#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ct7 s SER 2 N 0.00 -0.15 0.25 1.61 0.15 -1.26 -5.19 113.70 109.11 2ct7 s SER 2 Ca 0.00 -0.10 -0.11 0.00 0.70 0.00 0.00 55.95 56.44 2ct7 s SER 2 Cb 0.00 0.23 -0.01 0.00 -1.71 0.00 0.00 66.02 64.53 2ct7 s SER 2 CO 0.00 -0.40 0.45 -0.94 1.20 0.00 0.00 173.24 173.55 2ct7 s SER 3 N -2.60 -0.03 0.00 5.45 1.04 -1.26 -5.18 113.70 111.12 2ct7 s SER 3 Ca 0.11 -0.99 0.00 0.00 0.48 0.00 0.00 55.95 55.54 2ct7 s SER 3 Cb 0.01 0.57 0.00 0.00 0.10 0.00 0.00 66.02 66.70 2ct7 s SER 3 CO -0.04 -1.12 0.00 0.61 0.98 0.00 0.00 173.24 173.67 2ct7 n GLY 4 N -0.38 5.36 3.43 7.32 0.00 -1.26 -5.19 105.19 114.47 2ct7 n GLY 4 Ca -0.01 -1.31 -0.10 0.00 0.00 0.00 0.00 46.02 44.60 2ct7 n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2ct7 s SER 5 N 1.00 -0.02 -0.23 1.61 1.04 -1.26 -5.15 113.70 110.69 2ct7 s SER 5 Ca 0.00 -0.93 -0.03 0.00 0.48 0.00 0.00 55.95 55.47 2ct7 s SER 5 Cb 0.00 0.50 0.11 0.00 0.10 0.00 0.00 66.02 66.73 2ct7 s SER 5 CO 0.00 -0.99 0.27 -0.44 0.98 0.00 0.00 173.24 173.06 2ct7 s SER 6 N -3.00 1.16 0.53 7.02 0.01 -1.26 -5.15 113.70 113.01 2ct7 s SER 6 Ca 0.21 -0.20 -0.09 0.00 1.31 0.00 0.00 55.95 57.18 2ct7 s SER 6 Cb 0.02 0.58 -0.04 0.00 0.21 0.00 0.00 66.02 66.78 2ct7 s SER 6 CO 0.05 -0.33 0.90 -0.83 0.41 0.00 0.00 173.24 173.44 2ct7 s GLY 7 N 2.38 1.65 -0.30 3.44 0.00 -1.26 -5.08 107.32 108.16 2ct7 s GLY 7 Ca 0.09 -0.25 -0.07 0.00 0.00 0.00 0.00 44.72 44.49 2ct7 s GLY 7 CO -0.16 -0.03 0.75 0.00 0.00 0.00 0.00 173.10 173.66 2ct7 s ALA 8 N -2.88 -2.54 0.11 3.20 0.00 -1.26 -5.14 121.76 113.25 2ct7 s ALA 8 Ca 0.52 1.85 -0.34 0.00 0.00 0.00 0.00 51.96 53.98 2ct7 s ALA 8 Cb -0.11 -2.18 -0.18 0.00 0.00 0.00 0.00 23.12 20.66 2ct7 s ALA 8 CO 0.46 -1.26 0.92 -0.11 0.00 0.00 0.00 175.76 175.78 2ct7 n LEU 9 N 5.40 -0.00 -0.28 0.00 0.00 -1.26 -4.78 117.00 116.08 2ct7 n LEU 9 Ca -0.05 1.15 -0.06 0.00 0.00 0.00 0.00 56.01 57.04 2ct7 n LEU 9 Cb 0.51 -1.01 -0.05 0.00 0.00 0.00 0.00 43.42 42.87 2ct7 n LEU 9 CO -0.02 -2.09 0.33 2.22 0.00 0.00 0.00 177.39 177.83 2ct7 n PHE 10 N 1.04 -0.25 -2.39 1.96 -1.74 -1.26 -4.41 117.46 110.41 2ct7 n PHE 10 Ca 0.18 0.83 -0.25 0.00 -0.56 0.00 0.00 57.45 57.66 2ct7 n PHE 10 Cb 0.18 -0.58 0.10 0.00 1.52 0.00 0.00 39.48 40.69 2ct7 n PHE 10 CO 0.00 0.00 0.00 -1.58 -0.56 0.00 0.00 176.76 174.62 2ct7 s HIS 11 N -5.37 2.17 0.00 2.97 2.46 -1.26 -4.94 115.29 111.32 2ct7 s HIS 11 Ca -0.08 0.06 -0.04 0.00 0.47 0.00 0.00 55.06 55.47 2ct7 s HIS 11 Cb 0.08 -3.18 -0.16 0.00 -0.13 0.00 0.00 32.58 29.19 2ct7 s HIS 11 CO 0.42 -1.63 2.83 1.63 -2.47 0.00 0.00 