#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ceb s LYS 2 N -4.13 2.72 0.09 0.00 -2.85 -0.95 -4.75 119.74 109.88 1ceb s LYS 2 Ca 0.46 -0.79 0.09 0.00 -1.00 0.00 0.00 55.97 54.73 1ceb s LYS 2 Cb -0.02 -2.62 -0.04 0.00 -2.06 0.00 0.00 37.83 33.09 1ceb s LYS 2 CO 0.27 0.54 -0.21 -0.08 0.10 0.00 0.00 175.35 175.96 1ceb s THR 3 N -1.41 2.59 0.00 3.79 -1.32 -1.26 -1.26 115.64 116.77 1ceb s THR 3 Ca 0.28 -1.49 0.00 0.00 -1.21 0.00 0.00 61.69 59.27 1ceb s THR 3 Cb -0.12 -2.13 0.00 0.00 -1.51 0.00 0.00 72.50 68.74 1ceb s THR 3 CO 0.20 0.18 0.00 0.61 -2.21 0.00 0.00 174.62 173.41 1ceb n GLY 4 N 1.12 3.05 1.13 6.08 0.00 -1.26 0.24 105.19 115.54 1ceb n GLY 4 Ca -0.17 0.17 0.08 0.00 0.00 0.00 0.00 46.02 46.11 1ceb n GLY 4 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1ceb n ASN 5 N 4.27 3.28 -3.36 1.61 0.23 -1.26 -4.96 115.26 115.07 1ceb n ASN 5 Ca 0.00 -2.12 -0.16 0.00 -0.53 0.00 0.00 54.58 51.78 1ceb n ASN 5 Cb 0.00 -0.42 0.03 0.00 -2.08 0.00 0.00 39.78 37.31 1ceb n ASN 5 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1ceb n GLY 6 N 1.24 -1.16 0.18 4.83 0.00 0.64 -3.97 105.19 106.95 1ceb n GLY 6 Ca 0.19 0.52 0.09 0.00 0.00 0.00 0.00 46.02 46.82 1ceb n GLY 6 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1ceb h LYS 7 N -0.71 0.00 -0.18 1.61 3.11 -1.83 -3.23 116.57 115.34 1ceb h LYS 7 Ca -0.43 0.00 0.00 0.00 -2.81 0.00 0.00 60.65 57.41 1ceb h LYS 7 Cb 1.23 0.00 0.00 0.00 -1.00 0.00 0.00 32.23 32.46 1ceb h LYS 7 CO 0.40 0.15 0.00 0.09 -2.81 0.00 0.00 179.45 177.28 1ceb n ASN 8 N -3.08 3.29 -4.65 4.20 5.03 -1.26 -4.73 115.26 114.06 1ceb n ASN 8 Ca 0.02 -2.90 -0.42 0.00 0.87 0.00 0.00 54.58 52.15 1ceb n ASN 8 Cb 0.60 -0.46 -0.03 0.00 -1.02 0.00 0.00 39.78 38.87 1ceb n ASN 8 CO 0.00 0.00 0.00 -0.47 -1.83 0.00 0.00 177.26 174.96 1ceb s TYR 9 N -2.60 1.49 -0.34 3.10 5.04 -1.22 -4.91 117.35 117.91 1ceb s TYR 9 Ca 0.36 -0.11 0.07 0.00 -2.44 0.00 0.00 57.07 54.95 1ceb s TYR 9 Cb 0.29 -4.11 0.45 0.00 0.35 0.00 0.00 41.96 38.94 1ceb s TYR 9 CO 0.07 -4.79 1.15 0.54 -1.34 0.00 0.00 175.55 171.18 1ceb n ARG 10 N 7.61 3.40 -2.28 4.97 5.12 -1.26 -4.89 116.66 129.33 1ceb n ARG 10 Ca 0.20 -4.22 -0.27 0.00 -1.93 0.00 0.00 57.85 51.63 1ceb n ARG 10 Cb 0.42 -2.21 0.04 0.00 -1.16 0.00 0.00 32.46 29.55 1ceb n ARG 10 CO 0.00 0.00 0.00 0.20 -1.93 0.00 0.00 177.63 175.90 1ceb s GLY 11 N -3.58 1.62 -0.29 -0.13 0.00 -1.26 -4.99 107.32 98.69 1ceb s GLY 11 Ca 0.48 -0.67 0.11 0.00 0.00 0.00 0.00 44.72 