#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 4.07 0.05 1.61 0.01 -1.26 -5.11 113.70 113.07 2ct7 s SER 2 Ca 0.00 -1.58 -0.01 0.00 1.31 0.00 0.00 55.95 55.67 2ct7 s SER 2 Cb 0.00 -1.10 -0.04 0.00 0.21 0.00 0.00 66.02 65.09 2ct7 s SER 2 CO 0.00 -0.35 -0.03 -0.55 0.41 0.00 0.00 173.24 172.72 2ct7 s SER 3 N 1.41 0.50 0.00 2.44 0.15 -1.26 -5.13 113.70 111.81 2ct7 s SER 3 Ca 0.05 -1.00 0.00 0.00 0.70 0.00 0.00 55.95 55.70 2ct7 s SER 3 Cb -0.18 0.20 0.00 0.00 -1.71 0.00 0.00 66.02 64.33 2ct7 s SER 3 CO -0.15 -0.60 0.00 0.61 1.20 0.00 0.00 173.24 174.30 2ct7 n GLY 4 N 0.10 1.86 3.63 9.45 0.00 -1.26 -5.10 105.19 113.88 2ct7 n GLY 4 Ca -0.14 0.18 -0.43 0.00 0.00 0.00 0.00 46.02 45.64 2ct7 n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2ct7 n SER 5 N 0.00 3.66 -4.34 1.61 7.64 -1.26 -4.94 113.62 115.99 2ct7 n SER 5 Ca 0.00 0.51 -0.44 0.00 1.01 0.00 0.00 58.87 59.95 2ct7 n SER 5 Cb 0.00 -1.54 -0.07 0.00 -1.01 0.00 0.00 64.21 61.58 2ct7 n SER 5 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2ct7 s SER 6 N 6.65 6.06 0.00 6.43 0.01 -1.26 -4.90 113.70 126.68 2ct7 s SER 6 Ca 0.96 -1.48 0.00 0.00 1.31 0.00 0.00 55.95 56.74 2ct7 s SER 6 Cb -0.38 -2.15 0.00 0.00 0.21 0.00 0.00 66.02 63.70 2ct7 s SER 6 CO 0.38 -0.68 0.00 0.61 0.41 0.00 0.00 173.24 173.97 2ct7 n GLY 7 N 5.15 3.61 2.86 3.44 0.00 -1.26 -5.15 105.19 113.85 2ct7 n GLY 7 Ca -0.12 -1.16 -0.13 0.00 0.00 0.00 0.00 46.02 44.61 2ct7 n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ct7 s ALA 8 N 0.00 0.05 0.43 4.61 0.00 -1.26 -5.15 121.76 120.44 2ct7 s ALA 8 Ca 0.00 0.04 -0.23 0.00 0.00 0.00 0.00 51.96 51.77 2ct7 s ALA 8 Cb 0.00 -0.05 -0.08 0.00 0.00 0.00 0.00 23.12 22.98 2ct7 s ALA 8 CO 0.00 -0.01 1.08 -1.17 0.00 0.00 0.00 175.76 175.66 2ct7 s LEU 9 N 0.19 4.04 0.00 0.00 0.20 -1.26 -4.98 118.68 116.87 2ct7 s LEU 9 Ca -0.02 2.09 0.00 0.00 0.69 0.00 0.00 54.13 56.90 2ct7 s LEU 9 Cb -0.03 -4.28 0.00 0.00 -0.43 0.00 0.00 46.19 41.46 2ct7 s LEU 9 CO -0.01 -0.68 0.96 2.22 -0.29 0.00 0.00 176.35 178.55 2ct7 n PHE 10 N -0.38 0.00 -4.27 5.38 -1.74 -1.26 -4.71 117.46 110.48 2ct7 n PHE 10 Ca 0.07 0.00 -0.20 0.00 -0.56 0.00 0.00 57.45 56.76 2ct7 n PHE 10 Cb 0.50 -0.46 -0.13 0.00 1.52 0.00 0.00 39.48 40.91 2ct7 n PHE 10 CO 0.00 0.00 0.00 -1.01 -0.56 0.00 0.00 176.76 175.19 2ct7 s HIS 11 N -2.84 1.32 0.33 2.97 3.76 -1.26 -5.11 115.29 114.45 2ct7 s HIS 11 Ca 0.00 -0.41 -0.12 0.00 -0.15 0.00 0.00 55.06 54.37 2ct7 s HIS 11 Cb 0.00 -0.75 -0.10 0.00 1.11 0.00 0.00 32.58 32.83 2ct7 s HIS 11 CO 0.00 0.07 -0.06 1.63 -0.85 0.00 0.00 174.74 