174.74 175.53 2ct7 n LYS 12 N -2.92 1.51 -3.37 2.88 4.76 -1.26 -4.76 118.16 115.01 2ct7 n LYS 12 Ca 0.12 -0.59 -0.46 0.00 -2.87 0.00 0.00 58.31 54.51 2ct7 n LYS 12 Cb 0.60 -1.62 -0.03 0.00 -1.84 0.00 0.00 35.03 32.14 2ct7 n LYS 12 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 2ct7 s LYS 13 N 0.78 3.41 0.10 1.97 2.47 -1.26 -5.03 119.74 122.18 2ct7 s LYS 13 Ca 0.39 -2.36 0.03 0.00 -1.56 0.00 0.00 55.97 52.48 2ct7 s LYS 13 Cb 0.19 -4.34 -0.04 0.00 -1.46 0.00 0.00 37.83 32.18 2ct7 s LYS 13 CO 0.00 -1.28 -0.09 -0.51 0.16 0.00 0.00 175.35 173.62 2ct7 s LEU 14 N 0.35 2.42 0.00 5.43 1.43 -1.26 -4.76 118.68 122.29 2ct7 s LEU 14 Ca 0.16 -0.84 -0.03 0.00 -1.03 0.00 0.00 54.13 52.39 2ct7 s LEU 14 Cb -0.14 -0.26 -0.13 0.00 0.03 0.00 0.00 46.19 45.69 2ct7 s LEU 14 CO -0.07 -0.30 2.68 1.07 0.23 0.00 0.00 176.35 179.97 2ct7 n THR 15 N 0.47 2.36 -3.05 5.49 5.66 -1.26 -4.86 114.28 119.09 2ct7 n THR 15 Ca -0.15 -0.96 -0.41 0.00 -3.05 0.00 0.00 64.05 59.48 2ct7 n THR 15 Cb 0.58 -1.73 -0.06 0.00 -1.55 0.00 0.00 70.33 67.57 2ct7 n THR 15 CO 0.00 0.00 0.00 -0.70 -3.05 0.00 0.00 175.07 171.32 2ct7 s GLU 16 N 0.65 4.02 -0.77 1.09 2.12 -1.26 -4.00 118.70 120.54 2ct7 s GLU 16 Ca 0.33 0.51 -0.05 0.00 0.36 0.00 0.00 54.97 56.12 2ct7 s GLU 16 Cb 0.16 -3.69 0.01 0.00 0.26 0.00 0.00 34.13 30.86 2ct7 s GLU 16 CO 0.00 -0.53 0.67 0.41 -0.54 0.00 0.00 175.26 175.27 2ct7 n GLY 17 N 4.22 0.10 0.14 -1.50 0.00 -1.26 -4.95 105.19 101.93 2ct7 n GLY 17 Ca 0.01 -0.15 -0.21 0.00 0.00 0.00 0.00 46.02 45.67 2ct7 n GLY 17 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2ct7 n VAL 18 N -3.93 1.70 -1.73 1.61 0.31 -1.26 -4.81 118.33 110.22 2ct7 n VAL 18 Ca 0.00 -0.59 -0.38 0.00 -0.01 0.00 0.00 64.34 63.36 2ct7 n VAL 18 Cb 0.53 -1.69 -0.03 0.00 -0.91 0.00 0.00 33.84 31.74 2ct7 n VAL 18 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 2ct7 s LEU 19 N -7.00 3.39 -0.60 7.52 1.02 -1.26 -4.88 118.68 116.87 2ct7 s LEU 19 Ca -0.26 1.00 0.05 0.00 0.02 0.00 0.00 54.13 54.94 2ct7 s LEU 19 Cb 0.07 -2.71 0.18 0.00 0.02 0.00 0.00 46.19 43.75 2ct7 s LEU 19 CO 0.72 -2.55 0.48 1.15 0.02 0.00 0.00 176.35 176.16 2ct7 n MET 20 N 8.98 1.36 -3.87 1.70 0.00 -1.26 -5.07 117.12 118.96 2ct7 n MET 20 Ca 0.31 -4.06 -0.11 0.00 0.00 0.00 0.00 57.70 53.83 2ct7 n MET 20 Cb 0.52 -2.05 -0.11 0.00 0.00 0.00 0.00 33.22 31.58 2ct7 n MET 20 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 175.97 176.47 2ct7 s ARG 21 N -1.11 0.30 -0.07 3.17 3.52 -1.26 -5.16 118.95 118.35 2ct7 s ARG 21 Ca 0.29 -0.18 0.04 0.00 -0.13 0.00 0.00 55.73 55.76 2ct7 s ARG 21 Cb 0.01 0.13 -0.00 0.00 -1.56 