#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 4.24 0.06 1.61 0.15 -1.26 -5.07 113.70 113.43 2d8y s SER 2 Ca 0.00 -2.90 -0.15 0.00 0.70 0.00 0.00 55.95 53.60 2d8y s SER 2 Cb 0.00 -1.55 0.02 0.00 -1.71 0.00 0.00 66.02 62.79 2d8y s SER 2 CO 0.00 -0.25 0.34 -0.55 1.20 0.00 0.00 173.24 173.98 2d8y s SER 3 N -0.12 -0.16 -0.14 5.45 0.15 -1.26 -5.16 113.70 112.46 2d8y s SER 3 Ca 0.17 -0.19 -0.04 0.00 0.70 0.00 0.00 55.95 56.59 2d8y s SER 3 Cb -0.25 0.39 -0.03 0.00 -1.71 0.00 0.00 66.02 64.42 2d8y s SER 3 CO -0.01 -0.67 -0.01 -0.83 1.20 0.00 0.00 173.24 172.92 2d8y s GLY 4 N -2.20 1.78 -0.03 9.45 0.00 -1.26 -5.11 107.32 109.95 2d8y s GLY 4 Ca -0.03 -0.81 0.05 0.00 0.00 0.00 0.00 44.72 43.94 2d8y s GLY 4 CO -0.05 -0.20 -0.20 -0.45 0.00 0.00 0.00 173.10 172.21 2d8y s SER 5 N 0.01 2.41 0.02 1.64 0.15 -1.26 -5.13 113.70 111.53 2d8y s SER 5 Ca 0.02 -0.39 -0.26 0.00 0.70 0.00 0.00 55.95 56.03 2d8y s SER 5 Cb -0.13 -0.49 0.06 0.00 -1.71 0.00 0.00 66.02 63.75 2d8y s SER 5 CO 0.02 0.21 0.59 -0.44 1.20 0.00 0.00 173.24 174.82 2d8y s SER 6 N -0.22 -0.54 0.00 5.45 0.01 -1.26 -5.07 113.70 112.07 2d8y s SER 6 Ca 0.01 0.37 0.00 0.00 1.31 0.00 0.00 55.95 57.65 2d8y s SER 6 Cb -0.10 0.52 0.00 0.00 0.21 0.00 0.00 66.02 66.65 2d8y s SER 6 CO 0.01 -0.70 0.00 0.61 0.41 0.00 0.00 173.24 173.58 2d8y n GLY 7 N 0.55 -0.27 3.23 3.44 0.00 -1.26 -5.16 105.19 105.71 2d8y n GLY 7 Ca -0.19 -0.22 0.04 0.00 0.00 0.00 0.00 46.02 45.66 2d8y n GLY 7 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 2d8y s MET 8 N 0.00 0.15 0.31 1.61 0.00 -1.26 -5.15 119.30 114.95 2d8y s MET 8 Ca 0.00 0.33 -0.29 0.00 0.00 0.00 0.00 55.69 55.72 2d8y s MET 8 Cb 0.00 0.19 -0.13 0.00 0.00 0.00 0.00 34.83 34.89 2d8y s MET 8 CO 0.00 -0.09 1.32 1.63 0.00 0.00 0.00 175.02 177.87 2d8y n LYS 9 N 5.03 2.06 -1.53 3.16 5.02 -1.26 -4.77 118.16 125.88 2d8y n LYS 9 Ca -0.08 0.73 -0.39 0.00 -2.02 0.00 0.00 58.31 56.55 2d8y n LYS 9 Cb 0.54 -2.32 -0.07 0.00 -0.02 0.00 0.00 35.03 33.16 2d8y n LYS 9 CO 0.00 0.00 0.00 1.19 -0.52 0.00 0.00 177.40 178.07 2d8y n PHE 10 N 0.87 1.26 -0.06 2.13 3.01 -1.26 -4.80 117.46 118.60 2d8y n PHE 10 Ca 0.07 0.19 -0.03 0.00 1.01 0.00 0.00 57.45 58.69 2d8y n PHE 10 Cb 0.34 -2.57 -0.02 0.00 -0.01 0.00 0.00 39.48 37.22 2d8y n PHE 10 CO 0.00 0.00 0.00 1.96 