175.53 2ct7 n LYS 12 N 1.49 0.00 0.01 1.40 4.76 -1.26 -4.89 118.16 119.67 2ct7 n LYS 12 Ca -0.20 0.00 -0.18 0.00 -2.87 0.00 0.00 58.31 55.06 2ct7 n LYS 12 Cb 0.54 -0.67 -0.14 0.00 -1.84 0.00 0.00 35.03 32.92 2ct7 n LYS 12 CO 0.00 0.00 0.00 0.87 -1.37 0.00 0.00 177.40 176.90 2ct7 h LYS 13 N 0.03 0.20 -4.13 1.97 6.56 -1.99 -3.42 116.57 115.79 2ct7 h LYS 13 Ca -0.27 -0.34 -0.44 0.00 -1.06 0.00 0.00 60.65 58.54 2ct7 h LYS 13 Cb 0.97 0.13 0.10 0.00 -0.57 0.00 0.00 32.23 32.85 2ct7 h LYS 13 CO 0.29 1.16 -0.54 1.28 -2.06 0.00 0.00 179.45 179.58 2ct7 n LEU 14 N -4.29 -1.53 0.20 2.94 4.77 -1.26 -4.63 117.00 113.20 2ct7 n LEU 14 Ca -0.13 0.65 0.14 0.00 -0.03 0.00 0.00 56.01 56.64 2ct7 n LEU 14 Cb 0.71 -0.63 0.50 0.00 -2.33 0.00 0.00 43.42 41.68 2ct7 n LEU 14 CO 0.44 -2.56 1.12 0.00 -1.33 0.00 0.00 177.39 175.06 2ct7 h THR 15 N 0.41 0.07 -0.83 -5.08 1.03 -2.02 -2.12 112.91 104.37 2ct7 h THR 15 Ca -0.23 0.00 0.31 0.00 -0.01 0.00 0.00 66.41 66.48 2ct7 h THR 15 Cb 0.99 0.36 -0.15 0.00 -1.07 0.00 0.00 68.15 68.28 2ct7 h THR 15 CO 0.35 0.00 0.31 1.21 -0.01 0.00 0.00 175.52 177.38 2ct7 n GLU 16 N -2.99 -0.05 -0.79 0.00 4.07 -1.26 0.32 120.64 119.94 2ct7 n GLU 16 Ca 0.04 1.17 -0.07 0.00 -0.06 0.00 0.00 57.16 58.24 2ct7 n GLU 16 Cb 0.79 -2.02 -0.10 0.00 -0.06 0.00 0.00 31.44 30.06 2ct7 n GLU 16 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2ct7 n GLY 17 N -1.28 2.81 3.39 8.31 0.00 -0.80 -4.83 105.19 112.80 2ct7 n GLY 17 Ca 0.28 -0.71 -0.34 0.00 0.00 0.00 0.00 46.02 45.25 2ct7 n GLY 17 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ct7 s VAL 18 N 0.52 3.47 -0.34 1.61 0.11 0.15 -5.00 120.40 120.92 2ct7 s VAL 18 Ca 0.38 -0.49 0.06 0.00 -2.93 0.00 0.00 61.98 59.01 2ct7 s VAL 18 Cb 0.19 -2.53 0.46 0.00 -1.53 0.00 0.00 36.38 32.97 2ct7 s VAL 18 CO -0.00 0.47 1.35 0.00 -3.33 0.00 0.00 175.10 173.59 2ct7 n LEU 19 N 4.02 5.11 0.13 2.54 -0.00 -1.26 -4.76 117.00 122.78 2ct7 n LEU 19 Ca -0.18 -4.52 0.19 0.00 -0.00 0.00 0.00 56.01 51.50 2ct7 n LEU 19 Cb 0.52 -0.49 0.77 0.00 -0.00 0.00 0.00 43.42 44.22 2ct7 n LEU 19 CO 0.31 1.87 1.17 0.00 -0.00 0.00 0.00 177.39 180.73 2ct7 h MET 20 N 1.94 0.00 0.00 1.47 -0.00 -1.98 -1.12 114.93 115.24 2ct7 h MET 20 Ca 0.36 0.00 -0.06 0.00 -0.00 0.00 0.00 59.70 60.01 2ct7 h MET 20 Cb 1.39 0.00 -0.13 0.00 -0.00 0.00 0.00 31.60 32.87 2ct7 h MET 20 CO 0.79 0.00 -0.61 2.89 -0.00 0.00 0.00 176.91 179.98 2ct7 n ARG 21 N -3.85 0.90 -4.09 -0.10 1.85 -1.26 -5.05 116.66 105.06 2ct7 n ARG 21 Ca 0.05 -2.60 -0.14 0.00 -1.00 0.00 0.00 57.85 54.17 2ct7 n ARG 21 Cb 0.49 -0.98 -0.12 0.00 -1.05 0.00 0.00 32.46 30.79 2ct7 n ARG 21 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 2ct7 s ASP 22 N -2.60 0.80 -0.02 2.89 1.01 -0.42 -5.08 116.67 113.25 2ct7 s ASP 22 Ca 0.33 -0.42 -0.21 0.00 0.71 0.00 0.00 52.55 52.96 2ct7 s ASP 22 Cb 0.33 0.00 -0.13 0.00 1.01 0.00 0.00 42.92 44.14 2ct7 s ASP 22 CO -0.08 -0.12 0.89 1.55 0.21 0.00 0.00 175.17 177.61 2ct7 h PRO 23 N 4.93 -0.55 -0.17 8.23 0.13 -1.97 -3.45 132.00 139.15 2ct7 h PRO 23 Ca -0.34 0.04 0.27 0.00 -0.87 0.00 0.00 66.00 65.10 2ct7 h PRO 23 Cb 1.20 0.12 -0.21 0.00 0.13 0.00 0.00 31.00 32.25 2ct7 h PRO 23 CO 0.43 -0.27 0.20 0.21 -0.23 0.00 0.00 178.00 178.34 2ct7 s LYS 24 N -3.91 0.10 -0.41 0.86 2.36 -1.26 -5.01 119.74 112.47 2ct7 s LYS 24 Ca -0.11 0.16 -0.28 0.00 -2.55 0.00 0.00 55.97 53.19 2ct7 s LYS 24 Cb 0.01 0.09 -0.01 0.00 -1.05 0.00 0.00 37.83 36.87 2ct7 s LYS 24 CO 0.38 -0.12 1.74 0.12 1.55 0.00 0.00 175.35 179.02 2ct7 s PHE 25 N 2.98 1.89 -0.20 4.03 5.36 -1.26 -4.06 117.98 126.71 2ct7 s PHE 25 Ca -0.01 0.67 -0.01 0.00 -0.96 0.00 0.00 56.93 56.62 2ct7 s PHE 25 Cb -0.08 -4.16 0.01 0.00 -0.34 0.00 0.00 43.02 38.45 2ct7 s PHE 25 CO -0.11 -2.61 -0.13 -1.17 -1.46 0.00 0.00 175.22 169.74 2ct7 s LEU 26 N 7.12 2.45 0.19 6.12 1.98 -0.01 -4.99 118.68 131.55 2ct7 s LEU 26 Ca 0.73 -0.54 -0.07 0.00 -2.89 0.00 0.00 54.13 51.36 2ct7 s LEU 26 Cb -0.18 -1.59 -0.02 0.00 0.66 0.00 0.00 46.19 45.06 2ct7 s LEU 26 CO 0.30 -0.01 0.28 -1.66 -1.89 0.00 0.00 176.35 173.37 2ct7 s TRP 27 N 1.36 0.63 1.33 5.38 1.48 -1.26 -3.10 118.94 124.75 2ct7 s TRP 27 Ca 0.05 -0.96 -0.22 0.00 -1.06 0.00 0.00 56.10 53.91 2ct7 s TRP 27 Cb -0.14 -0.16 0.34 0.00 -1.16 0.00 0.00 33.47 32.35 2ct7 s TRP 27 CO -0.09 -0.76 0.77 0.00 -4.06 0.00 0.00 176.95 172.81 2ct7 n ALA 29 N -5.51 2.98 0.05 0.00 0.00 -1.26 -4.14 120.51 112.62 2ct7 n ALA 29 Ca -0.17 -0.48 0.00 0.00 0.00 0.00 0.00 53.44 52.78 2ct7 n ALA 29 Cb 0.53 -0.45 0.00 0.00 0.00 0.00 0.00 19.45 19.53 2ct7 n ALA 29 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2ct7 n GLN 30 N -0.18 0.00 0.07 0.00 10.64 -1.26 -4.77 117.38 121.87 2ct7 n GLN 30 Ca 0.05 0.00 0.12 0.00 -1.83 0.00 0.00 57.00 55.35 2ct7 n GLN 30 Cb 0.27 -0.35 0.47 0.00 -0.86 0.00 0.00 30.24 29.76 2ct7 n GLN 30 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 2ct7 n SER 32 N -1.96 -0.92 -0.10 0.00 3.41 -1.26 -4.81 113.62 107.98 2ct7 n SER 32 Ca 0.05 -1.03 -0.06 0.00 -0.26 0.00 0.00 58.87 57.57 2ct7 n SER 32 Cb 0.33 -1.26 -0.05 0.00 -0.26 0.00 0.00 64.21 62.98 2ct7 n SER 32 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 