44.64 1ceb s GLY 11 CO -0.04 -0.36 1.79 -1.30 0.00 0.00 0.00 173.10 173.19 1ceb n THR 12 N -2.71 2.88 -1.84 0.90 -2.24 -1.26 -4.67 114.28 105.35 1ceb n THR 12 Ca 0.05 -1.57 -0.41 0.00 -2.27 0.00 0.00 64.05 59.85 1ceb n THR 12 Cb 0.58 -0.33 -0.01 0.00 -2.10 0.00 0.00 70.33 68.47 1ceb n THR 12 CO 0.00 0.00 0.00 -0.04 -0.57 0.00 0.00 175.07 174.46 1ceb s MET 13 N -2.92 4.16 0.00 -0.78 -1.94 -1.26 -4.83 119.30 111.73 1ceb s MET 13 Ca 0.55 2.51 0.00 0.00 -1.71 0.00 0.00 55.69 57.04 1ceb s MET 13 Cb 0.43 -3.03 0.00 0.00 2.01 0.00 0.00 34.83 34.25 1ceb s MET 13 CO 0.14 -0.55 0.68 -1.13 -0.01 0.00 0.00 175.02 174.16 1ceb n SER 14 N 1.66 0.78 -4.17 3.03 3.41 -1.26 -0.56 113.62 116.52 1ceb n SER 14 Ca 0.06 -1.38 -0.16 0.00 -0.26 0.00 0.00 58.87 57.12 1ceb n SER 14 Cb 0.39 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 64.22 1ceb n SER 14 CO 0.00 0.00 0.00 -0.75 -0.16 0.00 0.00 175.04 174.13 1ceb s LYS 15 N -0.38 0.82 0.00 4.33 2.20 -1.26 -2.02 119.74 123.43 1ceb s LYS 15 Ca 0.00 -1.05 0.00 0.00 -0.36 0.00 0.00 55.97 54.56 1ceb s LYS 15 Cb 0.00 -0.65 0.00 0.00 -1.51 0.00 0.00 37.83 35.67 1ceb s LYS 15 CO 0.00 0.12 0.00 0.25 -0.36 0.00 0.00 175.35 175.36 1ceb n THR 16 N 0.90 0.00 0.50 3.43 -2.24 0.96 -4.74 114.28 113.09 1ceb n THR 16 Ca -0.18 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 61.72 1ceb n THR 16 Cb 0.56 -0.70 0.34 0.00 -2.10 0.00 0.00 70.33 68.43 1ceb n THR 16 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 1ceb h LYS 17 N 0.00 0.00 -1.01 -0.78 1.57 -0.14 -2.96 116.57 113.24 1ceb h LYS 17 Ca 0.00 0.00 -0.56 0.00 -1.87 0.00 0.00 60.65 58.22 1ceb h LYS 17 Cb 0.00 0.00 -0.29 0.00 0.08 0.00 0.00 32.23 32.02 1ceb h LYS 17 CO 0.00 0.00 0.72 0.09 -0.57 0.00 0.00 179.45 179.69 1ceb n ASN 18 N -2.52 5.22 -2.12 0.86 5.03 -1.26 -4.91 115.26 115.57 1ceb n ASN 18 Ca 0.05 -3.63 -0.15 0.00 0.87 0.00 0.00 54.58 51.72 1ceb n ASN 18 Cb 0.45 -0.89 -0.02 0.00 -1.02 0.00 0.00 39.78 38.30 1ceb n ASN 18 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1ceb n GLY 19 N -1.00 0.09 3.77 7.41 0.00 -1.12 -4.99 105.19 109.35 1ceb n GLY 19 Ca 0.59 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 46.27 1ceb n GLY 19 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1ceb s ILE 20 N -2.57 4.75 0.11 -0.61 1.10 -1.26 -4.82 121.20 117.89 1ceb s ILE 20 Ca 0.00 -0.21 -0.31 0.00 -0.51 0.00 0.00 60.65 59.63 1ceb s ILE 20 Cb 0.00 -3.08 -0.07 0.00 0.15 0.00 0.00 42.46 39.46 1ceb s ILE 20 CO 