1.01 0.00 0.00 176.76 179.73 2d8y h GLN 11 N 16.63 0.00 -1.49 -1.08 4.20 -2.05 -3.50 115.11 127.81 2d8y h GLN 11 Ca -0.20 0.00 0.27 0.00 0.06 0.00 0.00 58.65 58.78 2d8y h GLN 11 Cb 1.28 0.00 -0.17 0.00 0.30 0.00 0.00 27.48 28.90 2d8y h GLN 11 CO 1.19 0.17 0.81 0.00 -0.67 0.00 0.00 178.83 180.33 2d8y s ALA 12 N -2.53 -2.11 -1.26 3.87 0.00 -1.26 -5.01 121.76 113.47 2d8y s ALA 12 Ca -0.06 1.30 0.15 0.00 0.00 0.00 0.00 51.96 53.35 2d8y s ALA 12 Cb 0.00 0.04 0.69 0.00 0.00 0.00 0.00 23.12 23.85 2d8y s ALA 12 CO 0.15 -0.74 1.42 -0.35 0.00 0.00 0.00 175.76 176.25 2d8y n PRO 13 N -0.22 0.13 -3.15 0.00 -0.04 -1.26 -4.53 135.00 125.93 2d8y n PRO 13 Ca -0.02 0.19 0.06 0.00 -0.04 0.00 0.00 63.50 63.68 2d8y n PRO 13 Cb 0.60 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.55 2d8y n PRO 13 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2d8y s ALA 14 N -2.74 -3.98 1.03 0.55 0.00 -1.26 -5.17 121.76 110.20 2d8y s ALA 14 Ca 0.11 1.36 -0.21 0.00 0.00 0.00 0.00 51.96 53.23 2d8y s ALA 14 Cb 0.10 -2.73 -0.02 0.00 0.00 0.00 0.00 23.12 20.48 2d8y s ALA 14 CO 0.24 -1.81 -0.61 2.89 0.00 0.00 0.00 175.76 176.47 2d8y n ARG 15 N 5.28 -0.96 -4.16 0.00 1.85 -1.26 -4.99 116.66 112.41 2d8y n ARG 15 Ca 0.01 -0.28 -0.25 0.00 -1.00 0.00 0.00 57.85 56.34 2d8y n ARG 15 Cb 0.56 -1.35 -0.06 0.00 -1.05 0.00 0.00 32.46 30.56 2d8y n ARG 15 CO 0.00 0.00 0.00 -1.21 -0.01 0.00 0.00 177.63 176.41 2d8y s GLU 16 N -2.78 2.67 0.03 2.89 0.41 -1.26 -5.10 118.70 115.55 2d8y s GLU 16 Ca 0.43 -1.07 0.00 0.00 -0.41 0.00 0.00 54.97 53.92 2d8y s GLU 16 Cb -0.01 -2.47 -0.02 0.00 -1.78 0.00 0.00 34.13 29.85 2d8y s GLU 16 CO 0.59 0.43 -0.04 0.99 -0.49 0.00 0.00 175.26 176.75 2d8y s THR 17 N -1.94 0.20 0.22 3.63 2.01 -1.26 -2.71 115.64 115.79 2d8y s THR 17 Ca 0.31 -1.00 -0.30 0.00 0.31 0.00 0.00 61.69 61.00 2d8y s THR 17 Cb -0.09 -0.41 -0.09 0.00 0.01 0.00 0.00 72.50 71.92 2d8y s THR 17 CO 0.22 -0.51 1.33 0.00 -0.69 0.00 0.00 174.62 174.97 2d8y n VAL 19 N 2.38 0.99 0.00 0.00 0.24 -0.96 -1.18 118.33 119.80 2d8y n VAL 19 Ca 0.06 -0.54 0.00 0.00 -2.04 0.00 0.00 64.34 61.81 2d8y n VAL 19 Cb 0.42 -0.28 0.00 0.00 -1.47 0.00 0.00 33.84 32.51 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 0.29 0.00 -0.00 7.34 -0.58 -1.26 -4.84 120.64 121.58 2d8y n GLU 20 Ca 0.11 0.00 