0.00 0.00 34.95 33.53 2ct7 s ARG 21 CO -0.16 -0.06 -0.20 0.16 -0.81 0.00 0.00 175.30 174.23 2ct7 s ASP 22 N -0.74 2.57 -0.02 -2.12 -4.77 -1.26 -5.06 116.67 105.28 2ct7 s ASP 22 Ca -0.08 -0.44 -0.17 0.00 -3.30 0.00 0.00 52.55 48.56 2ct7 s ASP 22 Cb -0.05 -0.97 -0.09 0.00 -1.09 0.00 0.00 42.92 40.72 2ct7 s ASP 22 CO 0.01 0.15 0.76 1.55 0.70 0.00 0.00 175.17 178.33 2ct7 h PRO 23 N 6.53 -0.58 -0.31 2.11 0.13 -2.04 -3.47 132.00 134.37 2ct7 h PRO 23 Ca -0.27 0.04 0.23 0.00 -0.87 0.00 0.00 66.00 65.13 2ct7 h PRO 23 Cb 1.20 0.13 -0.21 0.00 0.13 0.00 0.00 31.00 32.26 2ct7 h PRO 23 CO 0.47 -0.39 0.11 0.21 -0.23 0.00 0.00 178.00 178.18 2ct7 s LYS 24 N -3.56 0.18 -0.04 0.86 2.36 -1.26 -5.06 119.74 113.21 2ct7 s LYS 24 Ca -0.09 0.30 -0.30 0.00 -2.55 0.00 0.00 55.97 53.33 2ct7 s LYS 24 Cb 0.01 0.16 -0.05 0.00 -1.05 0.00 0.00 37.83 36.90 2ct7 s LYS 24 CO 0.26 -0.22 1.55 0.12 1.55 0.00 0.00 175.35 178.62 2ct7 s PHE 25 N 2.95 2.31 -0.07 4.03 5.36 -1.26 -4.29 117.98 127.02 2ct7 s PHE 25 Ca 0.03 0.43 -0.01 0.00 -0.96 0.00 0.00 56.93 56.42 2ct7 s PHE 25 Cb -0.09 -3.82 0.03 0.00 -0.34 0.00 0.00 43.02 38.80 2ct7 s PHE 25 CO -0.13 -3.30 -0.00 -1.17 -1.46 0.00 0.00 175.22 169.16 2ct7 s LEU 26 N 3.48 0.64 0.18 6.12 1.98 -0.90 -5.04 118.68 125.15 2ct7 s LEU 26 Ca 0.69 -0.10 -0.01 0.00 -2.89 0.00 0.00 54.13 51.82 2ct7 s LEU 26 Cb -0.32 -0.47 -0.04 0.00 0.66 0.00 0.00 46.19 46.02 2ct7 s LEU 26 CO 0.27 -0.19 0.10 -1.66 -1.89 0.00 0.00 176.35 172.98 2ct7 s TRP 27 N 1.94 1.08 -2.00 5.38 -2.14 -1.26 -3.48 118.94 118.47 2ct7 s TRP 27 Ca 0.05 -1.31 0.09 0.00 2.66 0.00 0.00 56.10 57.59 2ct7 s TRP 27 Cb -0.12 -0.56 0.56 0.00 -3.10 0.00 0.00 33.47 30.25 2ct7 s TRP 27 CO -0.05 -0.57 0.98 0.00 -2.66 0.00 0.00 176.95 174.65 2ct7 n ALA 29 N -0.90 -0.48 0.00 0.00 0.00 -1.26 -4.63 120.51 113.24 2ct7 n ALA 29 Ca 0.07 0.16 0.00 0.00 0.00 0.00 0.00 53.44 53.67 2ct7 n ALA 29 Cb 0.03 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.03 2ct7 n ALA 29 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 2ct7 n GLN 30 N -2.33 0.00 0.01 0.00 6.02 -1.26 -4.87 117.38 114.95 2ct7 n GLN 30 Ca -0.14 0.00 -0.02 0.00 -0.01 0.00 0.00 57.00 56.83 2ct7 n GLN 30 Cb 0.52 -0.29 -0.10 0.00 1.02 0.00 0.00 30.24 31.38 2ct7 n GLN 30 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2ct7 n SER 32 N -2.90 -5.42 -0.02 0.00 7.64 -1.26 -4.93 113.62 106.72 2ct7 n SER 32 Ca -0.12 -0.39 -0.12 0.00 1.01 0.00 0.00 58.87 59.25 2ct7 n SER 32 Cb 0.90 -4.06 -0.06 0.00 -1.01 0.00 0.00 64.21 59.98 2ct7 n SER 32 CO 0.00 0.00 0.00 0.15 -3.01 0.00 0.00 175.04 172.18 2ct7 h PHE 33 N -1.98 0.17 -1.58 1.43 3.57 -1.96 -3.49 116.94 113.10 2ct7 h PHE 33 Ca -0.44 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.04 2ct7 h PHE 33 Cb 1.29 -0.05 0.00 0.00 2.79 0.00 0.00 35.95 39.98 2ct7 h PHE 33 CO 0.40 0.30 0.00 0.41 -2.23 0.00 0.00 178.31 177.19 2ct7 n GLY 34 N -0.58 -1.47 3.14 2.40 0.00 -1.26 -5.13 105.19 102.28 2ct7 n GLY 34 Ca -0.06 -0.47 -0.12 0.00 0.00 0.00 0.00 46.02 45.37 2ct7 n GLY 34 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2ct7 s PHE 35 N -0.04 -0.08 0.38 1.61 -0.71 -1.23 -5.04 117.98 112.87 2ct7 s PHE 35 Ca 0.00 0.14 0.01 0.00 -1.04 0.00 0.00 56.93 56.04 2ct7 s PHE 35 Cb 0.00 0.02 -0.02 0.00 -1.21 0.00 0.00 43.02 41.81 2ct7 s PHE 35 CO 0.00 -0.27 0.58 0.42 -1.34 0.00 0.00 175.22 174.61 2ct7 s ILE 36 N -0.99 4.64 0.00 -4.49 -1.09 -1.26 -2.11 121.20 115.89 2ct7 s ILE 36 Ca -0.11 -0.53 0.00 0.00 -2.23 0.00 0.00 60.65 57.78 2ct7 s ILE 36 Cb -0.06 -3.69 0.00 0.00 -1.58 0.00 0.00 42.46 37.13 2ct7 s ILE 36 CO 0.02 -0.44 0.00 0.00 -1.23 0.00 0.00 174.94 173.29 2ct7 n TYR 37 N -1.87 0.00 -3.79 3.97 4.11 -1.26 -4.95 117.16 113.37 2ct7 n TYR 37 Ca -0.02 0.00 -0.26 0.00 -0.00 0.00 0.00 57.90 57.61 2ct7 n TYR 37 Cb 0.57 0.00 -0.07 0.00 -0.00 0.00 0.00 39.34 39.84 2ct7 n TYR 37 CO 0.00 0.00 0.00 -0.85 -0.00 0.00 0.00 176.86 176.01 2ct7 n GLU 38 N -1.92 -0.88 -4.43 -3.48 0.28 -1.26 -4.88 120.64 104.07 2ct7 n GLU 38 Ca 0.00 0.08 -0.25 0.00 -0.16 0.00 0.00 57.16 56.83 2ct7 n GLU 38 Cb 0.23 -2.98 -0.09 0.00 1.43 0.00 0.00 31.44 30.03 2ct7 n GLU 38 CO 0.00 0.00 0.00 1.03 -0.16 0.00 0.00 177.13 178.00 2ct7 s ARG 39 N -5.93 1.98 -0.71 3.44 0.52 -1.26 -5.05 118.95 111.94 2ct7 s ARG 39 Ca 0.26 -1.87 -0.01 0.00 -0.52 0.00 0.00 55.73 53.60 2ct7 s ARG 39 Cb -0.15 -1.82 0.40 0.00 0.52 0.00 0.00 34.95 33.90 2ct7 s ARG 39 CO 0.74 0.10 1.91 -0.85 0.02 0.00 0.00 175.30 177.21 2ct7 n GLU 40 N -0.92 2.84 -4.03 3.54 0.28 -1.26 -4.95 120.64 116.13 2ct7 n GLU 40 Ca -0.04 -3.55 -0.12 0.00 -0.16 0.00 0.00 57.16 53.28 2ct7 n GLU 40 Cb 0.63 -2.28 -0.04 0.00 1.43 0.00 0.00 31.44 31.19 2ct7 n GLU 40 CO 0.00 0.00 0.00 1.14 -0.16 0.00 0.00 177.13 178.11 2ct7 s GLN 41 N -3.91 1.85 0.00 3.44 1.03 -1.26 -5.05 119.66 115.76 2ct7 s GLN 41 Ca 0.57 -1.59 0.09 0.00 0.04 0.00 0.00 55.36 54.47 2ct7 s GLN 41 Cb 0.46 0.47 0.04 0.00 0.03 0.00 0.00 33.01 34.01 2ct7 s GLN 41 CO -0.22 -0.78 0.69 1.28 -2.54 0.00 0.00 175.29 173.73 2ct7 n LEU 42 N -0.51 1.47 -2.85 2.60 4.77 -1.26 -4.73 117.00 116.49 2ct7 n LEU 42 Ca -0.01 -0.90 -0.30 0.00 -0.03 0.00 0.00 56.01 54.77 2ct7 n LEU 42 Cb 0.61 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.63 