0.00 0.51 1.28 0.28 -2.11 0.00 0.00 174.94 174.90 1ceb s THR 21 N -1.04 3.60 0.39 4.00 -1.32 -1.26 -0.03 115.64 119.99 1ceb s THR 21 Ca 0.17 1.19 -0.26 0.00 -1.21 0.00 0.00 61.69 61.59 1ceb s THR 21 Cb -0.12 -3.76 -0.09 0.00 -1.51 0.00 0.00 72.50 67.02 1ceb s THR 21 CO 0.07 0.12 1.20 0.00 -2.21 0.00 0.00 174.62 173.80 1ceb s GLN 23 N -2.23 3.62 0.25 0.00 0.74 0.26 -4.65 119.66 117.65 1ceb s GLN 23 Ca 0.56 0.25 -0.30 0.00 0.05 0.00 0.00 55.36 55.93 1ceb s GLN 23 Cb -0.33 -2.41 -0.09 0.00 1.10 0.00 0.00 33.01 31.28 1ceb s GLN 23 CO 0.42 -0.11 1.21 0.15 -0.55 0.00 0.00 175.29 176.41 1ceb s LYS 24 N -4.35 4.49 0.61 1.67 -0.14 -1.26 -4.56 119.74 116.20 1ceb s LYS 24 Ca 0.48 1.96 0.38 0.00 -1.36 0.00 0.00 55.97 57.43 1ceb s LYS 24 Cb -0.10 -3.18 1.93 0.00 -1.68 0.00 0.00 37.83 34.80 1ceb s LYS 24 CO 0.39 -0.04 2.21 -1.49 -0.76 0.00 0.00 175.35 175.65 1ceb h TRP 25 N 4.42 0.00 -0.58 3.18 4.06 -1.69 -2.16 115.95 123.18 1ceb h TRP 25 Ca -0.46 0.00 -0.23 0.00 2.06 0.00 0.00 58.89 60.26 1ceb h TRP 25 Cb 1.22 0.00 -0.14 0.00 -1.00 0.00 0.00 29.16 29.24 1ceb h TRP 25 CO 0.60 0.02 0.18 -1.13 -3.56 0.00 0.00 178.44 174.55 1ceb n SER 26 N -3.23 3.61 -4.31 -3.49 3.41 -1.26 -4.50 113.62 103.85 1ceb n SER 26 Ca -0.02 -3.47 -0.22 0.00 -0.26 0.00 0.00 58.87 54.90 1ceb n SER 26 Cb 0.17 -0.69 -0.12 0.00 -0.26 0.00 0.00 64.21 63.31 1ceb n SER 26 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1ceb s SER 27 N -1.78 2.61 -0.23 4.04 0.15 -0.81 -5.06 113.70 112.61 1ceb s SER 27 Ca 0.50 -0.81 0.13 0.00 0.70 0.00 0.00 55.95 56.48 1ceb s SER 27 Cb 0.42 -0.15 0.46 0.00 -1.71 0.00 0.00 66.02 65.04 1ceb s SER 27 CO 0.07 -0.01 1.18 0.35 1.20 0.00 0.00 173.24 176.03 1ceb n THR 28 N 0.55 1.90 -3.66 6.45 -2.24 -1.26 -4.55 114.28 111.47 1ceb n THR 28 Ca -0.15 -3.33 -0.11 0.00 -2.27 0.00 0.00 64.05 58.19 1ceb n THR 28 Cb 0.56 -0.18 -0.08 0.00 -2.10 0.00 0.00 70.33 68.53 1ceb n THR 28 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1ceb s SER 29 N -3.35 -0.71 0.40 3.42 0.15 -1.26 -3.78 113.70 108.57 1ceb s SER 29 Ca 0.41 1.25 0.28 0.00 0.70 0.00 0.00 55.95 58.59 1ceb s SER 29 Cb 0.38 1.20 1.36 0.00 -1.71 0.00 0.00 66.02 67.25 1ceb s SER 29 CO -0.03 -0.22 1.85 1.55 1.20 0.00 0.00 173.24 177.59 1ceb h PRO 30 N 6.10 0.00 -5.58 5.44 0.13 -1.86 -3.45 132.00 132.77 1ceb h PRO 30 Ca -0.30 0.00 -0.52 0.00 -0.87 0.00 0.00 66.00 64.30 1ceb h PRO 30 Cb 1.19 0.00 -0.28 0.00 0.13 0.00 0.00 31.00 32.04 1ceb h PRO 30 CO 0.17 0.00 -0.83 -1.01 -0.23 0.00 0.00 178.00 176.10 1ceb s HIS 31 N -3.60 1.48 -0.29 1.56 3.76 -1.26 -4.99 115.29 111.96 1ceb s HIS 31 Ca -0.00 -0.30 -0.20 0.00 -0.15 0.00 0.00 55.06 54.41 1ceb s HIS 31 Cb 0.09 -0.94 -0.01 0.00 1.11 0.00 0.00 32.58 32.83 1ceb s HIS 31 CO 0.34 -0.01 0.64 0.50 -0.85 0.00 0.00 174.74 175.37 1ceb s ARG 32 N -0.55 3.98 0.22 1.40 3.52 -1.25 -4.01 118.95 122.26 1ceb s ARG 32 Ca 0.06 0.41 -0.22 0.00 -0.13 0.00 0.00 55.73 55.85 1ceb s ARG 32 Cb -0.07 -3.70 -0.08 0.00 -1.56 0.00 0.00 34.95 29.54 1ceb s ARG 32 CO -0.00 -0.52 0.76 -1.25 -0.81 0.00 0.00 175.30 173.48 1ceb s PRO 33 N 2.60 4.37 0.20 5.12 0.04 -1.26 -4.96 135.00 141.10 1ceb s PRO 33 Ca 0.26 1.00 0.12 0.00 0.04 0.00 0.00 61.00 62.42 1ceb s PRO 33 Cb -0.15 -2.97 -0.06 0.00 0.04 0.00 0.00 34.50 31.36 1ceb s PRO 33 CO 0.11 0.43 1.33 0.07 0.04 0.00 0.00 177.00 178.98 1ceb h ARG 34 N 3.63 0.00 -4.99 4.56 -0.00 -1.97 -3.42 114.38 112.19 1ceb h ARG 34 Ca -0.48 0.00 -0.66 0.00 -0.00 0.00 0.00 59.98 58.85 1ceb h ARG 34 Cb 1.20 0.00 -0.28 0.00 -0.00 0.00 0.00 29.97 30.89 1ceb h ARG 34 CO 0.65 0.68 -0.73 -0.06 -0.00 0.00 0.00 179.97 180.52 1ceb s PHE 35 N -2.85 2.96 0.23 4.08 0.40 -1.26 -4.91 117.98 116.62 1ceb s PHE 35 Ca 0.02 -0.98 -0.11 0.00 -0.60 0.00 0.00 56.93 55.27 1ceb s PHE 35 Cb 0.09 -2.10 -0.01 0.00 0.51 0.00 0.00 43.02 41.51 1ceb s PHE 35 CO 0.78 -0.56 0.40 -1.54 0.70 0.00 0.00 175.22 175.00 1ceb s SER 36 N 1.47 -0.04 0.51 1.36 1.04 -1.26 -4.94 113.70 111.83 1ceb s SER 36 Ca 0.06 -0.99 0.24 0.00 0.48 0.00 0.00 55.95 55.73 1ceb s SER 36 Cb -0.14 0.53 1.38 0.00 0.10 0.00 0.00 66.02 67.89 1ceb s SER 36 CO -0.04 -1.06 2.08 1.55 0.98 0.00 0.00 173.24 176.75 1ceb h PRO 37 N 2.35 0.00 -0.28 4.02 0.13 -1.79 0.29 132.00 136.71 1ceb h PRO 37 Ca -0.28 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.76 1ceb h PRO 37 Cb 1.25 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.36 1ceb h PRO 37 CO 0.40 0.12 -0.19 0.00 -0.23 0.00 0.00 178.00 178.10 1ceb h ALA 38 N 1.88 1.15 0.00 -0.56 0.00 -1.96 -3.26 119.26 116.51 1ceb h ALA 38 Ca -0.00 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1ceb h ALA 38 Cb 0.27 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1ceb h ALA 38 CO 0.02 0.54 -1.06 2.41 0.00 0.00 0.00 179.25 181.15 1ceb n THR 39 N -4.16 0.00 -3.29 0.00 -1.04 -1.02 -4.67 114.28 100.10 1ceb n THR 39 Ca 0.00 -0.25 -0.25 0.00 -2.04 0.00 0.00 64.05 61.51 1ceb n THR 39 Cb 0.37 0.58 -0.08 0.00 -1.82 0.00 0.00 