175.04 175.03 2ct7 h PHE 33 N -1.32 -0.82 -0.19 7.33 3.04 -1.91 -3.46 116.94 119.60 2ct7 h PHE 33 Ca -0.54 0.04 0.00 0.00 3.98 0.00 0.00 57.97 61.45 2ct7 h PHE 33 Cb 1.11 0.39 0.00 0.00 2.56 0.00 0.00 35.95 40.02 2ct7 h PHE 33 CO 0.36 -0.21 0.00 0.41 -2.02 0.00 0.00 178.31 176.85 2ct7 n GLY 34 N -1.16 0.53 2.70 2.40 0.00 -1.26 -5.03 105.19 103.37 2ct7 n GLY 34 Ca -0.01 -0.62 -0.11 0.00 0.00 0.00 0.00 46.02 45.28 2ct7 n GLY 34 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 2ct7 n PHE 35 N -0.03 -1.34 -4.49 1.61 1.16 -1.18 -5.04 117.46 108.16 2ct7 n PHE 35 Ca 0.00 -1.81 -0.29 0.00 -1.87 0.00 0.00 57.45 53.47 2ct7 n PHE 35 Cb 0.00 0.47 -0.13 0.00 -1.61 0.00 0.00 39.48 38.21 2ct7 n PHE 35 CO 0.00 0.00 0.00 0.42 -1.87 0.00 0.00 176.76 175.31 2ct7 s ILE 36 N -2.68 2.41 0.00 1.97 -1.09 -1.26 -0.83 121.20 119.72 2ct7 s ILE 36 Ca 0.22 -1.59 0.00 0.00 -2.23 0.00 0.00 60.65 57.05 2ct7 s ILE 36 Cb -0.01 -2.05 0.00 0.00 -1.58 0.00 0.00 42.46 38.82 2ct7 s ILE 36 CO 0.16 0.16 0.00 0.00 -1.23 0.00 0.00 174.94 174.03 2ct7 n TYR 37 N 1.10 0.00 -3.44 3.97 4.11 -1.26 -4.93 117.16 116.71 2ct7 n TYR 37 Ca -0.17 0.00 -0.16 0.00 -0.00 0.00 0.00 57.90 57.57 2ct7 n TYR 37 Cb 0.53 0.00 -0.05 0.00 -0.00 0.00 0.00 39.34 39.81 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 -1.82 -0.97 -4.43 -3.48 -0.00 -1.26 -4.87 120.64 103.81 2ct7 n GLU 38 Ca 0.00 0.05 -0.31 0.00 -0.00 0.00 0.00 57.16 56.90 2ct7 n GLU 38 Cb 0.42 -1.86 -0.11 0.00 -0.00 0.00 0.00 31.44 29.89 2ct7 n GLU 38 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.13 177.63 2ct7 s ARG 39 N -5.25 2.31 -0.09 3.44 6.06 -1.26 -5.01 118.95 119.15 2ct7 s ARG 39 Ca 0.01 -0.88 -0.00 0.00 -2.50 0.00 0.00 55.73 52.36 2ct7 s ARG 39 Cb -0.00 -2.37 0.05 0.00 0.06 0.00 0.00 34.95 32.69 2ct7 s ARG 39 CO 0.52 0.56 2.06 -0.85 -2.50 0.00 0.00 175.30 175.08 2ct7 n GLU 40 N 1.28 1.26 -3.84 5.12 0.28 -1.26 -4.79 120.64 118.68 2ct7 n GLU 40 Ca -0.15 -0.47 -0.12 0.00 -0.16 0.00 0.00 57.16 56.26 2ct7 n GLU 40 Cb 0.52 -1.20 -0.10 0.00 1.43 0.00 0.00 31.44 32.09 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 -0.49 0.43 0.00 3.44 -2.07 -1.26 -5.03 119.66 114.69 2ct7 s GLN 41 Ca 0.11 -0.18 0.29 0.00 -1.82 0.00 0.00 55.36 53.76 2ct7 s GLN 41 Cb 0.08 0.19 1.35 0.00 -1.09 0.00 0.00 33.01 33.54 2ct7 s GLN 41 CO -0.00 -0.10 1.97 1.28 -1.32 0.00 0.00 175.29 177.12 2ct7 n LEU 42 N 1.88 0.07 -4.61 2.60 4.77 -1.26 -4.74 117.00 115.71 2ct7 n LEU 42 Ca -0.20 0.32 -0.42 0.00 -0.03 0.00 0.00 56.01 55.68 2ct7 n LEU 42 Cb 0.56 -0.35 -0.04 0.00 -2.33 0.00 0.00 