#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ct4 n SER 2 N 0.00 1.16 0.06 1.61 2.88 -1.26 -4.84 113.62 113.23 2ct4 n SER 2 Ca 0.00 1.11 -0.13 0.00 -1.33 0.00 0.00 58.87 58.52 2ct4 n SER 2 Cb 0.00 -0.89 -0.08 0.00 -0.75 0.00 0.00 64.21 62.49 2ct4 n SER 2 CO 0.00 0.00 0.00 -1.28 -1.23 0.00 0.00 175.04 172.53 2ct4 h SER 3 N 5.65 -0.10 -3.32 -3.46 0.87 -2.06 -3.39 113.55 107.74 2ct4 h SER 3 Ca -0.39 -0.20 -0.73 0.00 -1.23 0.00 0.00 61.79 59.24 2ct4 h SER 3 Cb 1.38 0.03 -0.27 0.00 -0.44 0.00 0.00 62.40 63.10 2ct4 h SER 3 CO 1.00 0.14 -0.38 -0.83 -0.53 0.00 0.00 176.83 176.23 2ct4 s GLY 4 N -2.61 2.02 -0.05 5.77 0.00 -1.26 -4.94 107.32 106.24 2ct4 s GLY 4 Ca -0.14 -2.32 -0.22 0.00 0.00 0.00 0.00 44.72 42.04 2ct4 s GLY 4 CO 0.64 1.07 0.91 1.76 0.00 0.00 0.00 173.10 177.48 2ct4 h SER 5 N 8.57 -0.16 -3.84 1.64 0.02 -1.99 -3.40 113.55 114.39 2ct4 h SER 5 Ca -0.25 -0.39 -0.71 0.00 -0.84 0.00 0.00 61.79 59.60 2ct4 h SER 5 Cb 1.09 0.04 -0.34 0.00 0.14 0.00 0.00 62.40 63.33 2ct4 h SER 5 CO 0.86 0.41 -0.38 -0.55 -1.14 0.00 0.00 176.83 176.03 2ct4 s SER 6 N -5.52 5.42 0.98 3.07 0.15 -1.26 -5.09 113.70 111.45 2ct4 s SER 6 Ca -0.13 -2.52 -0.16 0.00 0.70 0.00 0.00 55.95 53.84 2ct4 s SER 6 Cb 0.00 -1.90 0.08 0.00 -1.71 0.00 0.00 66.02 62.50 2ct4 s SER 6 CO 0.50 -0.47 -0.08 0.61 1.20 0.00 0.00 173.24 175.01 2ct4 n GLY 7 N 3.98 -2.41 3.89 9.45 0.00 -1.26 -4.96 105.19 113.88 2ct4 n GLY 7 Ca 0.04 -0.62 -0.34 0.00 0.00 0.00 0.00 46.02 45.10 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 -1.70 2.24 -0.36 -0.02 0.00 -1.25 -4.99 107.32 101.24 2ct4 s GLY 8 Ca 0.37 -0.60 -0.10 0.00 0.00 0.00 0.00 44.72 44.39 2ct4 s GLY 8 CO 0.43 -0.45 0.19 0.30 0.00 0.00 0.00 173.10 173.56 2ct4 s HIS 9 N -1.39 3.24 0.19 1.90 0.09 -1.26 -2.10 115.29 115.96 2ct4 s HIS 9 Ca 0.31 -1.03 0.09 0.00 -0.00 0.00 0.00 55.06 54.44 2ct4 s HIS 9 Cb -0.13 -2.41 -0.04 0.00 -0.00 0.00 0.00 32.58 30.00 2ct4 s HIS 9 CO 0.19 -0.65 -0.19 0.00 -0.00 0.00 0.00 174.74 174.09 2ct4 s VAL 11 N -2.17 0.57 0.11 0.00 -7.23 -1.18 -1.77 120.40 108.73 2ct4 s VAL 11 Ca 0.19 -0.14 -0.36 0.00 -1.81 0.00 0.00 61.98 59.86 2ct4 s VAL 11 