0.05 0.00 -0.42 0.00 0.00 57.16 56.90 2d8y n GLU 20 Cb 0.56 -0.56 -0.06 0.00 -0.57 0.00 0.00 31.44 30.81 2d8y n GLU 20 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2d8y n GLN 22 N -1.50 -3.52 -4.61 0.00 1.13 -0.33 -5.00 117.38 103.56 2d8y n GLN 22 Ca 0.00 0.46 -0.34 0.00 -1.94 0.00 0.00 57.00 55.19 2d8y n GLN 22 Cb 0.19 -4.37 -0.12 0.00 0.11 0.00 0.00 30.24 26.06 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 -5.45 3.04 -0.72 -1.09 3.01 -1.26 -4.75 119.74 112.51 2d8y s LYS 23 Ca 0.25 -0.57 -0.33 0.00 -1.01 0.00 0.00 55.97 54.31 2d8y s LYS 23 Cb -0.11 -2.66 -0.17 0.00 -1.01 0.00 0.00 37.83 33.88 2d8y s LYS 23 CO 0.30 0.50 2.47 2.41 0.51 0.00 0.00 175.35 181.55 2d8y n THR 24 N 2.71 0.01 -2.40 2.17 -1.04 -1.26 -1.82 114.28 112.65 2d8y n THR 24 Ca -0.18 -0.17 -0.42 0.00 -2.04 0.00 0.00 64.05 61.24 2d8y n THR 24 Cb 0.53 -1.05 -0.03 0.00 -1.82 0.00 0.00 70.33 67.96 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 8.73 4.09 0.58 12.58 1.01 -1.10 -4.91 120.40 141.37 2d8y s VAL 25 Ca 1.23 1.45 -0.09 0.00 0.00 0.00 0.00 61.98 64.57 2d8y s VAL 25 Cb -1.07 -3.93 -0.03 0.00 0.00 0.00 0.00 36.38 31.35 2d8y s VAL 25 CO 0.48 0.03 0.95 -0.31 0.00 0.00 0.00 175.10 176.25 2d8y s TYR 26 N 1.91 3.56 -2.00 5.22 1.51 -1.26 -4.70 117.35 121.58 2d8y s TYR 26 Ca 0.58 1.07 0.10 0.00 -1.01 0.00 0.00 57.07 57.81 2d8y s TYR 26 Cb -0.27 -2.61 0.62 0.00 -0.11 0.00 0.00 41.96 39.58 2d8y s TYR 26 CO 0.25 -0.60 1.06 -0.35 -1.11 0.00 0.00 175.55 174.79 2d8y n PRO 27 N -2.60 0.49 -0.03 -1.71 -0.04 -1.26 -1.87 135.00 127.97 2d8y n PRO 27 Ca 0.04 0.00 0.01 0.00 -0.04 0.00 0.00 63.50 63.51 2d8y n PRO 27 Cb 0.55 -1.33 -0.11 0.00 -0.04 0.00 0.00 33.50 32.57 2d8y n PRO 27 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 2d8y n MET 28 N -0.83 1.05 -0.57 0.54 2.81 -1.26 -4.55 117.12 114.30 2d8y n MET 28 Ca 0.08 -0.08 0.06 0.00 -1.81 0.00 0.00 57.70 55.96 2d8y n MET 28 Cb 0.04 -1.34 0.17 0.00 -0.71 0.00 0.00 33.22 31.38 2d8y n MET 28 CO 0.00 0.00 0.00 -0.85 1.51 0.00 0.00 175.97 176.63 2d8y n GLU 29 N -2.21 1.35 -2.94 0.03 0.28 -0.89 -4.97 120.64 111.29 2d8y n GLU 29 Ca -0.11 -3.00 -0.44 0.00 -0.16 0.00 0.00 57.16 53.46 2d8y n GLU 29 Cb 0.61 -1.43 -0.03 0.00 1.43 0.00 0.00 31.44 32.02 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 -2.81 3.37 -0.40 3.44 3.52 -0.78 -3.84 118.95 121.46 2d8y s ARG 30 Ca 0.36 -1.43 -0.15 0.00 -0.13 0.00 0.00 55.73 54.37 2d8y s ARG 30 Cb 0.35 -4.60 0.01 0.00 -1.56 0.00 0.00 34.95 29.15 2d8y s ARG 30 CO -0.06 -1.74 0.32 -1.17 -0.81 0.00 0.00 175.30 171.84 2d8y s LEU 31 N 3.04 4.92 0.00 -0.88 0.20 0.53 -4.93 118.68 121.56 2d8y s LEU 31 Ca 0.26 -0.73 -0.30 0.00 0.69 0.00 0.00 54.13 54.05 2d8y s LEU 31 Cb -0.11 -2.21 -0.05 0.00 -0.43 0.00 0.00 46.19 43.39 2d8y s LEU 31 CO -0.01 -0.43 1.27 -0.22 -0.29 0.00 0.00 176.35 176.67 2d8y s LEU 32 N 1.79 4.32 -0.21 -0.68 1.98 -1.26 -0.21 118.68 124.41 2d8y s LEU 32 Ca 0.07 1.98 -0.04 0.00 -2.89 0.00 0.00 54.13 53.25 2d8y s LEU 32 Cb -0.18 -3.57 0.10 0.00 0.66 0.00 0.00 46.19 43.20 2d8y s LEU 32 CO 0.11 -0.60 0.25 0.00 -1.89 0.00 0.00 176.35 174.22 2d8y s ALA 33 N 1.90 -0.41 -1.03 5.97 0.00 0.15 -4.91 121.76 123.44 2d8y s ALA 33 Ca 0.59 0.39 -0.00 0.00 0.00 0.00 0.00 51.96 52.94 2d8y s ALA 33 Cb -0.28 -1.36 0.00 0.00 0.00 0.00 0.00 23.12 21.47 2d8y s ALA 33 CO 0.26 -1.19 0.86 0.09 0.00 0.00 0.00 175.76 175.77 2d8y n ASN 34 N 5.33 -2.15 -3.87 0.00 5.03 -1.26 -2.67 115.26 115.67 2d8y n ASN 34 Ca -0.05 -0.53 -0.29 0.00 0.87 0.00 0.00 54.58 54.58 2d8y n ASN 34 Cb 0.50 -4.44 0.03 0.00 -1.02 0.00 0.00 39.78 34.84 2d8y n ASN 34 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2d8y n GLN 35 N -3.69 -5.70 -3.72 3.52 6.02 -1.26 -4.97 117.38 107.58 2d8y n GLN 35 Ca -0.24 0.62 -0.14 0.00 -0.01 0.00 0.00 57.00 57.23 2d8y n GLN 35 Cb 0.64 -5.50 -0.08 0.00 1.02 0.00 0.00 30.24 26.32 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 -6.53 0.69 -0.20 -1.09 -0.21 -1.09 -5.13 119.66 106.09 2d8y s GLN 36 Ca 0.59 -0.01 -0.29 0.00 0.02 0.00 0.00 55.36 55.67 2d8y s GLN 36 Cb -0.29 0.31 0.00 0.00 1.00 0.00 0.00 33.01 34.04 2d8y s GLN 36 CO 0.82 -0.18 1.03 0.08 -2.12 0.00 0.00 175.29 174.91 2d8y s VAL 37 N -1.07 4.71 0.08 1.09 1.01 -1.26 -0.67 120.40 124.29 2d8y s VAL 37 Ca -0.11 2.02 0.06 0.00 0.00 0.00 0.00 61.98 63.95 2d8y s VAL 37 Cb -0.04 -4.31 -0.03 0.00 0.00 0.00 0.00 36.38 32.00 2d8y s VAL 37 CO 0.04 -0.14 -0.16 -0.36 0.00 0.00 0.00 175.10 174.49 2d8y s PHE 38 N 2.92 1.38 -0.08 5.22 0.08 0.70 -2.26 117.98 125.95 2d8y s PHE 38 Ca 0.45 -0.45 -0.24 0.00 0.12 0.00 0.00 56.93 56.80 2d8y s