70.33 69.37 1ceb n THR 39 CO 0.00 0.00 0.00 1.41 -0.64 0.00 0.00 175.07 175.84 1ceb n HIS 40 N -1.60 -0.54 0.33 -1.42 8.25 0.98 -4.96 115.22 116.26 1ceb n HIS 40 Ca -0.00 -3.46 0.14 0.00 -0.26 0.00 0.00 57.72 54.14 1ceb n HIS 40 Cb 0.23 -0.07 0.61 0.00 1.12 0.00 0.00 29.99 31.88 1ceb n HIS 40 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 1ceb h PRO 41 N 4.77 0.00 -0.59 -0.41 0.11 -1.77 -2.88 132.00 131.23 1ceb h PRO 41 Ca 0.16 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.27 1ceb h PRO 41 Cb 0.89 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.00 1ceb h PRO 41 CO 0.43 0.00 0.00 0.43 -0.21 0.00 0.00 178.00 178.65 1ceb n SER 42 N -2.55 3.36 -0.86 -2.05 7.64 -1.26 -4.43 113.62 113.47 1ceb n SER 42 Ca 0.01 -1.99 0.10 0.00 1.01 0.00 0.00 58.87 58.00 1ceb n SER 42 Cb 0.22 -0.39 0.11 0.00 -1.01 0.00 0.00 64.21 63.14 1ceb n SER 42 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1ceb n GLU 43 N 1.35 1.94 -1.56 1.43 -0.58 -1.09 -4.94 120.64 117.19 1ceb n GLU 43 Ca 0.21 -1.80 -0.02 0.00 -0.42 0.00 0.00 57.16 55.13 1ceb n GLU 43 Cb 0.54 -1.40 -0.00 0.00 -0.57 0.00 0.00 31.44 30.00 1ceb n GLU 43 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1ceb n GLY 44 N 1.18 0.40 2.60 0.62 0.00 -1.26 -4.87 105.19 103.85 1ceb n GLY 44 Ca 0.13 -0.92 -0.08 0.00 0.00 0.00 0.00 46.02 45.16 1ceb n GLY 44 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ceb n LEU 45 N -0.20 2.03 -4.87 0.99 4.32 -1.26 -4.80 117.00 113.21 1ceb n LEU 45 Ca -0.02 -1.63 -0.31 0.00 -0.02 0.00 0.00 56.01 54.03 1ceb n LEU 45 Cb 0.29 -0.62 -0.05 0.00 -1.62 0.00 0.00 43.42 41.43 1ceb n LEU 45 CO 0.02 -0.11 0.35 -1.83 -1.22 0.00 0.00 177.39 174.60 1ceb s GLU 46 N 3.38 3.83 0.00 3.23 1.03 -1.26 -4.51 118.70 124.40 1ceb s GLU 46 Ca 0.19 0.42 0.00 0.00 0.03 0.00 0.00 54.97 55.61 1ceb s GLU 46 Cb 0.07 -2.50 0.00 0.00 -0.80 0.00 0.00 34.13 30.90 1ceb s GLU 46 CO -0.01 0.14 0.00 0.39 -1.33 0.00 0.00 175.26 174.45 1ceb n GLU 47 N -0.70 0.00 -0.02 -4.83 -0.58 -1.26 -2.27 120.64 110.98 1ceb n GLU 47 Ca 0.02 0.00 0.02 0.00 -0.42 0.00 0.00 57.16 56.78 1ceb n GLU 47 Cb 0.53 0.00 0.03 0.00 -0.57 0.00 0.00 31.44 31.43 1ceb n GLU 47 CO 0.00 0.00 0.00 0.27 -0.48 0.00 0.00 177.13 176.92 1ceb n ASN 48 N 0.68 1.96 -4.25 1.62 6.94 -1.26 -2.15 115.26 118.80 1ceb n ASN 48 Ca 0.00 -2.20 -0.35 0.00 -0.02 0.00 0.00 54.58 52.01 1ceb n ASN 48 Cb 0.00 -0.10 0.07 0.00 -2.36 0.00 0.00 39.78 37.39 1ceb n ASN 48 CO 0.00 0.00 0.00 -1.22 -1.03 0.00 0.00 177.26 175.01 1ceb n TYR 49 N -0.68 -2.96 -3.02 -2.53 4.01 -0.96 -4.72 117.16 106.30 1ceb n TYR 49 Ca 0.04 0.16 -0.40 0.00 -0.16 0.00 0.00 57.90 57.54 1ceb n TYR 49 Cb 0.36 -1.66 -0.05 0.00 -0.31 0.00 0.00 39.34 37.68 1ceb n TYR 49 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1ceb s ARG 51 N 1.19 0.70 -0.79 0.00 1.81 0.19 -4.69 118.95 117.37 1ceb s ARG 51 Ca 0.37 -1.25 0.02 0.00 -1.72 0.00 0.00 55.73 53.15 1ceb s ARG 51 Cb -0.17 0.02 0.25 0.00 -0.45 0.00 0.00 34.95 34.59 1ceb s ARG 51 CO 0.16 -0.07 0.87 -1.71 -0.68 0.00 0.00 175.30 173.87 1ceb n ASN 52 N 0.09 4.28 -0.12 0.23 5.15 -1.25 -0.84 115.26 122.80 1ceb n ASN 52 Ca -0.13 -3.35 -0.13 0.00 -0.60 0.00 0.00 54.58 50.37 1ceb n ASN 52 Cb 0.61 -0.87 -0.02 0.00 -0.53 0.00 0.00 39.78 38.96 1ceb n ASN 52 CO 0.00 0.00 0.00 -0.65 1.40 0.00 0.00 177.26 178.01 1ceb h PRO 53 N 4.93 0.87 0.00 1.20 0.11 -1.90 -0.79 132.00 136.42 1ceb h PRO 53 Ca 0.19 -0.43 0.00 0.00 0.11 0.00 0.00 66.00 65.87 1ceb h PRO 53 Cb 0.69 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.80 1ceb h PRO 53 CO 0.92 1.07 -0.31 -0.40 -0.21 0.00 0.00 178.00 179.07 1ceb n ASP 54 N -4.16 0.74 -1.75 -2.05 5.75 -1.26 -4.96 116.55 108.86 1ceb n ASP 54 Ca -0.02 0.34 -0.05 0.00 -0.01 0.00 0.00 54.79 55.05 1ceb n ASP 54 Cb 0.49 -0.31 0.03 0.00 -1.03 0.00 0.00 41.12 40.29 1ceb n ASP 54 CO 0.00 0.00 0.00 -3.20 -0.11 0.00 0.00 177.20 173.89 1ceb n ASN 55 N -2.17 -2.05 -4.72 -1.12 4.05 -0.30 -5.03 115.26 103.92 1ceb n ASN 55 Ca 0.04 -0.19 -0.42 0.00 0.45 0.00 0.00 54.58 54.46 1ceb n ASN 55 Cb 0.43 -1.92 -0.03 0.00 1.23 0.00 0.00 39.78 39.50 1ceb n ASN 55 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 177.26 173.59 1ceb s ASP 56 N -3.41 6.62 0.31 1.20 -1.08 -1.26 -4.92 116.67 114.13 1ceb s ASP 56 Ca 0.00 2.58 0.04 0.00 -0.52 0.00 0.00 52.55 54.65 1ceb s ASP 56 Cb -0.00 -2.59 0.63 0.00 -1.46 0.00 0.00 42.92 39.50 1ceb s ASP 56 CO 0.22 -0.80 1.86 1.55 0.52 0.00 0.00 175.17 178.53 1ceb h PRO 57 N 6.78 0.88 0.00 4.34 0.13 -1.95 -2.13 132.00 140.05 1ceb h PRO 57 Ca -0.43 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1ceb h PRO 57 Cb 1.21 -0.20 0.00 0.00 0.13 0.00 0.00 31.00 32.14 1ceb h PRO 57 CO 0.91 0.58 0.00 1.04 -0.23 0.00 0.00 178.00 180.30 1ceb n GLN 58 N -4.57 0.23 0.00 0.86 6.02 -1.26 -4.91 117.38 113.75 1ceb n GLN 58 Ca 0.17 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.16 1ceb n GLN 58 Cb 0.35 -1.23 0.00 0.00 1.02 0.00 0.00 30.24 30.38 