2ct7 n LEU 42 CO 0.28 0.29 2.49 1.21 -1.33 0.00 0.00 177.39 180.33 2ct7 n GLU 43 N 0.17 3.20 -2.37 3.23 2.13 -1.26 -4.04 120.64 121.70 2ct7 n GLU 43 Ca 0.04 -2.08 -0.40 0.00 0.66 0.00 0.00 57.16 55.39 2ct7 n GLU 43 Cb 0.20 -2.45 -0.03 0.00 0.27 0.00 0.00 31.44 29.42 2ct7 n GLU 43 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2ct7 s ALA 44 N 0.79 3.37 -0.08 4.31 0.00 -1.24 -4.90 121.76 124.01 2ct7 s ALA 44 Ca 0.65 0.98 0.05 0.00 0.00 0.00 0.00 51.96 53.64 2ct7 s ALA 44 Cb 0.25 -3.37 -0.00 0.00 0.00 0.00 0.00 23.12 20.00 2ct7 s ALA 44 CO -0.07 -0.33 -0.24 0.99 0.00 0.00 0.00 175.76 176.12 2ct7 s THR 45 N -1.22 1.99 0.12 0.00 2.01 -1.26 -2.37 115.64 114.90 2ct7 s THR 45 Ca 0.48 -1.00 -0.30 0.00 0.31 0.00 0.00 61.69 61.18 2ct7 s THR 45 Cb -0.33 -1.71 -0.06 0.00 0.01 0.00 0.00 72.50 70.41 2ct7 s THR 45 CO 0.43 0.55 0.97 0.00 -0.69 0.00 0.00 174.62 175.87 2ct7 n PRO 47 N 2.74 0.13 -0.05 0.00 -0.04 -1.26 0.15 135.00 136.68 2ct7 n PRO 47 Ca 0.02 0.37 -0.10 0.00 -0.04 0.00 0.00 63.50 63.75 2ct7 n PRO 47 Cb 0.49 -1.75 -0.03 0.00 -0.04 0.00 0.00 33.50 32.16 2ct7 n PRO 47 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 2ct7 n GLN 48 N -2.00 0.26 0.09 0.54 7.27 -1.26 -4.73 117.38 117.54 2ct7 n GLN 48 Ca 0.02 0.11 -0.12 0.00 0.07 0.00 0.00 57.00 57.09 2ct7 n GLN 48 Cb 0.21 -0.95 -0.07 0.00 2.41 0.00 0.00 30.24 31.84 2ct7 n GLN 48 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 2ct7 n HIS 50 N -3.61 -0.99 -4.25 0.00 8.25 0.12 -4.93 115.22 109.81 2ct7 n HIS 50 Ca -0.05 0.10 -0.32 0.00 -0.26 0.00 0.00 57.72 57.19 2ct7 n HIS 50 Cb 0.90 -3.49 -0.09 0.00 1.12 0.00 0.00 29.99 28.43 2ct7 n HIS 50 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 2ct7 s GLN 51 N -4.99 2.64 -0.37 -0.41 -0.21 -1.26 -4.75 119.66 110.30 2ct7 s GLN 51 Ca 0.06 -0.72 -0.24 0.00 0.02 0.00 0.00 55.36 54.48 2ct7 s GLN 51 Cb -0.03 -2.58 0.01 0.00 1.00 0.00 0.00 33.01 31.41 2ct7 s GLN 51 CO 0.07 0.59 0.82 0.99 -2.12 0.00 0.00 175.29 175.64 2ct7 s THR 52 N -1.16 4.68 0.03 -0.19 2.01 -1.26 -3.17 115.64 116.60 2ct7 s THR 52 Ca 0.22 0.92 0.02 0.00 0.31 0.00 0.00 61.69 63.15 2ct7 s THR 52 Cb -0.11 -4.25 -0.02 0.00 0.01 0.00 0.00 72.50 68.12 2ct7 s THR 52 CO 0.13 -0.49 -0.07 0.72 -0.69 0.00 0.00 174.62 174.22 2ct7 s PHE 53 N 3.22 0.59 0.64 4.92 -0.71 -1.00 -1.85 117.98 123.80 2ct7 s PHE 53 Ca 0.33 -0.44 -0.18 0.00 -1.04 0.00 0.00 56.93 55.60 2ct7 s PHE 53 Cb -0.13 -0.36 -0.02 0.00 -1.21 0.00 0.00 43.02 41.30 2ct7 s PHE 53 CO 0.18 -0.08 1.13 0.00 -1.34 0.00 0.00 175.22 175.10 2ct7 n VAL 55 N -1.92 0.34 0.00 0.00 0.24 -1.26 -2.86 