Cb -0.05 -0.59 -0.17 0.00 0.56 0.00 0.00 36.38 36.13 2ct4 s VAL 11 CO 0.08 0.23 1.26 0.00 -0.31 0.00 0.00 175.10 176.36 2ct4 n ALA 12 N 4.02 -1.12 -0.04 1.32 0.00 -0.88 -2.97 120.51 120.84 2ct4 n ALA 12 Ca -0.25 0.51 -0.22 0.00 0.00 0.00 0.00 53.44 53.48 2ct4 n ALA 12 Cb 0.51 -2.04 -0.13 0.00 0.00 0.00 0.00 19.45 17.79 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 2.12 1.68 -4.26 0.00 5.41 -0.57 0.24 119.36 123.98 2ct4 n ILE 13 Ca 0.17 -0.43 -0.17 0.00 1.00 0.00 0.00 62.75 63.33 2ct4 n ILE 13 Cb 0.20 -1.84 -0.14 0.00 -0.71 0.00 0.00 39.64 37.15 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 -2.49 0.69 -0.33 1.39 2.02 -1.26 -4.57 117.35 112.80 2ct4 s TYR 14 Ca -0.25 -0.17 -0.39 0.00 -0.37 0.00 0.00 57.07 55.88 2ct4 s TYR 14 Cb 0.07 -0.44 -0.15 0.00 -0.40 0.00 0.00 41.96 41.04 2ct4 s TYR 14 CO 0.69 -0.01 1.95 1.58 -1.57 0.00 0.00 175.55 178.19 2ct4 n HIS 15 N 2.70 1.79 -4.69 2.71 -0.00 -1.26 -4.73 115.22 111.74 2ct4 n HIS 15 Ca -0.14 0.48 -0.32 0.00 0.46 0.00 0.00 57.72 58.19 2ct4 n HIS 15 Cb 0.57 -2.46 -0.17 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 5.17 2.67 -0.42 1.57 2.19 -1.08 -5.01 117.98 123.06 2ct4 s PHE 16 Ca 1.05 -1.34 -0.05 0.00 0.33 0.00 0.00 56.93 56.92 2ct4 s PHE 16 Cb -1.06 -1.81 0.11 0.00 -1.31 0.00 0.00 43.02 38.95 2ct4 s PHE 16 CO 0.60 -0.61 0.24 -2.00 1.83 0.00 0.00 175.22 175.28 2ct4 s GLU 17 N 0.80 2.23 0.08 10.12 2.56 -1.26 -0.84 118.70 132.38 2ct4 s GLU 17 Ca -0.07 -1.73 -0.33 0.00 0.00 0.00 0.00 54.97 52.84 2ct4 s GLU 17 Cb -0.16 -3.68 -0.12 0.00 2.00 0.00 0.00 34.13 32.18 2ct4 s GLU 17 CO -0.02 -1.07 1.78 0.41 -0.56 0.00 0.00 175.26 175.81 2ct4 n GLY 18 N 4.72 1.48 1.00 -1.50 0.00 -1.23 -4.86 105.19 104.81 2ct4 n GLY 18 Ca -0.05 0.74 -0.00 0.00 0.00 0.00 0.00 46.02 46.70 2ct4 n GLY 18 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2ct4 n SER 19 N 5.32 0.14 -4.16 1.61 3.41 -1.26 -4.79 113.62 113.88 2ct4 n SER 19 Ca 0.19 0.02 -0.32 0.00 -0.26 0.00 0.00 58.87 58.49 2ct4 n SER 19 Cb 0.33 -0.04 0.15 0.00 -0.26 0.00 0.00 64.21 64.38 2ct4 n SER 19 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2ct4 n SER 20 N -3.07 -2.54 -4.58 4.04 7.64 -1.26 -4.82 113.62 109.03 2ct4 n SER 20 Ca -0.01 -0.14 -0.42 0.00 1.01 0.00 0.00 58.87 59.32 2ct4 n SER 20 Cb 0.45 -0.85 -0.02 0.00 -1.01 0.00 0.00 64.21 62.78 2ct4 n SER 20 CO 0.00 0.00 0.00 -0.70 -3.01 0.00 0.00 175.04 171.33 2ct4 s GLU 21 N -3.18 3.44 0.00 1.43 2.56 -1.26 -3.53 118.70 118.16 2ct4 s GLU 21 Ca 0.51 0.35 0.00 0.00 0.00 0.00 0.00 54.97 55.82 2ct4 s GLU 21 Cb -0.07 -4.06 0.00 0.00 2.00 0.00 0.00 34.13 32.01 2ct4 s GLU 21 CO 0.63 -1.77 0.00 0.41 -0.56 0.00 0.00 175.26 173.97 2ct4 n GLY 22 N 5.14 0.95 3.37 -1.50 0.00 -1.26 -5.10 105.19 106.78 2ct4 n GLY 22 Ca 0.10 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.93 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 -1.87 1.43 0.06 2.61 -4.23 -1.23 -3.20 115.64 109.22 2ct4 s THR 23 Ca 0.00 -2.11 0.04 0.00 -1.18 0.00 0.00 61.69 58.44 2ct4 s THR 23 Cb 0.00 -2.30 -0.03 0.00 1.34 0.00 0.00 72.50 71.51 2ct4 s THR 23 CO 0.00 -0.40 -0.11 -0.51 -0.54 0.00 0.00 174.62 173.07 2ct4 s ILE 24 N -3.16 0.85 -0.01 2.99 2.07 -1.26 -4.78 121.20 117.91 2ct4 s ILE 24 Ca 0.27 -1.28 -0.02 0.00 -1.41 0.00 0.00 60.65 58.21 2ct4 s ILE 24 Cb 0.03 -0.94 -0.04 0.00 0.13 0.00 0.00 42.46 41.64 2ct4 s ILE 24 CO 0.09 -0.35 0.16 -0.94 -1.91 0.00 0.00 174.94 171.99 2ct4 s SER 25 N -1.81 6.21 0.10 4.50 1.04 -1.26 -3.47 113.70 119.01 2ct4 s SER 25 Ca -0.04 0.30 0.02 0.00 0.48 0.00 0.00 55.95 56.71 2ct4 s SER 25 Cb -0.09 -1.92 -0.04 0.00 0.10 0.00 0.00 66.02 64.07 2ct4 s SER 25 CO 0.01 0.27 -0.07 0.00 0.98 0.00 0.00 173.24 174.43 2ct4 s MET 26 N -1.89 0.83 0.19 4.02 0.23 -0.02 -4.92 119.30 117.73 2ct4 s MET 26 Ca 0.26 -1.31 0.00 0.00 -1.03 0.00 0.00 55.69 53.62 2ct4 s MET 26 Cb -0.12 -0.24 -0.04 0.00 -1.53 0.00 0.00 34.83 32.89 2ct4 s MET 26 CO 0.18 -0.01 0.36 0.00 -2.03 0.00 0.00 175.02 173.52 2ct4 s ALA 27 N -3.46 3.87 -0.23 3.16 0.00 -1.26 -2.64 121.76 121.20 2ct4 s ALA 27 Ca 0.11 -0.89 -0.29 0.00 0.00 0.00 0.00 51.96 50.89 2ct4 s ALA 27 Cb 0.04 -1.93 -0.04 0.00 0.00 0.00 0.00 23.12 21.19 2ct4 s ALA 27 CO -0.04 0.46 1.88 -2.00 0.00 0.00 0.00 175.76 176.06 2ct4 s GLU 28 N -3.30 3.49 0.00 0.00 2.12 -1.26 -2.32 118.70 