1ceb n GLN 58 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1ceb n GLY 59 N -0.39 -1.55 3.31 1.08 0.00 -0.80 -4.92 105.19 101.92 1ceb n GLY 59 Ca 0.03 -1.56 -0.38 0.00 0.00 0.00 0.00 46.02 44.10 1ceb n GLY 59 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1ceb n PRO 60 N -1.76 0.17 -1.77 1.61 -0.02 -1.25 -4.79 135.00 127.19 1ceb n PRO 60 Ca 0.00 0.07 -0.02 0.00 -2.02 0.00 0.00 63.50 61.53 1ceb n PRO 60 Cb 0.00 -1.29 0.00 0.00 -0.02 0.00 0.00 33.50 32.19 1ceb n PRO 60 CO 0.00 0.00 0.00 -2.67 1.98 0.00 0.00 175.50 174.81 1ceb n TRP 61 N -1.76 -1.13 -3.51 6.00 4.27 -0.02 -2.49 117.44 118.82 1ceb n TRP 61 Ca 0.08 -0.46 -0.11 0.00 -3.89 0.00 0.00 57.50 53.12 1ceb n TRP 61 Cb 0.48 0.19 -0.02 0.00 -1.36 0.00 0.00 31.31 30.60 1ceb n TRP 61 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1ceb s TYR 63 N -3.78 3.40 0.34 0.00 2.02 -1.26 -2.80 117.35 115.26 1ceb s TYR 63 Ca 0.03 1.59 0.07 0.00 -0.37 0.00 0.00 57.07 58.39 1ceb s TYR 63 Cb -0.01 -2.82 -0.02 0.00 -0.40 0.00 0.00 41.96 38.71 1ceb s TYR 63 CO -0.10 -0.02 0.37 0.99 -1.57 0.00 0.00 175.55 175.22 1ceb s THR 64 N -2.04 3.76 -2.46 -0.71 2.01 -1.10 0.89 115.64 116.00 1ceb s THR 64 Ca 0.58 -1.21 0.28 0.00 0.31 0.00 0.00 61.69 61.66 1ceb s THR 64 Cb -0.11 -3.28 0.57 0.00 0.01 0.00 0.00 72.50 69.69 1ceb s THR 64 CO 0.16 -0.17 1.78 0.35 -0.69 0.00 0.00 174.62 176.05 1ceb n THR 65 N -1.49 0.00 -3.27 -0.82 -2.24 -0.41 -4.44 114.28 101.62 1ceb n THR 65 Ca -0.01 -0.23 -0.39 0.00 -2.27 0.00 0.00 64.05 61.15 1ceb n THR 65 Cb 0.59 0.43 -0.07 0.00 -2.10 0.00 0.00 70.33 69.18 1ceb n THR 65 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1ceb s ASP 66 N -2.00 6.53 0.21 3.42 2.15 -1.26 -4.78 116.67 120.94 1ceb s ASP 66 Ca 0.39 0.63 0.16 0.00 0.43 0.00 0.00 52.55 54.16 1ceb s ASP 66 Cb 0.21 -2.28 0.82 0.00 -0.30 0.00 0.00 42.92 41.37 1ceb s ASP 66 CO 0.34 -0.17 1.50 -0.81 -0.17 0.00 0.00 175.17 175.86 1ceb n PRO 67 N 4.79 0.11 -0.30 4.34 -0.04 -1.26 -2.10 135.00 140.54 1ceb n PRO 67 Ca -0.05 0.54 0.07 0.00 -0.04 0.00 0.00 63.50 64.02 1ceb n PRO 67 Cb 0.50 -1.80 0.22 0.00 -0.04 0.00 0.00 33.50 32.38 1ceb n PRO 67 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1ceb n GLU 68 N -2.02 2.98 -3.61 0.54 1.02 -1.26 -4.72 120.64 113.57 1ceb n GLU 68 Ca -0.00 -2.37 -0.29 0.00 -0.02 0.00 0.00 57.16 54.48 1ceb n GLU 68 Cb 0.07 -1.48 -0.13 0.00 -0.02 0.00 0.00 31.44 29.88 1ceb n GLU 68 CO 0.00 0.00 0.00 0.21 1.18 0.00 0.00 177.13 178.52 