#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2d8y s SER 2 N 0.00 0.18 0.21 1.61 0.01 -1.26 -5.17 113.70 109.29 2d8y s SER 2 Ca 0.00 -1.30 -0.06 0.00 1.31 0.00 0.00 55.95 55.91 2d8y s SER 2 Cb 0.00 0.45 -0.06 0.00 0.21 0.00 0.00 66.02 66.62 2d8y s SER 2 CO 0.00 -0.94 0.48 -0.44 0.41 0.00 0.00 173.24 172.75 2d8y s SER 3 N -3.14 6.51 -0.04 2.44 0.01 -1.26 -5.10 113.70 113.12 2d8y s SER 3 Ca 0.35 0.70 0.06 0.00 1.31 0.00 0.00 55.95 58.37 2d8y s SER 3 Cb 0.05 -2.14 -0.01 0.00 0.21 0.00 0.00 66.02 64.13 2d8y s SER 3 CO 0.12 -0.06 -0.24 -0.83 0.41 0.00 0.00 173.24 172.64 2d8y s GLY 4 N -2.69 1.21 -0.43 3.44 0.00 -1.26 -5.03 107.32 102.57 2d8y s GLY 4 Ca 0.43 -0.99 0.04 0.00 0.00 0.00 0.00 44.72 44.20 2d8y s GLY 4 CO 0.26 -0.67 1.47 1.44 0.00 0.00 0.00 173.10 175.60 2d8y n SER 5 N 2.85 5.85 -3.69 1.64 7.64 -1.26 -4.96 113.62 121.68 2d8y n SER 5 Ca -0.17 -3.76 -0.10 0.00 1.01 0.00 0.00 58.87 55.84 2d8y n SER 5 Cb 0.52 -0.56 -0.11 0.00 -1.01 0.00 0.00 64.21 63.05 2d8y n SER 5 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2d8y s SER 6 N -2.99 -0.52 -0.05 6.43 0.01 -1.26 -5.15 113.70 110.17 2d8y s SER 6 Ca 0.55 0.90 -0.02 0.00 1.31 0.00 0.00 55.95 58.70 2d8y s SER 6 Cb 0.44 0.79 0.04 0.00 0.21 0.00 0.00 66.02 67.50 2d8y s SER 6 CO 0.00 -0.19 0.10 -0.83 0.41 0.00 0.00 173.24 172.73 2d8y s GLY 7 N 1.43 0.06 -0.25 3.44 0.00 -1.26 -5.10 107.32 105.65 2d8y s GLY 7 Ca -0.09 0.47 -0.33 0.00 0.00 0.00 0.00 44.72 44.76 2d8y s GLY 7 CO -0.13 1.12 2.12 1.03 0.00 0.00 0.00 173.10 177.24 2d8y n MET 8 N 4.62 1.61 -2.68 2.90 2.00 -1.26 -4.90 117.12 119.40 2d8y n MET 8 Ca -0.19 0.49 -0.43 0.00 0.00 0.00 0.00 57.70 57.57 2d8y n MET 8 Cb 0.50 -2.73 -0.02 0.00 0.00 0.00 0.00 33.22 30.97 2d8y n MET 8 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 175.97 176.12 2d8y s LYS 9 N 5.71 4.33 0.19 0.03 -0.14 -1.26 -4.85 119.74 123.75 2d8y s LYS 9 Ca 1.03 1.36 0.00 0.00 -1.36 0.00 0.00 55.97 57.00 2d8y s LYS 9 Cb -0.67 -3.60 0.00 0.00 -1.68 0.00 0.00 37.83 31.89 2d8y s LYS 9 CO 0.46 -0.49 0.00 0.34 -0.76 0.00 0.00 175.35 174.90 2d8y n PHE 10 N 5.74 -1.40 -3.21 3.18 7.35 -1.26 -5.07 117.46 122.79 2d8y n PHE 10 Ca 0.10 0.25 -0.39 0.00 -0.76 0.00 0.00 57.45 56.65 2d8y n PHE 10 Cb 0.47 0.35 -0.06 0.00 0.35 0.00 0.00 39.48 40.60 2d8y n PHE 10 CO 0.00 0.00 0.00 -0.65 -0.76 0.00 0.00 176.76 175.35 2d8y s GLN 11 N -2.00 4.32 -0.04 -4.13 -1.52 -1.26 -5.01 119.66 110.02 2d8y s GLN 11 Ca 0.00 0.71 -0.04 0.00 -1.95 0.00 0.00 55.36 54.08 2d8y s GLN 11 Cb 0.00 -3.36 -0.02 0.00 -0.22 0.00 0.00 33.01 29.41 2d8y s GLN 11 CO 0.00 0.32 0.25 0.00 -0.25 0.00 0.00 175.29 175.62 2d8y h ALA 12 N 5.84 -0.23 0.15 6.09 0.00 -2.03 -3.40 119.26 125.68 2d8y h ALA 12 Ca -0.44 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.42 