117.44 2ct4 s GLU 28 Ca 0.37 1.78 0.00 0.00 0.36 0.00 0.00 54.97 57.48 2ct4 s GLU 28 Cb -0.11 -4.19 0.00 0.00 0.26 0.00 0.00 34.13 30.09 2ct4 s GLU 28 CO 0.29 -1.67 0.00 0.41 -0.54 0.00 0.00 175.26 173.75 2ct4 n GLY 29 N 5.21 0.85 3.64 -1.50 0.00 0.14 -4.99 105.19 108.54 2ct4 n GLY 29 Ca 0.23 -0.69 -0.35 0.00 0.00 0.00 0.00 46.02 45.22 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 -4.52 3.36 0.16 1.61 2.12 -0.98 -4.86 118.70 115.60 2ct4 s GLU 30 Ca 0.00 -0.40 -0.30 0.00 0.36 0.00 0.00 54.97 54.63 2ct4 s GLU 30 Cb 0.00 -2.93 -0.08 0.00 0.26 0.00 0.00 34.13 31.39 2ct4 s GLU 30 CO 0.00 0.52 1.21 0.16 -0.54 0.00 0.00 175.26 176.61 2ct4 s ASP 31 N -0.37 7.07 0.18 -1.70 -4.77 -1.26 -2.07 116.67 113.75 2ct4 s ASP 31 Ca 0.08 2.21 0.02 0.00 -3.30 0.00 0.00 52.55 51.56 2ct4 s ASP 31 Cb -0.12 -2.60 -0.05 0.00 -1.09 0.00 0.00 42.92 39.06 2ct4 s ASP 31 CO 0.02 -0.40 -0.01 -0.76 0.70 0.00 0.00 175.17 174.72 2ct4 s LEU 32 N 0.04 2.17 -0.42 2.11 1.43 -0.73 -4.82 118.68 118.46 2ct4 s LEU 32 Ca 0.54 -1.17 -0.10 0.00 -1.03 0.00 0.00 54.13 52.38 2ct4 s LEU 32 Cb -0.32 -0.13 0.08 0.00 0.03 0.00 0.00 46.19 45.84 2ct4 s LEU 32 CO 0.35 -0.53 0.28 -0.44 0.23 0.00 0.00 176.35 176.24 2ct4 s SER 33 N -3.20 5.71 -0.35 2.29 0.01 -0.27 -3.83 113.70 114.05 2ct4 s SER 33 Ca 0.24 -1.47 -0.27 0.00 1.31 0.00 0.00 55.95 55.76 2ct4 s SER 33 Cb 0.06 -2.01 -0.05 0.00 0.21 0.00 0.00 66.02 64.22 2ct4 s SER 33 CO 0.05 -0.55 2.21 -0.22 0.41 0.00 0.00 173.24 175.14 2ct4 s LEU 34 N 1.46 3.42 -0.18 2.44 1.98 -0.89 -0.71 118.68 126.21 2ct4 s LEU 34 Ca 0.03 1.46 -0.14 0.00 -2.89 0.00 0.00 54.13 52.59 2ct4 s LEU 34 Cb -0.23 -3.12 -0.09 0.00 0.66 0.00 0.00 46.19 43.41 2ct4 s LEU 34 CO 0.03 -2.27 -0.11 0.23 -1.89 0.00 0.00 176.35 172.35 2ct4 n MET 35 N 8.83 0.50 -4.62 1.98 2.81 -0.89 -3.96 117.12 121.78 2ct4 n MET 35 Ca 0.31 0.48 -0.31 0.00 -1.81 0.00 0.00 57.70 56.37 2ct4 n MET 35 Cb 0.49 -1.66 -0.13 0.00 -0.71 0.00 0.00 33.22 31.21 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 -2.38 2.01 0.10 0.03 0.41 -1.03 -5.03 118.70 112.82 2ct4 s GLU 36 Ca -0.22 -1.02 0.02 0.00 -0.41 0.00 0.00 54.97 53.34 2ct4 