43.42 41.26 2ct7 n LEU 42 CO 0.21 0.01 0.68 -0.70 -1.33 0.00 0.00 177.39 176.26 2ct7 s GLU 43 N -2.73 3.88 -0.06 3.23 2.12 -1.26 -3.53 118.70 120.35 2ct7 s GLU 43 Ca 0.23 0.56 0.02 0.00 0.36 0.00 0.00 54.97 56.14 2ct7 s GLU 43 Cb 0.20 -3.77 0.01 0.00 0.26 0.00 0.00 34.13 30.82 2ct7 s GLU 43 CO 0.50 -0.84 -0.12 0.00 -0.54 0.00 0.00 175.26 174.27 2ct7 s ALA 44 N 3.24 1.18 0.05 6.30 0.00 -1.19 -5.02 121.76 126.31 2ct7 s ALA 44 Ca 0.35 -0.40 0.06 0.00 0.00 0.00 0.00 51.96 51.98 2ct7 s ALA 44 Cb -0.13 -0.51 -0.03 0.00 0.00 0.00 0.00 23.12 22.44 2ct7 s ALA 44 CO 0.16 0.12 -0.14 0.99 0.00 0.00 0.00 175.76 176.89 2ct7 s THR 45 N 0.56 3.07 -0.03 0.00 2.01 -1.26 -1.45 115.64 118.54 2ct7 s THR 45 Ca -0.12 -1.12 -0.19 0.00 0.31 0.00 0.00 61.69 60.57 2ct7 s THR 45 Cb -0.14 -2.33 -0.05 0.00 0.01 0.00 0.00 72.50 69.98 2ct7 s THR 45 CO 0.03 0.30 0.53 0.00 -0.69 0.00 0.00 174.62 174.80 2ct7 n PRO 47 N 2.83 0.35 0.00 0.00 -0.04 -1.26 0.99 135.00 137.88 2ct7 n PRO 47 Ca -0.08 0.07 0.00 0.00 -0.04 0.00 0.00 63.50 63.45 2ct7 n PRO 47 Cb 0.51 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.47 2ct7 n PRO 47 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2ct7 n GLN 48 N -1.14 0.22 0.03 0.54 10.64 -1.26 -4.79 117.38 121.62 2ct7 n GLN 48 Ca 0.09 0.00 0.06 0.00 -1.83 0.00 0.00 57.00 55.32 2ct7 n GLN 48 Cb 0.09 -0.89 -0.09 0.00 -0.86 0.00 0.00 30.24 28.49 2ct7 n GLN 48 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 2ct7 n HIS 50 N -2.63 -1.61 -4.17 0.00 8.25 0.28 -4.87 115.22 110.46 2ct7 n HIS 50 Ca -0.07 0.22 -0.34 0.00 -0.26 0.00 0.00 57.72 57.26 2ct7 n HIS 50 Cb 0.70 -2.90 -0.10 0.00 1.12 0.00 0.00 29.99 28.81 2ct7 n HIS 50 CO 0.00 0.00 0.00 -1.14 0.64 0.00 0.00 176.34 175.84 2ct7 s GLN 51 N -5.45 3.79 -0.60 -0.41 -0.44 -1.26 -4.75 119.66 110.53 2ct7 s GLN 51 Ca 0.17 -0.40 -0.28 0.00 -2.50 0.00 0.00 55.36 52.35 2ct7 s GLN 51 Cb -0.09 -3.08 0.02 0.00 -1.64 0.00 0.00 33.01 28.23 2ct7 s GLN 51 CO 0.21 0.31 1.28 0.99 0.50 0.00 0.00 175.29 178.58 2ct7 s THR 52 N 0.23 3.89 0.10 -0.34 2.01 -1.26 -3.50 115.64 116.77 2ct7 s THR 52 Ca 0.02 0.75 0.08 0.00 0.31 0.00 0.00 61.69 62.85 2ct7 s THR 52 Cb -0.13 -4.67 -0.03 0.00 0.01 0.00 0.00 72.50 67.68 2ct7 s THR 52 CO 0.01 -1.37 -0.20 0.72 -0.69 0.00 0.00 174.62 173.09 2ct7 s PHE 53 N 5.44 1.69 0.68 4.92 -0.71 -0.53 -1.59 117.98 127.89 2ct7 s PHE 53 Ca 0.45 -0.42 -0.17 0.00 -1.04 0.00 0.00 56.93 55.74 2ct7 s PHE 53 Cb -0.09 -0.93 0.01 0.00 -1.21 0.00 0.00 43.02 40.80 2ct7 s PHE 53 CO 0.24 0.18 1.27 0.00 -1.34 0.00 0.00 175.22 175.56 2ct7 n VAL 55 