2d8y h ALA 12 Cb 1.20 0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.05 2d8y h ALA 12 CO 0.71 -0.22 -0.07 -1.00 0.00 0.00 0.00 179.25 178.67 2d8y h PRO 13 N -0.64 -0.19 -1.47 0.00 0.13 -2.07 -3.49 132.00 124.26 2d8y h PRO 13 Ca -0.02 0.01 0.34 0.00 -0.87 0.00 0.00 66.00 65.46 2d8y h PRO 13 Cb 0.12 0.04 -0.12 0.00 0.13 0.00 0.00 31.00 31.18 2d8y h PRO 13 CO 0.03 0.22 0.86 0.00 -0.23 0.00 0.00 178.00 178.88 2d8y s ALA 14 N -4.27 -2.30 0.26 -0.56 0.00 -1.26 -5.19 121.76 108.44 2d8y s ALA 14 Ca -0.14 0.65 0.01 0.00 0.00 0.00 0.00 51.96 52.48 2d8y s ALA 14 Cb 0.01 0.40 -0.04 0.00 0.00 0.00 0.00 23.12 23.50 2d8y s ALA 14 CO 0.57 -1.07 0.13 -0.98 0.00 0.00 0.00 175.76 174.42 2d8y s ARG 15 N -2.33 1.41 0.60 0.00 1.70 -1.26 -4.76 118.95 114.31 2d8y s ARG 15 Ca 0.16 -1.78 0.00 0.00 -0.47 0.00 0.00 55.73 53.65 2d8y s ARG 15 Cb 0.05 -0.02 0.06 0.00 -0.57 0.00 0.00 34.95 34.46 2d8y s ARG 15 CO -0.04 -0.39 0.84 -1.21 -1.08 0.00 0.00 175.30 173.42 2d8y s GLU 16 N -3.98 2.34 -0.11 3.89 0.41 -1.26 -5.08 118.70 114.90 2d8y s GLU 16 Ca 0.38 -0.82 -0.21 0.00 -0.41 0.00 0.00 54.97 53.91 2d8y s GLU 16 Cb 0.06 -2.43 0.05 0.00 -1.78 0.00 0.00 34.13 30.03 2d8y s GLU 16 CO 0.15 -0.91 0.51 0.99 -0.49 0.00 0.00 175.26 175.51 2d8y s THR 17 N -2.88 0.01 0.21 3.63 2.01 -1.26 -3.51 115.64 113.86 2d8y s THR 17 Ca 0.59 -0.12 -0.31 0.00 0.31 0.00 0.00 61.69 62.17 2d8y s THR 17 Cb -0.09 -0.77 -0.10 0.00 0.01 0.00 0.00 72.50 71.54 2d8y s THR 17 CO 0.40 -0.07 1.49 0.00 -0.69 0.00 0.00 174.62 175.75 2d8y n VAL 19 N 2.98 0.76 0.03 0.00 0.24 -0.83 -1.87 118.33 119.64 2d8y n VAL 19 Ca 0.09 -0.46 -0.00 0.00 -2.04 0.00 0.00 64.34 61.93 2d8y n VAL 19 Cb 0.40 -0.16 -0.00 0.00 -1.47 0.00 0.00 33.84 32.61 2d8y n VAL 19 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 2d8y n GLU 20 N 0.27 0.02 0.00 7.34 1.02 -1.26 -4.81 120.64 123.22 2d8y n GLU 20 Ca 0.10 0.01 0.11 0.00 -0.02 0.00 0.00 57.16 57.36 2d8y n GLU 20 Cb 0.45 -0.41 0.10 0.00 -0.02 0.00 0.00 31.44 31.56 2d8y n GLU 20 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2d8y n GLN 22 N -1.22 -4.06 -4.28 0.00 1.13 -0.78 -5.01 117.38 103.15 2d8y n GLN 22 Ca 0.06 0.78 -0.21 0.00 -1.94 0.00 0.00 57.00 55.69 2d8y n GLN 22 Cb 0.35 -5.48 -0.12 0.00 0.11 0.00 0.00 30.24 25.10 2d8y n GLN 22 CO 0.00 0.00 0.00 0.15 -1.44 0.00 0.00 177.06 175.77 2d8y s LYS 23 N -4.75 1.12 -0.44 -1.09 1.02 -1.25 -4.84 119.74 109.51 2d8y s LYS 23 Ca 0.20 -1.24 -0.26 0.00 0.02 0.00 0.00 55.97 54.69 2d8y s LYS 23 Cb -0.03 -1.20 -0.07 0.00 -0.52 0.00 0.00 37.83 36.02 2d8y s LYS 23 CO 0.66 0.25 2.38 2.41 -0.92 0.00 0.00 175.35 180.14 2d8y n THR 24 N 0.71 -0.00 -2.41 2.17 -1.04 -1.26 -0.28 114.28 112.18 2d8y n THR 24 Ca -0.17 -0.74 -0.42 0.00 -2.04 0.00 0.00 64.05 60.68 2d8y n THR 24 Cb 0.56 -2.77 -0.03 0.00 -1.82 0.00 0.00 70.33 66.27 2d8y n THR 24 CO 0.00 0.00 0.00 -0.69 -0.64 0.00 0.00 175.07 173.74 2d8y s VAL 25 N 11.49 4.17 0.62 12.58 1.01 -1.23 -4.91 120.40 144.12 2d8y s VAL 25 Ca 0.99 1.48 -0.09 0.00 0.00 0.00 0.00 61.98 64.36 2d8y s VAL 25 Cb -0.21 -3.96 -0.01 0.00 0.00 0.00 0.00 36.38 32.21 2d8y s VAL 25 CO 0.28 -0.04 0.98 -0.31 0.00 0.00 0.00 175.10 176.00 2d8y s TYR 26 N 2.68 3.44 -2.00 5.22 1.51 -1.26 -4.66 117.35 122.28 2d8y s TYR 26 Ca 0.57 0.99 0.11 0.00 -1.01 0.00 0.00 57.07 57.72 2d8y s TYR 26 Cb -0.25 -2.76 0.63 0.00 -0.11 0.00 0.00 41.96 39.47 2d8y s TYR 26 CO 0.20 -0.80 1.07 -0.35 -1.11 0.00 0.00 175.55 174.56 2d8y n PRO 27 N -2.71 0.49 -0.05 -1.71 -0.04 -1.26 -1.67 135.00 128.06 2d8y n PRO 27 Ca 0.05 0.00 -0.02 0.00 -0.04 0.00 0.00 63.50 63.49 2d8y n PRO 27 Cb 0.56 -1.34 -0.12 0.00 -0.04 0.00 0.00 33.50 32.57 2d8y n PRO 27 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2d8y n MET 28 N -0.84 1.24 -0.38 0.54 0.00 -1.26 -4.53 117.12 111.90 2d8y n MET 28 Ca 0.08 -0.05 0.08 0.00 0.00 0.00 0.00 57.70 57.80 2d8y n MET 28 Cb 0.04 -1.37 0.17 0.00 0.00 0.00 0.00 33.22 32.06 2d8y n MET 28 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 175.97 175.12 2d8y n GLU 29 N -2.36 1.40 -2.88 3.17 0.28 -0.92 -4.98 120.64 114.35 2d8y n GLU 29 Ca -0.16 -2.92 -0.43 0.00 -0.16 0.00 0.00 57.16 53.49 2d8y n GLU 29 Cb 0.77 -1.52 -0.04 0.00 1.43 0.00 0.00 31.44 32.08 2d8y n GLU 29 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 177.13 177.47 2d8y s ARG 30 N -2.97 3.15 -0.34 3.44 3.52 -0.67 -3.79 118.95 121.30 2d8y s ARG 30 Ca 0.35 -0.75 -0.08 0.00 -0.13 0.00 0.00 55.73 55.11 2d8y s ARG 30 Cb 0.32 -4.19 0.02 0.00 -1.56 0.00 0.00 34.95 29.55 2d8y s ARG 30 CO -0.03 -1.72 0.14 -1.17 -0.81 0.00 0.00 175.30 171.72 2d8y s LEU 31 N 3.91 4.32 0.07 -0.88 0.20 0.34 -4.95 118.68 121.69 2d8y s LEU 31 Ca 0.23 -0.91 -0.31 0.00 0.69 0.00 0.00 54.13 53.83 2d8y s LEU 31 Cb -0.17 -1.94 -0.07 0.00 -0.43 0.00 0.00 46.19 43.59 2d8y s LEU 31 CO 0.12 -0.30 1.34 -0.22 -0.29 0.00 0.00 176.35 177.00 2d8y s LEU 32 N 1.50 4.36 -0.21 -0.68 1.98 -1.26 -0.61 118.68 123.76 2d8y s LEU 32 Ca 0.01 2.19 -0.04 0.00 -2.89 0.00 0.00 54.13 53.41 2d8y s LEU 32 Cb -0.19 -3.58 0.11 0.00 0.66 0.00 0.00 46.19 43.20 2d8y s LEU 32 CO 0.04 -0.63 0.33 0.00 -1.89 0.00 0.00 176.35 174.21 2d8y s ALA 33 N 1.44 -0.83 -1.22 5.97 0.00 -0.04 -4.91 121.76 122.18 2d8y s ALA 33 Ca 0.63 0.84 -0.05 0.00 0.00 0.00 0.00 51.96 53.38 2d8y s ALA 33 Cb -0.34 -1.45 0.01 0.00 0.00 0.00 0.00 23.12 21.34 2d8y s ALA 33 CO 0.29 -1.10 1.04 0.09 0.00 0.00 0.00 175.76 176.09 2d8y n ASN 34 N 5.36 -4.28 -3.48 0.00 4.13 -1.26 -2.20 115.26 113.52 2d8y n ASN 34 Ca -0.05 -0.55 -0.25 0.00 1.68 0.00 0.00 54.58 55.42 2d8y n ASN 34 Cb 0.50 -4.83 0.05 0.00 -1.54 