PHE 38 Cb -0.16 -0.76 -0.03 0.00 -0.57 0.00 0.00 43.02 41.50 2d8y s PHE 38 CO 0.09 0.10 0.75 -1.01 -0.10 0.00 0.00 175.22 175.05 2d8y s HIS 39 N -1.29 3.56 0.66 0.36 3.76 -1.26 -0.35 115.29 120.72 2d8y s HIS 39 Ca 0.01 1.29 0.12 0.00 -0.15 0.00 0.00 55.06 56.33 2d8y s HIS 39 Cb -0.10 -2.87 0.66 0.00 1.11 0.00 0.00 32.58 31.38 2d8y s HIS 39 CO 0.03 0.02 1.36 0.82 -0.85 0.00 0.00 174.74 176.12 2d8y h ILE 40 N 4.84 0.01 0.00 0.60 5.03 -1.91 0.12 117.51 126.20 2d8y h ILE 40 Ca -0.39 0.00 -0.36 0.00 -0.12 0.00 0.00 64.86 63.99 2d8y h ILE 40 Cb 1.19 0.25 -0.05 0.00 -3.03 0.00 0.00 36.82 35.18 2d8y h ILE 40 CO 0.77 0.00 -2.14 -1.20 -0.68 0.00 0.00 178.15 174.89 2d8y n SER 41 N -2.69 1.94 -0.31 1.72 7.64 -1.26 -4.45 113.62 116.21 2d8y n SER 41 Ca 0.00 0.35 0.14 0.00 1.01 0.00 0.00 58.87 60.37 2d8y n SER 41 Cb 0.79 -0.83 0.37 0.00 -1.01 0.00 0.00 64.21 63.53 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 -4.63 0.61 -4.09 0.00 7.35 0.21 -4.81 117.46 112.11 2d8y n PHE 43 Ca 0.20 0.10 -0.11 0.00 -0.76 0.00 0.00 57.45 56.89 2d8y n PHE 43 Cb 0.55 -1.75 -0.07 0.00 0.35 0.00 0.00 39.48 38.56 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 8.12 1.45 0.16 -4.13 0.52 -1.26 -1.40 118.95 122.42 2d8y s ARG 44 Ca 1.19 -1.45 -0.30 0.00 -0.52 0.00 0.00 55.73 54.65 2d8y s ARG 44 Cb -0.68 0.39 -0.07 0.00 0.52 0.00 0.00 34.95 35.11 2d8y s ARG 44 CO 0.39 -0.56 0.96 0.00 0.02 0.00 0.00 175.30 176.11 2d8y n SER 46 N 2.28 0.09 0.02 0.00 2.88 0.20 -0.59 113.62 118.51 2d8y n SER 46 Ca 0.01 -1.57 -0.00 0.00 -1.33 0.00 0.00 58.87 55.98 2d8y n SER 46 Cb 0.48 -0.05 -0.00 0.00 -0.75 0.00 0.00 64.21 63.89 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 -0.43 0.00 0.11 0.66 4.19 -1.26 -4.83 117.16 115.59 2d8y n TYR 47 Ca 0.00 0.00 0.09 0.00 3.31 0.00 0.00 57.90 61.30 2d8y n TYR 47 Cb 0.02 -0.02 0.01 0.00 0.49 0.00 0.00 39.34 39.85 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 -2.80 -2.93 -4.78 0.00 2.85 0.25 -4.95 115.26 102.90 2d8y n ASN 49 Ca -0.01 -0.46 -0.30 0.00 -0.11 0.00 0.00 54.58 53.70 2d8y n ASN 49 Cb 0.61 -4.02 -0.06 0.00 1.24 0.00 0.00 39.78 37.55 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 -3.83 5.52 0.20 1.20 0.01 -1.26 -4.75 114.94 112.03 2d8y s ASN 50 Ca 0.12 -0.03 -0.32 0.00 -0.71 0.00 0.00 52.86 51.92 