s GLU 36 Cb 0.04 -2.17 -0.04 0.00 -1.78 0.00 0.00 34.13 30.19 2ct4 s GLU 36 CO 0.37 0.53 0.20 -1.21 -0.49 0.00 0.00 175.26 174.66 2ct4 s GLU 37 N -1.52 3.28 -0.21 1.61 2.02 -1.26 -3.03 118.70 119.58 2ct4 s GLU 37 Ca 0.15 -0.59 -0.16 0.00 0.02 0.00 0.00 54.97 54.39 2ct4 s GLU 37 Cb -0.10 -2.91 -0.04 0.00 0.10 0.00 0.00 34.13 31.17 2ct4 s GLU 37 CO 0.06 0.56 0.40 0.16 0.02 0.00 0.00 175.26 176.45 2ct4 s ASP 38 N -2.79 6.41 -0.56 -0.19 -4.77 -1.25 -4.90 116.67 108.62 2ct4 s ASP 38 Ca 0.33 0.48 -0.06 0.00 -3.30 0.00 0.00 52.55 50.00 2ct4 s ASP 38 Cb -0.12 -2.23 0.14 0.00 -1.09 0.00 0.00 42.92 39.63 2ct4 s ASP 38 CO 0.27 -0.10 0.40 -1.59 0.70 0.00 0.00 175.17 174.85 2ct4 s LYS 39 N 1.46 2.56 -0.97 2.11 -2.85 -1.26 -4.63 119.74 116.16 2ct4 s LYS 39 Ca 0.19 -2.12 0.00 0.00 -1.00 0.00 0.00 55.97 53.03 2ct4 s LYS 39 Cb -0.15 -3.86 0.00 0.00 -2.06 0.00 0.00 37.83 31.76 2ct4 s LYS 39 CO 0.08 -1.18 0.00 0.41 0.10 0.00 0.00 175.35 174.76 2ct4 n GLY 40 N 4.25 0.87 0.08 0.59 0.00 -1.26 -4.75 105.19 104.97 2ct4 n GLY 40 Ca 0.01 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.92 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 -1.01 2.44 0.00 1.61 8.00 -1.26 -5.02 116.55 121.32 2ct4 n ASP 41 Ca -0.09 -0.08 0.00 0.00 0.71 0.00 0.00 54.79 55.33 2ct4 n ASP 41 Cb 0.56 -0.07 0.00 0.00 -0.02 0.00 0.00 41.12 41.59 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 2.57 0.72 3.43 0.44 0.00 -1.26 -5.04 105.19 106.05 2ct4 n GLY 42 Ca -0.29 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.35 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 -2.82 3.13 -0.09 1.61 0.52 -1.26 -0.42 118.94 119.61 2ct4 s TRP 43 Ca 0.00 -0.53 0.04 0.00 0.02 0.00 0.00 56.10 55.63 2ct4 s TRP 43 Cb 0.00 -2.28 -0.00 0.00 -1.15 0.00 0.00 33.47 30.03 2ct4 s TRP 43 CO 0.00 -0.41 -0.23 0.99 0.02 0.00 0.00 176.95 177.31 2ct4 s THR 44 N 1.60 1.97 -0.13 2.01 2.01 0.72 -3.78 115.64 120.04 2ct4 s THR 44 Ca 0.05 -0.98 -0.11 0.00 0.31 0.00 0.00 61.69 60.97 2ct4 s THR 44 Cb -0.16 -1.69 -0.05 0.00 0.01 0.00 0.00 72.50 70.61 2ct4 s THR 44 CO 0.05 0.54 0.22 -0.60 -0.69 0.00 0.00 174.62 174.14 2ct4 s ARG 45 N 0.24 3.92 