N -2.22 0.08 0.00 0.00 0.24 -1.23 -2.95 118.33 112.25 2ct7 n VAL 55 Ca 0.15 -0.09 0.00 0.00 -2.04 0.00 0.00 64.34 62.36 2ct7 n VAL 55 Cb 0.49 0.31 0.00 0.00 -1.47 0.00 0.00 33.84 33.16 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 -1.69 0.00 0.17 7.34 1.74 -1.26 -4.58 116.66 118.37 2ct7 n ARG 56 Ca 0.04 0.04 0.13 0.00 -0.77 0.00 0.00 57.85 57.29 2ct7 n ARG 56 Cb 0.37 -0.44 0.52 0.00 -1.02 0.00 0.00 32.46 31.89 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 -2.47 -7.36 -4.49 0.00 4.76 -1.15 -4.99 118.16 102.45 2ct7 n LYS 58 Ca 0.02 0.78 -0.29 0.00 -2.87 0.00 0.00 58.31 55.96 2ct7 n LYS 58 Cb 0.28 -5.80 -0.08 0.00 -1.84 0.00 0.00 35.03 27.59 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 -6.36 2.13 -0.18 1.97 1.70 -1.26 -4.60 118.95 112.36 2ct7 s ARG 59 Ca 0.60 -2.15 -0.29 0.00 -0.47 0.00 0.00 55.73 53.42 2ct7 s ARG 59 Cb -0.27 -1.72 -0.06 0.00 -0.57 0.00 0.00 34.95 32.32 2ct7 s ARG 59 CO 0.74 -0.23 2.17 0.94 -1.08 0.00 0.00 175.30 177.83 2ct7 n GLN 60 N -1.22 2.07 -1.42 3.89 7.27 -1.26 -0.77 117.38 125.94 2ct7 n GLN 60 Ca -0.09 0.62 -0.36 0.00 0.07 0.00 0.00 57.00 57.24 2ct7 n GLN 60 Cb 0.66 -3.13 0.09 0.00 2.41 0.00 0.00 30.24 30.27 2ct7 n GLN 60 CO 0.00 0.00 0.00 1.87 0.07 0.00 0.00 177.06 179.00 2ct7 n TRP 61 N 10.70 1.17 -3.83 3.69 -0.00 -0.62 -4.82 117.44 123.73 2ct7 n TRP 61 Ca 0.29 0.41 -0.12 0.00 -0.00 0.00 0.00 57.50 58.07 2ct7 n TRP 61 Cb 0.42 -2.14 -0.12 0.00 -0.00 0.00 0.00 31.31 29.47 2ct7 n TRP 61 CO 0.00 0.00 0.00 -2.00 -0.00 0.00 0.00 177.69 175.69 2ct7 s GLU 62 N -3.49 0.20 0.35 5.87 2.56 -1.26 -4.95 118.70 117.99 2ct7 s GLU 62 Ca 0.76 0.10 0.13 0.00 0.00 0.00 0.00 54.97 55.97 2ct7 s GLU 62 Cb -0.35 0.09 0.98 0.00 2.00 0.00 0.00 34.13 36.86 2ct7 s GLU 62 CO 0.47 -0.03 1.74 0.93 -0.56 0.00 0.00 175.26 177.81 2ct7 h GLU 63 N 5.71 0.48 -0.09 4.30 3.07 -2.01 0.61 114.58 126.63 2ct7 h GLU 63 Ca -0.26 -0.03 -0.10 0.00 -0.50 0.00 0.00 59.36 58.47 2ct7 h GLU 63 Cb 1.20 -0.11 -0.01 0.00 -0.84 0.00 0.00 28.75 28.99 2ct7 h GLU 63 CO 0.42 0.32 -0.39 1.96 -1.40 0.00 0.00 179.01 179.91 2ct7 h GLN 64 N 0.49 0.20 -0.00 2.33 1.08 -2.00 -2.73 115.11 114.48 2ct7 h GLN 64 Ca 0.64 -0.09 -0.03 0.00 -1.45 0.00 0.00 58.65 57.72 2ct7 h GLN 64 Cb 1.38 -0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.80 2ct7 h GLN 64 CO -0.42 0.57 -0.12 1.25 -0.95 0.00 0.00 178.83 179.16 2ct7 h HIS 65 N 0.17 0.01 0.10 2.96 2.76 -0.10 -3.06 115.15 117.99 2ct7 h HIS 65 Ca 0.02 -0.00 0.01 0.00 -2.20 0.00 0.00 60.37 58.20 2ct7 h HIS 65 Cb 0.77 -0.00 -0.05 0.00 1.55 0.00 0.00 27.41 