2d8y s ASN 50 Cb -0.05 -1.47 -0.11 0.00 0.41 0.00 0.00 41.25 40.02 2d8y s ASN 50 CO 0.56 0.15 1.67 -0.54 -1.51 0.00 0.00 177.10 177.43 2d8y s LYS 51 N -2.52 4.15 0.42 -0.60 -0.14 -1.26 -2.69 119.74 117.10 2d8y s LYS 51 Ca 0.29 2.53 0.02 0.00 -1.36 0.00 0.00 55.97 57.46 2d8y s LYS 51 Cb -0.12 -3.09 -0.01 0.00 -1.68 0.00 0.00 37.83 32.93 2d8y s LYS 51 CO 0.22 -0.70 0.09 1.28 -0.76 0.00 0.00 175.35 175.48 2d8y n LEU 52 N 3.83 0.00 -3.47 3.17 4.77 -0.49 -4.97 117.00 119.84 2d8y n LEU 52 Ca 0.15 -2.95 -0.12 0.00 -0.03 0.00 0.00 56.01 53.06 2d8y n LEU 52 Cb 0.36 0.73 -0.03 0.00 -2.33 0.00 0.00 43.42 42.16 2d8y n LEU 52 CO 0.63 -0.44 0.52 -0.44 -1.33 0.00 0.00 177.39 176.33 2d8y s SER 53 N -3.45 -0.50 -0.90 -1.43 0.01 -1.26 -4.87 113.70 101.29 2d8y s SER 53 Ca 0.12 0.12 -0.17 0.00 1.31 0.00 0.00 55.95 57.33 2d8y s SER 53 Cb 0.01 0.50 -0.25 0.00 0.21 0.00 0.00 66.02 66.49 2d8y s SER 53 CO 0.09 -0.77 2.29 0.18 0.41 0.00 0.00 173.24 175.43 2d8y n LEU 54 N -0.10 0.04 0.00 2.44 4.77 -1.26 -0.73 117.00 122.16 2d8y n LEU 54 Ca -0.14 -0.92 0.00 0.00 -0.03 0.00 0.00 56.01 54.92 2d8y n LEU 54 Cb 0.62 -1.04 0.00 0.00 -2.33 0.00 0.00 43.42 40.67 2d8y n LEU 54 CO 0.13 -1.92 0.00 0.61 -1.33 0.00 0.00 177.39 174.88 2d8y n GLY 55 N 6.09 1.27 0.09 -0.72 0.00 -1.26 -4.95 105.19 105.71 2d8y n GLY 55 Ca 0.58 -0.05 0.08 0.00 0.00 0.00 0.00 46.02 46.63 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 1.72 -4.03 2.61 5.66 0.09 -5.04 114.28 115.29 2d8y n THR 56 Ca 0.00 -1.99 -0.25 0.00 -3.05 0.00 0.00 64.05 58.76 2d8y n THR 56 Cb 0.00 -0.09 -0.05 0.00 -1.55 0.00 0.00 70.33 68.64 2d8y n THR 56 CO 0.00 0.00 0.00 -0.72 -3.05 0.00 0.00 175.07 171.30 2d8y s TYR 57 N -2.48 2.38 -0.30 1.09 -0.85 -1.22 -3.41 117.35 112.56 2d8y s TYR 57 Ca 0.26 -0.65 -0.15 0.00 -0.52 0.00 0.00 57.07 56.01 2d8y s TYR 57 Cb 0.22 -1.96 0.17 0.00 0.38 0.00 0.00 41.96 40.77 2d8y s TYR 57 CO 0.03 0.01 1.00 0.00 -1.52 0.00 0.00 175.55 175.07 2d8y s ALA 58 N -2.63 -2.79 0.22 9.51 0.00 0.22 -4.71 121.76 121.58 2d8y s ALA 58 Ca 0.38 1.98 0.07 0.00 0.00 0.00 0.00 51.96 54.39 2d8y s ALA 58 Cb 0.01 -2.11 -0.04 0.00 0.00 0.00 0.00 23.12 20.99 2d8y s ALA 58 CO 0.22 -1.01 0.14 0.45 0.00 0.00 0.00 175.76 175.56 2d8y s SER 59 N 2.48 5.35 0.08 0.00 0.15 -1.26 0.20 113.70 120.70 2d8y s