0.11 4.92 3.52 -1.17 0.07 118.95 130.57 2ct4 s ARG 45 Ca -0.15 -0.00 0.03 0.00 -0.13 0.00 0.00 55.73 55.49 2ct4 s ARG 45 Cb -0.17 -3.32 -0.04 0.00 -1.56 0.00 0.00 34.95 29.87 2ct4 s ARG 45 CO 0.07 0.50 -0.09 0.14 -0.81 0.00 0.00 175.30 175.11 2ct4 s VAL 46 N -0.28 0.95 -0.05 7.11 -7.23 -1.18 -2.09 120.40 117.63 2ct4 s VAL 46 Ca 0.15 -1.86 0.02 0.00 -1.81 0.00 0.00 61.98 58.48 2ct4 s VAL 46 Cb -0.13 -1.61 -0.03 0.00 0.56 0.00 0.00 36.38 35.17 2ct4 s VAL 46 CO 0.04 -0.71 -0.07 -0.60 -0.31 0.00 0.00 175.10 173.45 2ct4 s ARG 47 N -3.39 2.68 0.31 4.82 3.52 0.12 -3.38 118.95 123.63 2ct4 s ARG 47 Ca 0.11 -0.60 0.07 0.00 -0.13 0.00 0.00 55.73 55.18 2ct4 s ARG 47 Cb 0.01 -2.56 -0.03 0.00 -1.56 0.00 0.00 34.95 30.81 2ct4 s ARG 47 CO -0.01 0.65 0.28 1.03 -0.81 0.00 0.00 175.30 176.44 2ct4 s ARG 48 N -0.99 2.82 0.45 5.12 0.52 0.40 -1.11 118.95 126.14 2ct4 s ARG 48 Ca 0.14 -1.20 0.21 0.00 -0.52 0.00 0.00 55.73 54.36 2ct4 s ARG 48 Cb -0.11 -2.53 1.06 0.00 0.52 0.00 0.00 34.95 33.88 2ct4 s ARG 48 CO 0.03 0.18 1.92 -0.22 0.02 0.00 0.00 175.30 177.23 2ct4 h LYS 49 N 1.28 0.00 -1.10 3.54 3.64 -1.88 -2.60 116.57 119.46 2ct4 h LYS 49 Ca -0.46 0.00 -0.34 0.00 -1.27 0.00 0.00 60.65 58.58 2ct4 h LYS 49 Cb 1.25 0.00 -0.18 0.00 -0.41 0.00 0.00 32.23 32.88 2ct4 h LYS 49 CO 0.59 0.24 0.43 0.39 -2.27 0.00 0.00 179.45 178.83 2ct4 n GLU 50 N -3.75 1.82 -2.64 1.90 -0.58 -1.26 -4.83 120.64 111.30 2ct4 n GLU 50 Ca -0.01 -1.86 -0.20 0.00 -0.42 0.00 0.00 57.16 54.66 2ct4 n GLU 50 Cb 0.34 -1.73 0.00 0.00 -0.57 0.00 0.00 31.44 29.49 2ct4 n GLU 50 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2ct4 n GLY 51 N -0.37 -0.51 3.43 0.62 0.00 -0.98 -4.94 105.19 102.44 2ct4 n GLY 51 Ca 0.37 0.04 -0.44 0.00 0.00 0.00 0.00 46.02 45.99 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 -2.27 2.00 0.17 -0.02 0.00 -1.24 -4.88 107.32 101.07 2ct4 s GLY 52 Ca 0.11 -1.87 0.11 0.00 0.00 0.00 0.00 44.72 43.07 2ct4 s GLY 52 CO 0.13 1.02 -0.25 -0.54 0.00 0.00 0.00 173.10 173.47 2ct4 s GLU 53 N 1.75 1.46 0.00 2.90 8.01 -1.26 -0.46 118.70 131.10 2ct4 s GLU 53 Ca 0.06 -1.45 0.00 0.00 0.01 0.00 0.00 54.97 53.59 2ct4 s