29.69 2ct7 h HIS 65 CO 0.01 0.13 -0.52 0.00 -1.30 0.00 0.00 177.93 176.26 2ct7 h ARG 66 N 0.01 -0.70 -0.89 5.26 3.08 -1.22 0.06 114.38 119.98 2ct7 h ARG 66 Ca -0.00 0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.10 2ct7 h ARG 66 Cb 0.22 0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.43 2ct7 h ARG 66 CO 0.02 -0.46 0.00 0.41 -1.07 0.00 0.00 179.97 178.86 2ct7 n GLY 67 N -1.47 1.38 2.23 0.04 0.00 -1.16 -4.83 105.19 101.39 2ct7 n GLY 67 Ca -0.08 -0.06 -0.11 0.00 0.00 0.00 0.00 46.02 45.77 2ct7 n GLY 67 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ct7 n ARG 68 N 0.00 0.40 -4.39 1.61 1.74 0.01 -5.08 116.66 110.95 2ct7 n ARG 68 Ca 0.02 -2.02 -0.30 0.00 -0.77 0.00 0.00 57.85 54.78 2ct7 n ARG 68 Cb 0.29 1.83 -0.05 0.00 -1.02 0.00 0.00 32.46 33.50 2ct7 n ARG 68 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 2ct7 s SER 69 N -2.50 4.33 0.42 0.55 0.01 -1.26 -4.82 113.70 110.43 2ct7 s SER 69 Ca 0.22 -1.46 0.12 0.00 1.31 0.00 0.00 55.95 56.15 2ct7 s SER 69 Cb 0.00 0.39 0.98 0.00 0.21 0.00 0.00 66.02 67.60 2ct7 s SER 69 CO 0.16 -0.91 1.98 0.00 0.41 0.00 0.00 173.24 174.87 2ct7 h GLU 71 N 0.47 0.00 -0.99 0.00 4.81 -2.01 -3.25 114.58 113.61 2ct7 h GLU 71 Ca 0.28 0.00 0.22 0.00 -0.13 0.00 0.00 59.36 59.73 2ct7 h GLU 71 Cb 0.48 0.00 -0.10 0.00 0.63 0.00 0.00 28.75 29.77 2ct7 h GLU 71 CO -0.08 0.00 0.62 -0.44 -0.73 0.00 0.00 179.01 178.38 2ct7 h ASP 72 N -0.50 0.63 0.06 1.04 3.32 -1.94 -1.47 116.42 117.55 2ct7 h ASP 72 Ca 0.00 0.09 0.03 0.00 0.02 0.00 0.00 57.03 57.16 2ct7 h ASP 72 Cb 0.00 -0.02 -0.04 0.00 0.22 0.00 0.00 39.33 39.49 2ct7 h ASP 72 CO 0.00 0.19 -0.30 0.15 -1.72 0.00 0.00 179.24 177.57 2ct7 h PHE 73 N 0.59 -0.80 -0.39 4.55 3.57 -0.29 -2.01 116.94 122.17 2ct7 h PHE 73 Ca 0.57 0.02 0.08 0.00 3.53 0.00 0.00 57.97 62.17 2ct7 h PHE 73 Cb 1.12 0.35 -0.09 0.00 2.79 0.00 0.00 35.95 40.12 2ct7 h PHE 73 CO -0.00 -0.39 -0.24 0.37 -2.23 0.00 0.00 178.31 175.82 2ct7 h GLN 74 N -0.48 -0.17 -0.95 1.11 4.15 -1.30 0.89 115.11 118.37 2ct7 h GLN 74 Ca 0.05 0.01 0.19 0.00 0.77 0.00 0.00 58.65 59.67 2ct7 h GLN 74 Cb 0.54 0.04 -0.08 0.00 0.21 0.00 0.00 27.48 28.18 2ct7 h GLN 74 CO -0.21 -0.11 0.61 -0.91 -1.93 0.00 0.00 178.83 176.27 2ct7 h ASN 75 N -0.17 0.61 0.41 -0.69 2.35 -1.31 0.36 115.58 117.13 2ct7 h ASN 75 Ca 0.19 0.06 -0.07 0.00 -0.55 0.00 0.00 56.30 55.93 2ct7 h ASN 75 Cb 0.47 -0.05 -0.01 0.00 0.05 0.00 0.00 38.32 38.78 2ct7 h ASN 75 CO -0.49 0.25 -0.35 -0.25 -1.65 0.00 0.00 177.43 174.93 2ct7 h TRP 76 N 0.61 0.00 -0.09 1.19 7.01 -0.12 -1.69 115.95 122.86 2ct7 h