118.33 112.87 2ct7 n VAL 55 Ca 0.15 -0.46 0.00 0.00 -2.04 0.00 0.00 64.34 61.99 2ct7 n VAL 55 Cb 0.48 -0.11 0.00 0.00 -1.47 0.00 0.00 33.84 32.74 2ct7 n VAL 55 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 2ct7 n ARG 56 N -2.39 0.00 0.15 7.34 1.74 -1.26 -4.48 116.66 117.76 2ct7 n ARG 56 Ca -0.01 0.35 0.01 0.00 -0.77 0.00 0.00 57.85 57.43 2ct7 n ARG 56 Cb 0.53 -0.85 0.20 0.00 -1.02 0.00 0.00 32.46 31.32 2ct7 n ARG 56 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2ct7 n LYS 58 N -3.65 -2.79 -4.49 0.00 4.76 -1.14 -5.04 118.16 105.82 2ct7 n LYS 58 Ca -0.01 0.32 -0.23 0.00 -2.87 0.00 0.00 58.31 55.53 2ct7 n LYS 58 Cb 0.61 -3.80 -0.11 0.00 -1.84 0.00 0.00 35.03 29.90 2ct7 n LYS 58 CO 0.00 0.00 0.00 -0.98 -1.37 0.00 0.00 177.40 175.05 2ct7 s ARG 59 N -4.97 1.73 -0.21 1.97 1.70 -1.25 -4.73 118.95 113.18 2ct7 s ARG 59 Ca 0.10 -1.97 -0.34 0.00 -0.47 0.00 0.00 55.73 53.05 2ct7 s ARG 59 Cb -0.05 -1.01 -0.11 0.00 -0.57 0.00 0.00 34.95 33.21 2ct7 s ARG 59 CO 0.28 -0.18 2.02 0.94 -1.08 0.00 0.00 175.30 177.28 2ct7 n GLN 60 N -0.76 1.69 -1.94 3.89 7.27 -1.26 -0.86 117.38 125.41 2ct7 n GLN 60 Ca -0.03 0.56 -0.38 0.00 0.07 0.00 0.00 57.00 57.21 2ct7 n GLN 60 Cb 0.67 -2.62 0.02 0.00 2.41 0.00 0.00 30.24 30.72 2ct7 n GLN 60 CO 0.00 0.00 0.00 -0.46 0.07 0.00 0.00 177.06 176.67 2ct7 s TRP 61 N 5.68 2.52 -0.01 3.69 -0.11 -0.77 -4.78 118.94 125.17 2ct7 s TRP 61 Ca 1.00 1.41 0.01 0.00 1.22 0.00 0.00 56.10 59.73 2ct7 s TRP 61 Cb -0.73 -3.69 0.00 0.00 -1.50 0.00 0.00 33.47 27.55 2ct7 s TRP 61 CO 0.50 -2.45 -0.01 -2.00 -4.62 0.00 0.00 176.95 168.37 2ct7 s GLU 62 N -2.72 0.17 0.47 5.86 2.56 -1.26 -4.93 118.70 118.85 2ct7 s GLU 62 Ca 0.67 -0.04 0.33 0.00 0.00 0.00 0.00 54.97 55.93 2ct7 s GLU 62 Cb -0.37 -0.21 1.45 0.00 2.00 0.00 0.00 34.13 37.00 2ct7 s GLU 62 CO 0.45 0.01 1.67 0.93 -0.56 0.00 0.00 175.26 177.76 2ct7 h GLU 63 N 6.33 0.10 -0.30 4.30 5.08 -2.02 1.29 114.58 129.36 2ct7 h GLU 63 Ca -0.29 -0.01 -0.11 0.00 -1.00 0.00 0.00 59.36 57.95 2ct7 h GLU 63 Cb 1.19 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.40 2ct7 h GLU 63 CO 0.50 0.07 -0.27 1.96 -1.00 0.00 0.00 179.01 180.27 2ct7 h GLN 64 N 0.11 0.61 -0.69 2.33 1.08 -1.99 -2.89 115.11 113.66 2ct7 h GLN 64 Ca 0.76 -0.25 0.03 0.00 -1.45 0.00 0.00 58.65 57.74 2ct7 h GLN 64 Cb 2.56 -0.02 -0.04 0.00 -0.05 0.00 0.00 27.48 29.92 2ct7 h GLN 64 CO -0.26 0.82 0.45 1.25 -0.95 0.00 0.00 178.83 180.14 2ct7 h HIS 65 N 0.53 0.81 -0.64 2.96 2.76 0.14 -2.81 115.15 118.89 2ct7 h HIS 65 Ca 0.07 0.02 0.10 0.00 -2.20 0.00 0.00 60.37 58.36 2ct7 h HIS 65 Cb 0.74 -0.27 -0.12 0.00 1.55 