GLU 53 Cb -0.21 -1.85 0.00 0.00 -4.31 0.00 0.00 34.13 27.76 2ct4 s GLU 53 CO 0.09 0.42 0.00 0.41 0.01 0.00 0.00 175.26 176.19 2ct4 n GLY 54 N 0.54 1.92 3.65 -1.39 0.00 -1.22 -4.57 105.19 104.12 2ct4 n GLY 54 Ca -0.15 -0.84 -0.43 0.00 0.00 0.00 0.00 46.02 44.60 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 -2.00 3.13 0.16 1.61 2.02 -1.19 -3.10 117.35 117.98 2ct4 s TYR 55 Ca 0.00 1.24 0.09 0.00 -0.37 0.00 0.00 57.07 58.03 2ct4 s TYR 55 Cb 0.00 -3.52 -0.04 0.00 -0.40 0.00 0.00 41.96 38.00 2ct4 s TYR 55 CO 0.00 -0.89 -0.12 0.14 -1.57 0.00 0.00 175.55 173.11 2ct4 s VAL 56 N 3.52 3.13 -0.13 0.71 -7.23 0.11 -4.09 120.40 116.43 2ct4 s VAL 56 Ca 0.47 -1.59 -0.29 0.00 -1.81 0.00 0.00 61.98 58.76 2ct4 s VAL 56 Cb -0.15 -2.52 -0.04 0.00 0.56 0.00 0.00 36.38 34.23 2ct4 s VAL 56 CO 0.12 -0.04 1.54 -2.16 -0.31 0.00 0.00 175.10 174.25 2ct4 s PRO 57 N -2.62 4.09 0.41 4.82 0.04 -1.26 -0.20 135.00 140.28 2ct4 s PRO 57 Ca 0.23 1.92 0.16 0.00 0.04 0.00 0.00 61.00 63.35 2ct4 s PRO 57 Cb -0.09 -3.94 1.04 0.00 0.04 0.00 0.00 34.50 31.55 2ct4 s PRO 57 CO 0.14 -0.93 1.87 1.15 0.04 0.00 0.00 177.00 179.27 2ct4 h THR 58 N 5.70 0.72 -0.07 1.26 2.02 -1.05 0.25 112.91 121.74 2ct4 h THR 58 Ca -0.35 -0.15 0.02 0.00 0.77 0.00 0.00 66.41 66.70 2ct4 h THR 58 Cb 1.15 0.24 -0.00 0.00 -1.74 0.00 0.00 68.15 67.80 2ct4 h THR 58 CO 0.97 0.08 0.25 0.28 0.37 0.00 0.00 175.52 177.47 2ct4 h SER 59 N 0.44 0.00 -0.66 4.18 0.02 -1.91 0.32 113.55 115.95 2ct4 h SER 59 Ca 0.45 0.00 -0.29 0.00 -0.84 0.00 0.00 61.79 61.10 2ct4 h SER 59 Cb 1.05 0.00 -0.17 0.00 0.14 0.00 0.00 62.40 63.41 2ct4 h SER 59 CO -0.17 0.00 0.26 -1.22 -1.14 0.00 0.00 176.83 174.56 2ct4 n TYR 60 N -3.16 2.07 -4.22 3.45 4.02 0.87 -4.93 117.16 115.27 2ct4 n TYR 60 Ca -0.01 -1.55 -0.19 0.00 -0.01 0.00 0.00 57.90 56.14 2ct4 n TYR 60 Cb 0.33 -0.68 -0.16 0.00 -0.02 0.00 0.00 39.34 38.81 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 -3.18 1.53 -0.24 7.72 1.43 0.11 -1.52 118.68 124.54 2ct4 s LEU 61 Ca 0.51 -0.14 0.02 0.00 -1.03 0.00 0.00 54.13 53.50 2ct4 s LEU 61 Cb 0.43 -0.44 0.05 0.00 0.03 0.00 0.00 46.19 46.26 2ct4 s LEU 61 CO 0.07 -0.01 -0.12 -0.60 0.23 0.00 0.00 176.35 175.92 2ct4 s ARG 62 N 0.60 2.33 -0.09 1.70 3.52 -1.16 -4.93 118.95 120.91 2ct4 s ARG 62 Ca -0.08 -1.19 -0.30 0.00 -0.13 0.00 0.00 55.73 54.03 2ct4 s ARG 62 Cb -0.12 -2.77 -0.08 0.00 -1.56 0.00 0.00 34.95 30.42 2ct4 s ARG 62 CO 0.00 -0.49 2.06 0.28 -0.81 0.00 0.00 175.30 176.34 2ct4 n VAL 63 N 4.50 0.57 -0.65 7.11 0.31 -1.26 -3.09 118.33 125.81 2ct4 n VAL 63 Ca -0.15 -0.25 -0.31 0.00 -0.01 0.00 0.00 64.34 63.62 2ct4 n VAL 63 Cb 0.44 -2.28 0.18 0.00 -0.91 0.00 0.00 33.84 31.27 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 6.31 0.00 -2.78 2.52 -2.24 -0.57 -4.93 114.28 112.59 2ct4 n THR 64 Ca 0.25 -0.21 -0.42 0.00 -2.27 0.00 0.00 64.05 61.40 2ct4 n THR 64 Cb 0.39 -0.83 -0.03 0.00 -2.10 0.00 0.00 70.33 67.75 2ct4 n THR 64 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2ct4 s SER 65 N -2.28 7.25 0.46 3.42 1.04 -1.26 -4.98 113.70 117.35 2ct4 s SER 65 Ca 0.63 1.52 -0.23 0.00 0.48 0.00 0.00 55.95 58.35 2ct4 s SER 65 Cb -0.21 -2.53 -0.07 0.00 0.10 0.00 0.00 66.02 63.30 2ct4 s SER 65 CO 0.64 -0.28 1.15 -0.83 0.98 0.00 0.00 173.24 174.89 2ct4 s GLY 66 N 1.00 2.75 0.00 7.32 0.00 -1.26 -4.91 107.32 112.22 2ct4 s GLY 66 Ca 0.48 0.89 0.14 0.00 0.00 0.00 0.00 44.72 46.24 2ct4 s GLY 66 CO 0.23 1.33 1.43 -1.55 0.00 0.00 0.00 173.10 174.55 2ct4 n PRO 67 N -0.53 0.08 -3.37 2.90 -0.04 -1.26 -4.66 135.00 128.13 2ct4 n PRO 67 Ca 0.07 0.21 -0.38 0.00 -0.04 0.00 0.00 63.50 63.36 2ct4 n PRO 67 Cb 0.49 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.37 2ct4 n PRO 67 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 2ct4 s SER 68 N -2.83 6.46 -0.12 3.54 0.01 -1.26 -4.94 113.70 114.56 2ct4 s SER 68 Ca 0.10 0.54 -0.02 0.00 1.31 0.00 0.00 55.95 57.88 2ct4 s SER 68 Cb 0.10 -2.24 -0.07 0.00 0.21 0.00 0.00 66.02 64.02 2ct4 s SER 68 CO 0.25 -0.09 -0.12 -0.24 0.41 0.00 0.00 173.24 173.45 2ct4 n SER 69 N 4.48 2.34 -0.30 2.44 2.88 -1.26 -5.19 113.62 119.00 2ct4 n SER 69 Ca -0.08 0.01 0.15 0.00 -1.33 0.00 0.00 58.87 57.62 2ct4 n SER 69 Cb 0.51 -0.24 0.68 0.00 -0.75 0.00 0.00 64.21 64.41 2ct4 n SER 69 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42