TRP 76 Ca 0.51 0.00 -0.19 0.00 2.11 0.00 0.00 58.89 61.32 2ct7 h TRP 76 Cb 0.98 0.00 0.01 0.00 -2.10 0.00 0.00 29.16 28.05 2ct7 h TRP 76 CO -0.00 0.35 -0.68 0.87 -2.79 0.00 0.00 178.44 176.19 2ct7 h LYS 77 N 0.00 0.63 0.00 2.65 1.79 0.42 0.17 116.57 122.22 2ct7 h LYS 77 Ca -0.00 -0.55 -0.05 0.00 -2.18 0.00 0.00 60.65 57.87 2ct7 h LYS 77 Cb 0.65 0.12 -0.01 0.00 -1.58 0.00 0.00 32.23 31.41 2ct7 h LYS 77 CO 0.05 1.16 -0.25 0.07 -1.08 0.00 0.00 179.45 179.40 2ct7 h ARG 78 N 0.27 0.00 0.08 3.15 0.11 -1.17 0.16 114.38 116.99 2ct7 h ARG 78 Ca -0.06 0.00 -0.29 0.00 0.10 0.00 0.00 59.98 59.73 2ct7 h ARG 78 Cb 1.33 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 32.39 2ct7 h ARG 78 CO 0.14 0.25 -1.54 0.52 0.10 0.00 0.00 179.97 179.43 2ct7 h MET 79 N 0.00 0.18 0.00 0.08 2.86 -1.28 -3.30 114.93 113.47 2ct7 h MET 79 Ca -0.00 -0.31 0.00 0.00 -2.06 0.00 0.00 59.70 57.33 2ct7 h MET 79 Cb 0.77 0.11 0.00 0.00 0.06 0.00 0.00 31.60 32.54 2ct7 h MET 79 CO 0.03 1.15 -0.03 -0.91 1.06 0.00 0.00 176.91 178.21 2ct7 h ASN 80 N -0.39 0.00 0.00 1.22 2.35 -0.67 -3.41 115.58 114.68 2ct7 h ASN 80 Ca -0.35 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.40 2ct7 h ASN 80 Cb 1.71 0.00 0.00 0.00 0.05 0.00 0.00 38.32 40.08 2ct7 h ASN 80 CO -0.01 0.22 0.00 -0.24 -1.65 0.00 0.00 177.43 175.75 2ct7 n SER 81 N -3.14 0.00 0.00 5.81 2.88 0.51 -4.98 113.62 114.70 2ct7 n SER 81 Ca -0.00 0.96 0.00 0.00 -1.33 0.00 0.00 58.87 58.50 2ct7 n SER 81 Cb 0.01 -0.46 0.00 0.00 -0.75 0.00 0.00 64.21 63.01 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 -0.97 0.61 3.67 0.46 0.00 -0.80 -4.99 105.19 103.18 2ct7 n GLY 82 Ca 0.00 -1.17 -0.42 0.00 0.00 0.00 0.00 46.02 44.42 2ct7 n GLY 82 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2ct7 s PRO 83 N 0.00 4.23 -0.28 1.61 0.04 -1.26 -4.78 135.00 134.57 2ct7 s PRO 83 Ca 0.00 2.02 -0.12 0.00 0.04 0.00 0.00 61.00 62.93 2ct7 s PRO 83 Cb 0.00 -3.74 0.10 0.00 0.04 0.00 0.00 34.50 30.90 2ct7 s PRO 83 CO 0.00 -0.70 0.64 0.45 0.04 0.00 0.00 177.00 177.44 2ct7 s SER 84 N 2.41 -1.00 0.05 6.66 0.15 -1.26 -5.14 113.70 115.58 2ct7 s SER 84 Ca 0.66 1.50 -0.30 0.00 0.70 0.00 0.00 55.95 58.50 2ct7 s SER 84 Cb -0.31 1.83 -0.05 0.00 -1.71 0.00 0.00 66.02 65.78 2ct7 s SER 84 CO 0.26 -0.23 1.16 -0.44 1.20 0.00 0.00 173.24 175.19 2ct7 s SER 85 N 2.32 7.13 0.00 5.45 0.01 -1.26 -5.20 113.70 122.15 2ct7 s SER 85 Ca -0.08 1.95 0.00 0.00 1.31 0.00 0.00 55.95 59.13 2ct7 s SER 85 Cb -0.09 -2.58 0.00 0.00 0.21 0.00 0.00 66.02 63.56 2ct7 s SER 85 CO -0.19 -0.43 0.37 0.61 0.41 0.00 0.00 173.24 174.01