0.00 0.00 27.41 29.31 2ct7 h HIS 65 CO 0.03 0.48 -0.39 0.00 -1.30 0.00 0.00 177.93 176.75 2ct7 h ARG 66 N 0.85 -0.16 -0.90 5.26 3.08 -1.36 0.43 114.38 121.57 2ct7 h ARG 66 Ca 0.27 0.01 -0.18 0.00 0.07 0.00 0.00 59.98 60.15 2ct7 h ARG 66 Cb 0.02 0.04 -0.11 0.00 0.08 0.00 0.00 29.97 30.00 2ct7 h ARG 66 CO -0.07 -0.11 0.23 0.41 -1.07 0.00 0.00 179.97 179.36 2ct7 n GLY 67 N -1.42 3.00 3.57 0.04 0.00 -1.07 -4.90 105.19 104.41 2ct7 n GLY 67 Ca 0.04 -0.59 -0.12 0.00 0.00 0.00 0.00 46.02 45.35 2ct7 n GLY 67 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2ct7 s ARG 68 N -1.96 1.84 0.48 1.61 0.52 0.15 -5.08 118.95 116.50 2ct7 s ARG 68 Ca 0.33 -1.55 0.07 0.00 -0.52 0.00 0.00 55.73 54.05 2ct7 s ARG 68 Cb 0.26 0.48 0.00 0.00 0.52 0.00 0.00 34.95 36.22 2ct7 s ARG 68 CO 0.08 -0.78 0.37 -1.54 0.02 0.00 0.00 175.30 173.44 2ct7 s SER 69 N -3.14 4.75 0.35 0.23 1.04 -1.26 -4.78 113.70 110.88 2ct7 s SER 69 Ca 0.26 -1.04 0.07 0.00 0.48 0.00 0.00 55.95 55.72 2ct7 s SER 69 Cb -0.01 -0.07 0.77 0.00 0.10 0.00 0.00 66.02 66.80 2ct7 s SER 69 CO 0.15 -0.86 1.88 0.00 0.98 0.00 0.00 173.24 175.39 2ct7 h GLU 71 N 0.75 -0.15 -0.94 0.00 4.81 -2.01 -3.21 114.58 113.83 2ct7 h GLU 71 Ca 0.43 0.01 0.23 0.00 -0.13 0.00 0.00 59.36 59.90 2ct7 h GLU 71 Cb 0.61 0.03 -0.12 0.00 0.63 0.00 0.00 28.75 29.91 2ct7 h GLU 71 CO -0.20 -0.10 0.48 -0.44 -0.73 0.00 0.00 179.01 178.03 2ct7 h ASP 72 N -0.57 0.49 -0.08 1.04 5.19 -1.93 -1.35 116.42 119.22 2ct7 h ASP 72 Ca -0.02 0.14 0.04 0.00 -0.62 0.00 0.00 57.03 56.57 2ct7 h ASP 72 Cb 0.12 0.08 -0.06 0.00 0.18 0.00 0.00 39.33 39.65 2ct7 h ASP 72 CO 0.03 0.06 -0.41 0.15 -3.12 0.00 0.00 179.24 175.95 2ct7 h PHE 73 N 0.49 -1.16 -0.52 4.55 3.57 -0.41 -1.58 116.94 121.89 2ct7 h PHE 73 Ca 0.59 0.04 0.10 0.00 3.53 0.00 0.00 57.97 62.24 2ct7 h PHE 73 Cb 1.11 0.52 -0.10 0.00 2.79 0.00 0.00 35.95 40.26 2ct7 h PHE 73 CO -0.08 -0.48 -0.22 0.37 -2.23 0.00 0.00 178.31 175.67 2ct7 h GLN 74 N -0.52 -0.10 -0.80 1.11 4.15 -1.24 0.29 115.11 118.00 2ct7 h GLN 74 Ca 0.07 0.01 0.16 0.00 0.77 0.00 0.00 58.65 59.65 2ct7 h GLN 74 Cb 0.63 0.02 -0.06 0.00 0.21 0.00 0.00 27.48 28.29 2ct7 h GLN 74 CO -0.36 -0.07 0.53 -0.91 -1.93 0.00 0.00 178.83 176.09 2ct7 h ASN 75 N -0.10 0.44 0.72 -0.69 2.35 -1.23 0.22 115.58 117.29 2ct7 h ASN 75 Ca 0.24 0.03 -0.11 0.00 -0.55 0.00 0.00 56.30 55.90 2ct7 h ASN 75 Cb 0.48 -0.06 -0.02 0.00 0.05 0.00 0.00 38.32 38.77 2ct7 h ASN 75 CO -0.59 0.22 -0.54 -0.25 -1.65 0.00 0.00 177.43 174.62 2ct7 h TRP 76 N 0.46 0.00 0.04 1.19 7.01 0.48 -2.76 115.95 122.37 2ct7 h TRP 76 Ca 0.40 0.00 -0.00 0.00 2.11 0.00 0.00 