0.00 0.00 39.78 33.96 2d8y n ASN 34 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2d8y n GLN 35 N -4.40 -6.32 -3.80 3.52 6.02 -1.26 -4.98 117.38 106.15 2d8y n GLN 35 Ca -0.12 0.79 -0.12 0.00 -0.01 0.00 0.00 57.00 57.53 2d8y n GLN 35 Cb 0.60 -5.73 -0.09 0.00 1.02 0.00 0.00 30.24 26.04 2d8y n GLN 35 CO 0.00 0.00 0.00 -0.65 -1.01 0.00 0.00 177.06 175.40 2d8y s GLN 36 N -6.18 0.64 -0.23 -1.09 -0.21 -0.94 -5.13 119.66 106.52 2d8y s GLN 36 Ca 0.51 -0.34 -0.29 0.00 0.02 0.00 0.00 55.36 55.26 2d8y s GLN 36 Cb -0.24 0.28 0.01 0.00 1.00 0.00 0.00 33.01 34.06 2d8y s GLN 36 CO 0.63 -0.18 1.04 0.08 -2.12 0.00 0.00 175.29 174.75 2d8y s VAL 37 N -1.64 4.68 0.10 1.09 1.01 -1.26 -0.86 120.40 123.51 2d8y s VAL 37 Ca -0.12 2.02 0.07 0.00 0.00 0.00 0.00 61.98 63.95 2d8y s VAL 37 Cb -0.05 -4.31 -0.03 0.00 0.00 0.00 0.00 36.38 31.99 2d8y s VAL 37 CO 0.02 -0.19 -0.17 -0.36 0.00 0.00 0.00 175.10 174.40 2d8y s PHE 38 N 3.21 1.51 -0.09 5.22 0.08 0.22 -1.96 117.98 126.16 2d8y s PHE 38 Ca 0.44 -0.46 -0.22 0.00 0.12 0.00 0.00 56.93 56.81 2d8y s PHE 38 Cb -0.15 -0.82 -0.03 0.00 -0.57 0.00 0.00 43.02 41.44 2d8y s PHE 38 CO 0.06 0.15 0.66 -1.01 -0.10 0.00 0.00 175.22 174.98 2d8y s HIS 39 N -1.42 3.54 0.65 0.36 3.76 -1.26 -0.51 115.29 120.41 2d8y s HIS 39 Ca 0.04 1.16 0.14 0.00 -0.15 0.00 0.00 55.06 56.25 2d8y s HIS 39 Cb -0.09 -2.77 0.73 0.00 1.11 0.00 0.00 32.58 31.56 2d8y s HIS 39 CO 0.03 0.05 1.40 0.82 -0.85 0.00 0.00 174.74 176.19 2d8y h ILE 40 N 4.82 0.02 0.00 0.60 5.03 -1.91 0.14 117.51 126.22 2d8y h ILE 40 Ca -0.39 0.00 -0.33 0.00 -0.12 0.00 0.00 64.86 64.02 2d8y h ILE 40 Cb 1.18 0.26 -0.05 0.00 -3.03 0.00 0.00 36.82 35.19 2d8y h ILE 40 CO 0.76 0.00 -1.99 -1.20 -0.68 0.00 0.00 178.15 175.04 2d8y n SER 41 N -2.77 1.93 -0.34 1.72 7.64 -1.26 -4.45 113.62 116.09 2d8y n SER 41 Ca 0.02 0.37 0.11 0.00 1.01 0.00 0.00 58.87 60.38 2d8y n SER 41 Cb 0.82 -0.83 0.32 0.00 -1.01 0.00 0.00 64.21 63.50 2d8y n SER 41 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2d8y n PHE 43 N -4.66 0.59 -4.03 0.00 7.35 0.32 -4.82 117.46 112.20 2d8y n PHE 43 Ca 0.21 0.14 -0.10 0.00 -0.76 0.00 0.00 57.45 56.94 2d8y n PHE 43 Cb 0.50 -1.79 -0.08 0.00 0.35 0.00 0.00 39.48 38.46 2d8y n PHE 43 CO 0.00 0.00 0.00 1.03 -0.76 0.00 0.00 176.76 177.03 2d8y s ARG 44 N 8.17 1.18 0.35 -4.13 0.52 -1.26 -1.30 118.95 122.47 2d8y s ARG 44 Ca 1.22 -1.29 -0.27 0.00 -0.52 0.00 0.00 55.73 54.87 2d8y s ARG 44 Cb -0.76 0.35 -0.09 0.00 0.52 0.00 0.00 34.95 34.97 2d8y s ARG 44 CO 0.42 -0.42 1.10 0.00 0.02 0.00 0.00 175.30 176.41 2d8y n SER 46 N 0.53 2.79 0.11 0.00 2.88 0.66 -1.70 113.62 118.90 2d8y n SER 46 Ca 0.02 -2.23 0.00 0.00 -1.33 0.00 0.00 58.87 55.33 2d8y n SER 46 Cb 0.47 -0.55 0.00 0.00 -0.75 0.00 0.00 64.21 63.38 2d8y n SER 46 