1ceb s LYS 69 N -1.42 0.90 0.18 3.49 2.47 -0.89 -4.99 119.74 119.48 1ceb s LYS 69 Ca 0.33 -1.59 -0.20 0.00 -1.56 0.00 0.00 55.97 52.94 1ceb s LYS 69 Cb 0.20 -1.85 0.11 0.00 -1.46 0.00 0.00 37.83 34.83 1ceb s LYS 69 CO 0.18 -1.16 1.61 -0.09 0.16 0.00 0.00 175.35 176.05 1ceb h ARG 70 N 7.03 -0.17 -3.59 4.03 2.43 -1.85 -3.32 114.38 118.95 1ceb h ARG 70 Ca -0.00 0.01 -0.07 0.00 -0.81 0.00 0.00 59.98 59.11 1ceb h ARG 70 Cb 0.96 0.04 -0.13 0.00 -0.42 0.00 0.00 29.97 30.42 1ceb h ARG 70 CO 0.39 -0.11 -0.18 1.52 -1.51 0.00 0.00 179.97 180.08 1ceb s TYR 71 N -6.06 0.03 -0.01 2.20 1.13 -1.26 -2.70 117.35 110.68 1ceb s TYR 71 Ca -0.15 -0.39 -0.23 0.00 -1.41 0.00 0.00 57.07 54.90 1ceb s TYR 71 Cb 0.15 0.13 0.05 0.00 -1.10 0.00 0.00 41.96 41.19 1ceb s TYR 71 CO 0.69 -0.70 0.51 0.34 -2.51 0.00 0.00 175.55 173.88 1ceb s ASP 72 N -2.86 -0.44 0.65 -0.18 2.15 -1.12 -4.96 116.67 109.91 1ceb s ASP 72 Ca 0.07 0.34 -0.14 0.00 0.43 0.00 0.00 52.55 53.26 1ceb s ASP 72 Cb 0.02 0.45 -0.01 0.00 -0.30 0.00 0.00 42.92 43.09 1ceb s ASP 72 CO -0.08 -0.59 1.07 -0.31 -0.17 0.00 0.00 175.17 175.09 1ceb s TYR 73 N -1.65 2.92 0.18 -5.34 1.51 -1.26 -3.18 117.35 110.53 1ceb s TYR 73 Ca -0.10 1.50 0.08 0.00 -1.01 0.00 0.00 57.07 57.54 1ceb s TYR 73 Cb -0.02 -3.00 -0.04 0.00 -0.11 0.00 0.00 41.96 38.79 1ceb s TYR 73 CO 0.04 -1.31 -0.04 0.00 -1.11 0.00 0.00 175.55 173.13 1ceb s ASP 75 N -2.92 5.96 -0.06 0.00 1.01 -1.26 -4.74 116.67 114.65 1ceb s ASP 75 Ca 0.26 -1.89 0.03 0.00 0.71 0.00 0.00 52.55 51.67 1ceb s ASP 75 Cb -0.09 -2.11 -0.02 0.00 1.01 0.00 0.00 42.92 41.71 1ceb s ASP 75 CO 0.17 -0.77 -0.16 -0.63 0.21 0.00 0.00 175.17 174.00 1ceb s ILE 76 N 1.43 2.90 0.07 0.77 -1.09 -1.26 -5.05 121.20 118.97 1ceb s ILE 76 Ca 0.05 -0.77 -0.14 0.00 -2.23 0.00 0.00 60.65 57.55 1ceb s ILE 76 Cb -0.28 -2.14 -0.06 0.00 -1.58 0.00 0.00 42.46 38.41 1ceb s ILE 76 CO 0.01 0.58 0.47 -0.76 -1.23 0.00 0.00 174.94 174.01 1ceb s LEU 77 N -0.46 4.42 0.80 2.97 1.02 -1.26 -4.86 118.68 121.30 1ceb s LEU 77 Ca 0.06 1.01 -0.14 0.00 0.02 0.00 0.00 54.13 55.08 1ceb s LEU 77 Cb -0.12 -2.92 0.04 0.00 0.02 0.00 0.00 46.19 43.22 1ceb s LEU 77 CO 0.02 0.22 0.95 -0.62 0.02 0.00 0.00 176.35 176.93 1ceb n GLU 78 N 1.32 0.20 0.00 1.70 -0.58 -1.26 -2.23 120.64 119.79 1ceb n GLU 78 Ca -0.10 0.13 0.14 0.00 -0.42 0.00 0.00 57.16 56.92 1ceb n GLU 78 Cb 0.52 -2.22 0.52 0.00 -0.57 0.00 0.00 31.44 29.68 1ceb n GLU 78 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65