58.89 61.40 2ct7 h TRP 76 Cb 0.87 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 27.93 2ct7 h TRP 76 CO -0.00 0.54 -0.02 0.87 -2.79 0.00 0.00 178.44 177.04 2ct7 h LYS 77 N 0.00 -0.06 -0.10 2.65 1.79 0.66 0.26 116.57 121.78 2ct7 h LYS 77 Ca -0.01 0.00 -0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2ct7 h LYS 77 Cb 1.04 0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 31.70 2ct7 h LYS 77 CO 0.07 0.49 0.06 0.07 -1.08 0.00 0.00 179.45 179.06 2ct7 h ARG 78 N -0.64 0.13 0.00 3.15 0.11 -1.38 0.76 114.38 116.51 2ct7 h ARG 78 Ca -0.01 -0.01 -0.05 0.00 0.10 0.00 0.00 59.98 60.02 2ct7 h ARG 78 Cb 0.57 -0.03 -0.01 0.00 1.11 0.00 0.00 29.97 31.61 2ct7 h ARG 78 CO 0.01 0.09 -0.27 0.52 0.10 0.00 0.00 179.97 180.42 2ct7 h MET 79 N 0.13 0.00 0.20 0.08 2.86 -1.47 -3.41 114.93 113.32 2ct7 h MET 79 Ca 0.04 0.00 -0.01 0.00 -2.06 0.00 0.00 59.70 57.67 2ct7 h MET 79 Cb -0.00 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.66 2ct7 h MET 79 CO -0.01 0.92 -0.10 -0.91 1.06 0.00 0.00 176.91 177.87 2ct7 h ASN 80 N -1.00 -0.23 -3.59 1.22 2.35 -0.30 -3.46 115.58 110.57 2ct7 h ASN 80 Ca -0.07 0.01 -0.51 0.00 -0.55 0.00 0.00 56.30 55.17 2ct7 h ASN 80 Cb 0.99 0.06 0.21 0.00 0.05 0.00 0.00 38.32 39.63 2ct7 h ASN 80 CO -0.04 0.00 -0.31 -0.24 -1.65 0.00 0.00 177.43 175.19 2ct7 n SER 81 N -3.66 -1.26 0.00 5.81 2.88 0.26 -4.88 113.62 112.78 2ct7 n SER 81 Ca -0.03 0.28 0.00 0.00 -1.33 0.00 0.00 58.87 57.79 2ct7 n SER 81 Cb 0.11 -1.28 0.00 0.00 -0.75 0.00 0.00 64.21 62.29 2ct7 n SER 81 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2ct7 n GLY 82 N 1.09 1.23 0.27 0.46 0.00 -1.26 -4.71 105.19 102.27 2ct7 n GLY 82 Ca 0.08 -0.77 0.16 0.00 0.00 0.00 0.00 46.02 45.49 2ct7 n GLY 82 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2ct7 h PRO 83 N 0.00 0.00 -0.91 1.61 0.13 -2.00 -3.18 132.00 127.65 2ct7 h PRO 83 Ca 0.00 0.00 0.22 0.00 -0.87 0.00 0.00 66.00 65.35 2ct7 h PRO 83 Cb 0.00 0.00 -0.12 0.00 0.13 0.00 0.00 31.00 31.01 2ct7 h PRO 83 CO 0.00 0.05 0.42 0.66 -0.23 0.00 0.00 178.00 178.89 2ct7 h SER 84 N 0.00 0.37 -5.89 1.44 4.64 -1.99 -3.45 113.55 108.67 2ct7 h SER 84 Ca -0.00 0.15 -0.39 0.00 -0.47 0.00 0.00 61.79 61.09 2ct7 h SER 84 Cb 0.52 0.12 0.11 0.00 -0.31 0.00 0.00 62.40 62.84 2ct7 h SER 84 CO 0.01 0.01 -0.77 -0.24 -0.87 0.00 0.00 176.83 174.97 2ct7 n SER 85 N -5.03 -3.08 -0.30 4.97 2.88 -1.20 -5.31 113.62 106.54 2ct7 n SER 85 Ca 0.23 -0.67 0.04 0.00 -1.33 0.00 0.00 58.87 57.13 2ct7 n SER 85 Cb 0.67 -4.68 0.03 0.00 -0.75 0.00 0.00 64.21 59.48 2ct7 n SER 85 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42