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2d8y n TYR 47 N 0.20 -1.80 -0.04 0.66 4.19 -1.26 -4.92 117.16 114.19 2d8y n TYR 47 Ca 0.08 0.32 -0.01 0.00 3.31 0.00 0.00 57.90 61.61 2d8y n TYR 47 Cb 0.62 0.44 -0.14 0.00 0.49 0.00 0.00 39.34 40.75 2d8y n TYR 47 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 2d8y n ASN 49 N -2.63 -2.73 -4.32 0.00 2.85 -0.69 -4.97 115.26 102.78 2d8y n ASN 49 Ca -0.18 -0.25 -0.33 0.00 -0.11 0.00 0.00 54.58 53.71 2d8y n ASN 49 Cb 0.89 -2.31 -0.15 0.00 1.24 0.00 0.00 39.78 39.46 2d8y n ASN 49 CO 0.00 0.00 0.00 0.20 -2.11 0.00 0.00 177.26 175.35 2d8y s ASN 50 N -3.38 3.89 0.17 1.20 0.01 -1.26 -4.77 114.94 110.81 2d8y s ASN 50 Ca 0.07 -0.40 -0.32 0.00 -0.71 0.00 0.00 52.86 51.51 2d8y s ASN 50 Cb -0.01 -1.61 -0.16 0.00 0.41 0.00 0.00 41.25 39.88 2d8y s ASN 50 CO 0.28 0.11 0.99 1.17 -1.51 0.00 0.00 177.10 178.14 2d8y n LYS 51 N 3.91 0.80 -3.23 -0.60 4.81 -1.26 -3.18 118.16 119.42 2d8y n LYS 51 Ca -0.19 0.28 -0.14 0.00 -0.87 0.00 0.00 58.31 57.39 2d8y n LYS 51 Cb 0.52 -1.65 -0.03 0.00 0.02 0.00 0.00 35.03 33.88 2d8y n LYS 51 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 2d8y n LEU 52 N 1.82 0.00 -3.74 3.14 4.77 -0.42 -4.95 117.00 117.62 2d8y n LEU 52 Ca 0.15 -1.49 -0.13 0.00 -0.03 0.00 0.00 56.01 54.52 2d8y n LEU 52 Cb 0.24 0.24 -0.08 0.00 -2.33 0.00 0.00 43.42 41.49 2d8y n LEU 52 CO 0.60 -0.22 0.05 -0.44 -1.33 0.00 0.00 177.39 176.06 2d8y s SER 53 N -2.28 -0.20 -0.71 -1.43 0.01 -1.26 -4.95 113.70 102.88 2d8y s SER 53 Ca 0.02 0.01 -0.30 0.00 1.31 0.00 0.00 55.95 57.00 2d8y s SER 53 Cb 0.00 0.35 -0.15 0.00 0.21 0.00 0.00 66.02 66.43 2d8y s SER 53 CO 0.02 -0.53 2.52 0.18 0.41 0.00 0.00 173.24 175.83 2d8y n LEU 54 N 0.96 1.29 0.00 2.44 4.77 -1.26 -1.47 117.00 123.73 2d8y n LEU 54 Ca -0.20 -0.04 0.00 0.00 -0.03 0.00 0.00 56.01 55.74 2d8y n LEU 54 Cb 0.57 -1.21 0.00 0.00 -2.33 0.00 0.00 43.42 40.45 2d8y n LEU 54 CO 0.22 -1.05 0.00 0.61 -1.33 0.00 0.00 177.39 175.84 2d8y n GLY 55 N 6.35 4.35 0.12 -0.72 0.00 -1.26 -4.94 105.19 109.09 2d8y n GLY 55 Ca 0.52 -0.69 -0.15 0.00 0.00 0.00 0.00 46.02 45.69 2d8y n GLY 55 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2d8y n THR 56 N 0.00 1.56 -0.94 2.61 5.66 -0.54 -4.97 114.28 117.65 2d8y n THR 56 Ca 0.00 -0.71 -0.34 0.00 -3.05 0.00 0.00 64.05 59.96 2d8y n THR 56 Cb 0.00 -1.18 0.11 0.00 -1.55 0.00 0.00 70.33 67.71 2d8y n THR 56 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2d8y n TYR 57 N -3.15 -0.67 -3.43 1.09 4.11 -1.19 -3.67 117.16 110.25 2d8y n TYR 57 Ca -0.34 0.30 -0.06 0.00 -0.00 0.00 0.00 57.90 57.80 2d8y n TYR 57 Cb 1.06 -1.88 -0.07 0.00 -0.00 0.00 0.00 39.34 38.44 2d8y n TYR 57 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 2d8y s ALA 58 N -2.26 -1.37 -0.09 -3.48 0.00 -0.24 -4.91 121.76 109.40 2d8y s ALA 58 Ca 0.62 1.35 -0.03 0.00 0.00 0.00 0.00 51.96 53.90 2d8y s ALA 58 Cb -0.26 -1.66 -0.04 0.00 0.00 0.00 0.00 23.12 21.17 2d8y s ALA 58 CO 0.62 -1.10 0.05 0.45 0.00 0.00 0.00 175.76 175.78 2d8y s SER 59 N 2.64 5.61 0.00 0.00 0.15 -1.26 -0.71 113.70 120.14 2d8y s SER 59 Ca 0.08 0.25 0.00 0.00 0.70 0.00 0.00 55.95 56.98 2d8y s SER 59 Cb -0.14 -1.66 0.00 0.00 -1.71 0.00 0.00 66.02 62.51 2d8y s SER 59 CO -0.16 0.38 0.00 -0.11 1.20 0.00 0.00 173.24 174.56 2d8y n LEU 60 N 2.05 0.00 -2.17 3.45 7.94 -1.13 -4.84 117.00 122.30 2d8y n LEU 60 Ca -0.19 0.00 -0.30 0.00 -1.11 0.00 0.00 56.01 54.42 2d8y n LEU 60 Cb 0.54 -0.10 0.07 0.00 0.53 0.00 0.00 43.42 44.46 2d8y n LEU 60 CO 0.29 -0.44 0.98 1.41 -1.11 0.00 0.00 177.39 178.53 2d8y n HIS 61 N -2.33 2.97 0.00 1.96 8.25 -1.26 -4.85 115.22 119.96 2d8y n HIS 61 Ca 0.00 -2.66 0.00 0.00 -0.26 0.00 0.00 57.72 54.80 2d8y n HIS 61 Cb 0.00 -1.02 0.00 0.00 1.12 0.00 0.00 29.99 30.09 2d8y n HIS 61 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2d8y n GLY 62 N -0.86 3.19 3.85 -1.41 0.00 -1.26 -5.05 105.19 103.65 2d8y n GLY 62 Ca 0.55 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 46.23 2d8y n GLY 62 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2d8y s ARG 63 N -0.40 3.98 0.36 1.61 0.52 -1.26 -5.02 118.95 118.73 2d8y s ARG 63 Ca 0.00 0.53 -0.06 0.00 -0.52 0.00 0.00 55.73 55.67 2d8y s ARG 63 Cb 0.00 -2.74 -0.05 0.00 0.52 0.00 0.00 34.95 32.68 2d8y s ARG 63 CO 0.00 0.36 0.66 0.42 0.02 0.00 0.00 175.30 176.75 2d8y s ILE 64 N -1.68 4.94 -0.11 1.52 -1.09 -1.26 -2.83 121.20 120.69 2d8y s ILE 64 Ca 0.45 0.21 -0.21 0.00 -2.23 0.00 0.00 60.65 58.87 2d8y s ILE 64 Cb -0.13 -3.77 0.05 0.00 -1.58 0.00 0.00 42.46 37.03 2d8y s ILE 64 CO 0.20 -0.49 0.51 -0.31 -1.23 0.00 0.00 174.94 173.61 2d8y s TYR 65 N -2.30 -0.49 0.47 3.97 2.02 0.12 -0.24 117.35 120.89 2d8y s TYR 65 Ca 0.46 1.01 -0.20 0.00 -0.37 0.00 0.00 57.07 57.97 2d8y s TYR 65 Cb -0.10 0.23 -0.09 0.00 -0.40 0.00 0.00 41.96 41.59 2d8y s TYR 65 CO 0.33 -0.40 0.99 0.00 -1.57 0.00 0.00 175.55 174.91 2d8y h LYS 67 N 1.62 0.07 -0.05 0.00 1.79 -1.91 0.35 116.57 118.44 2d8y h LYS 67 Ca -0.49 -0.00 0.01 0.00 -2.18 0.00 0.00 60.65 57.99 2d8y h LYS 67 Cb 1.20 -0.02 -0.02 0.00 -1.58 0.00 0.00 32.23 31.81 2d8y h LYS 67 CO 0.60 0.05 -0.16 -1.35 -1.08 0.00 0.00 179.45 177.51 2d8y h PRO 68 N 0.07 -0.15 -0.22 3.15 0.11 -1.93 0.30 132.00 133.34 2d8y h PRO 68 Ca 0.45 0.01 -0.01 0.00 0.11 0.00 0.00 66.00 66.56 2d8y h PRO 68 Cb 0.80 0.03 -0.01 0.00 0.11 0.00 0.00 31.00 31.93 2d8y h PRO 68 CO -0.75 -0.10 0.10 0.45 -0.21 0.00 0.00 178.00 177.49 2d8y h HIS 69 N -0.16 0.32 -0.37 0.65 3.86 -1.82 -2.54 115.15 115.09 2d8y h HIS 69 Ca 0.01 -0.02 0.07 0.00 -1.16 0.00 0.00 60.37 59.27 2d8y h HIS 69 Cb 0.19 -0.10 -0.09 0.00 1.06 0.00 0.00 27.41 28.47 2d8y h HIS 69 CO -0.51 0.33 -0.37 0.35 0.86 0.00 0.00 177.93 178.59 2d8y h PHE 70 N 0.22 -1.06 0.00 2.45 3.04 -0.11 0.99 116.94 122.46 2d8y h PHE 70 Ca 0.07 0.06 0.00 0.00 3.98 0.00 0.00 57.97 62.08 2d8y h PHE 70 Cb 0.14 0.52 0.00 0.00 2.56 0.00 0.00 35.95 39.16 2d8y h PHE 70 CO -0.02 -0.41 0.00 0.09 -2.02 0.00 0.00 178.31 175.95 2d8y n ASN 71 N -5.42 0.00 -0.07 0.41 3.02 0.10 0.62 115.26 113.92 2d8y n ASN 71 Ca -0.00 -0.72 -0.07 0.00 -0.03 0.00 0.00 54.58 53.75 2d8y n ASN 71 Cb 0.35 0.00 -0.11 0.00 -0.61 0.00 0.00 39.78 39.41 2d8y n ASN 71 CO 0.00 0.00 0.00 1.67 -2.62 0.00 0.00 177.26 176.31 2d8y n GLN 72 N -0.89 1.63 -0.08 3.52 7.27 0.29 -4.06 117.38 125.06 2d8y n GLN 72 Ca 0.11 0.00 -0.08 0.00 0.07 0.00 0.00 57.00 57.11 2d8y n GLN 72 Cb 0.05 -1.35 -0.13 0.00 2.41 0.00 0.00 30.24 31.22 2d8y n GLN 72 CO 0.00 0.00 0.00 1.28 0.07 0.00 0.00 177.06 178.41 2d8y n LEU 73 N -2.56 0.00 -0.06 1.69 4.77 0.17 -3.98 117.00 117.03 2d8y n LEU 73 Ca -0.23 -0.00 -0.08 0.00 -0.03 0.00 0.00 56.01 55.66 2d8y n LEU 73 Cb 0.93 0.40 -0.08 0.00 -2.33 0.00 0.00 43.42 42.35 2d8y n LEU 73 CO 0.28 0.40 0.21 -0.26 -1.33 0.00 0.00 177.39 176.69 2d8y h PHE 74 N 0.00 0.00 -0.91 -1.77 -1.00 -0.01 -3.35 116.94 109.90 2d8y h PHE 74 Ca -0.44 0.00 0.01 0.00 2.81 0.00 0.00 57.97 60.35 2d8y h PHE 74 Cb 2.00 0.00 -0.05 0.00 3.61 0.00 0.00 35.95 41.51 2d8y h PHE 74 CO 0.00 0.59 0.60 -0.22 -1.61 0.00 0.00 178.31 177.67 2d8y h LYS 75 N -1.00 1.21 -6.39 1.51 1.63 -1.70 -3.38 116.57 108.44 2d8y h LYS 75 Ca -0.00 -0.08 -0.54 0.00 -0.85 0.00 0.00 60.65 59.18 2d8y h LYS 75 Cb 0.59 -0.27 -0.06 0.00 -0.60 0.00 0.00 32.23 31.89 2d8y h LYS 75 CO -0.00 0.80 1.10 -1.12 -3.45 0.00 0.00 179.45 176.78 2d8y s SER 76 N -6.21 6.11 0.28 4.20 0.01 -1.26 -4.95 113.70 111.89 2d8y s SER 76 Ca -0.12 0.19 -0.08 0.00 1.31 0.00 0.00 55.95 57.25 2d8y s SER 76 Cb 0.18 -2.55 -0.00 0.00 0.21 0.00 0.00 66.02 63.86 2d8y s SER 76 CO 0.81 -1.74 0.46 -0.75 0.41 0.00 0.00 173.24 172.43 2d8y s LYS 77 N 5.57 1.68 0.00 12.44 2.20 -1.26 -4.81 119.74 135.56 2d8y s LYS 77 Ca 0.50 -1.47 0.00 0.00 -0.36 0.00 0.00 55.97 54.64 2d8y s LYS 77 Cb -0.10 0.45 0.00 0.00 -1.51 0.00 0.00 37.83 36.67 2d8y s LYS 77 CO 0.24 -0.69 0.00 0.41 -0.36 0.00 0.00 175.35 174.94 2d8y n GLY 78 N -0.44 0.01 3.83 5.54 0.00 -1.26 -5.10 105.19 107.77 2d8y n GLY 78 Ca -0.01 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.69 2d8y n GLY 78 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2d8y s ASN 79 N -2.76 6.47 0.14 1.61 4.22 -1.26 -5.08 114.94 118.28 2d8y s ASN 79 Ca 0.00 1.65 0.09 0.00 -2.14 0.00 0.00 52.86 52.45 2d8y s ASN 79 Cb 0.00 -2.52 -0.04 0.00 1.28 0.00 0.00 41.25 39.97 2d8y s ASN 79 CO 0.00 -0.69 -0.21 -0.31 -2.04 0.00 0.00 177.10 173.85 2d8y s TYR 80 N -2.53 1.91 0.09 1.54 2.02 -1.26 -5.15 117.35 113.97 2d8y s TYR 80 Ca 0.60 -0.42 -0.03 0.00 -0.37 0.00 0.00 57.07 56.85 2d8y s TYR 80 Cb -0.11 -1.00 -0.03 0.00 -0.40 0.00 0.00 41.96 40.41 2d8y s TYR 80 CO 0.30 0.29 0.06 0.34 -1.57 0.00 0.00 175.55 174.98 2d8y s ASP 81 N -2.26 0.34 -0.47 2.29 2.15 -1.26 -5.05 116.67 112.40 2d8y s ASP 81 Ca 0.12 -1.00 0.03 0.00 0.43 0.00 0.00 52.55 52.14 2d8y s ASP 81 Cb -0.08 0.27 0.57 0.00 -0.30 0.00 0.00 42.92 43.38 2d8y s ASP 81 CO 0.06 -0.69 1.83 -1.84 -0.17 0.00 0.00 175.17 174.36 2d8y n GLU 82 N -0.01 2.36 0.00 4.34 0.28 -1.26 -4.78 120.64 121.58 2d8y n GLU 82 Ca -0.11 -3.18 0.00 0.00 -0.16 0.00 0.00 57.16 53.71 2d8y n GLU 82 Cb 0.62 -2.15 0.00 0.00 1.43 0.00 0.00 31.44 31.34 2d8y n GLU 82 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2d8y n GLY 83 N -1.06 -2.98 0.14 -1.84 0.00 -1.26 -3.56 105.19 94.63 2d8y n GLY 83 Ca 0.55 0.17 -0.07 0.00 0.00 0.00 0.00 46.02 46.68 2d8y n GLY 83 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 2d8y h PHE 84 N 0.00 -0.18 -0.81 1.61 0.04 -2.07 -3.43 116.94 112.11 2d8y h PHE 84 Ca 0.00 0.03 -0.59 0.00 2.80 0.00 0.00 57.97 60.21 2d8y h PHE 84 Cb 0.00 0.13 0.07 0.00 2.20 0.00 0.00 35.95 38.34 2d8y h PHE 84 CO -0.01 -0.14 -0.20 0.41 -0.60 0.00 0.00 178.31 177.76 2d8y n GLY 85 N -1.26 -0.86 3.33 -1.45 0.00 -1.23 -4.96 105.19 98.77 2d8y n GLY 85 Ca -0.00 0.43 -0.11 0.00 0.00 0.00 0.00 46.02 46.34 2d8y n GLY 85 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2d8y s SER 86 N -0.43 -0.29 1.02 1.61 1.04 -1.26 -5.00 113.70 110.38 2d8y s SER 86 Ca 0.62 -0.22 -0.21 0.00 0.48 0.00 0.00 55.95 56.61 2d8y s SER 86 Cb -0.88 0.49 -0.10 0.00 0.10 0.00 0.00 66.02 65.63 2d8y s SER 86 CO 0.46 -0.84 -0.83 0.61 0.98 0.00 0.00 173.24 173.61 2d8y n GLY 87 N -0.15 -3.26 3.69 7.32 0.00 -1.26 -4.93 105.19 106.60 2d8y n GLY 87 Ca -0.17 -0.50 -0.29 0.00 0.00 0.00 0.00 46.02 45.06 2d8y n GLY 87 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2d8y s PRO 88 N -2.46 0.74 -0.54 1.61 0.04 -1.26 -4.97 135.00 128.16 2d8y s PRO 88 Ca 0.43 0.64 -0.24 0.00 0.04 0.00 0.00 61.00 61.87 2d8y s PRO 88 Cb -0.05 -1.76 0.04 0.00 0.04 0.00 0.00 34.50 32.77 2d8y s PRO 88 CO 0.71 -2.55 0.95 -1.12 0.04 0.00 0.00 177.00 175.03 2d8y s SER 89 N -3.44 6.36 0.53 6.66 0.01 -1.26 -5.03 113.70 117.53 2d8y s SER 89 Ca 0.65 -0.29 -0.03 0.00 1.31 0.00 0.00 55.95 57.58 2d8y s SER 89 Cb -0.18 -2.44 0.01 0.00 0.21 0.00 0.00 66.02 63.61 2d8y s SER 89 CO 0.57 -1.22 0.80 -0.55 0.41 0.00 0.00 173.24 173.26 2d8y s SER 90 N 2.79 5.65 0.00 2.44 0.15 -1.26 -5.34 113.70 118.13 2d8y s SER 90 Ca 0.31 0.50 0.00 0.00 0.70 0.00 0.00 55.95 57.46 2d8y s SER 90 Cb -0.12 -1.58 0.00 0.00 -1.71 0.00 0.00 66.02 62.61 2d8y s SER 90 CO 0.20 -0.93 0.00 0.61 1.20 0.00 0.00 173.24 174.32