SER 59 Ca -0.02 -0.26 0.00 0.00 0.70 0.00 0.00 55.95 56.37 2d8y s SER 59 Cb -0.06 -1.32 0.00 0.00 -1.71 0.00 0.00 66.02 62.92 2d8y s SER 59 CO -0.17 0.01 0.00 -0.11 1.20 0.00 0.00 173.24 174.17 2d8y n LEU 60 N -0.78 0.23 -1.96 3.45 7.94 -1.16 -4.90 117.00 119.83 2d8y n LEU 60 Ca -0.08 0.12 -0.24 0.00 -1.11 0.00 0.00 56.01 54.71 2d8y n LEU 60 Cb 0.57 -0.01 0.06 0.00 0.53 0.00 0.00 43.42 44.57 2d8y n LEU 60 CO 0.42 -0.61 0.59 1.41 -1.11 0.00 0.00 177.39 178.09 2d8y n HIS 61 N -2.91 2.60 0.00 1.96 8.25 -1.26 -4.88 115.22 118.97 2d8y n HIS 61 Ca 0.00 -2.34 0.00 0.00 -0.26 0.00 0.00 57.72 55.12 2d8y n HIS 61 Cb 0.00 -0.65 0.00 0.00 1.12 0.00 0.00 29.99 30.46 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 -0.83 2.54 3.88 -1.41 0.00 -1.26 -5.06 105.19 103.05 2d8y n GLY 62 Ca 0.47 -0.03 -0.30 0.00 0.00 0.00 0.00 46.02 46.16 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 0.00 3.66 0.07 1.61 1.81 -1.26 -5.02 118.95 119.82 2d8y s ARG 63 Ca 0.00 0.58 0.01 0.00 -1.72 0.00 0.00 55.73 54.60 2d8y s ARG 63 Cb 0.00 -2.22 -0.04 0.00 -0.45 0.00 0.00 34.95 32.24 2d8y s ARG 63 CO 0.00 -0.34 0.19 0.42 -0.68 0.00 0.00 175.30 174.89 2d8y s ILE 64 N -2.85 5.19 -0.13 1.52 -1.09 -1.26 -3.00 121.20 119.59 2d8y s ILE 64 Ca 0.53 -0.50 -0.14 0.00 -2.23 0.00 0.00 60.65 58.30 2d8y s ILE 64 Cb -0.11 -3.54 0.04 0.00 -1.58 0.00 0.00 42.46 37.27 2d8y s ILE 64 CO 0.44 0.12 0.39 -0.31 -1.23 0.00 0.00 174.94 174.35 2d8y s TYR 65 N -1.51 -0.41 0.30 3.97 1.51 0.13 -0.63 117.35 120.71 2d8y s TYR 65 Ca 0.34 0.97 -0.29 0.00 -1.01 0.00 0.00 57.07 57.08 2d8y s TYR 65 Cb -0.13 0.15 -0.10 0.00 -0.11 0.00 0.00 41.96 41.78 2d8y s TYR 65 CO 0.27 -0.24 1.13 0.00 -1.11 0.00 0.00 175.55 175.60 2d8y n LYS 67 N 1.02 -0.15 -0.01 0.00 4.01 -1.22 0.24 118.16 122.04 2d8y n LYS 67 Ca -0.00 0.99 -0.04 0.00 -0.51 0.00 0.00 58.31 58.74 2d8y n LYS 67 Cb 0.45 -1.47 -0.03 0.00 -0.51 0.00 0.00 35.03 33.47 2d8y n LYS 67 CO 0.00 0.00 0.00 -1.35 -1.11 0.00 0.00 177.40 174.94 2d8y h PRO 68 N 0.00 -0.15 -0.44 1.97 0.11 -1.91 0.26 132.00 131.84 2d8y h PRO 68 Ca 0.22 0.01 0.02 0.00 0.11 0.00 0.00 66.00 66.37 2d8y h PRO 68 Cb 0.39 0.03 -0.03 0.00 0.11 0.00 0.00 31.00 31.50 2d8y h PRO 68 CO -0.64 -0.10 0.25 0.45 -0.21 0.00 0.00 178.00 177.76 2d8y h HIS 69 N -0.15 0.47 -0.08 0.65 3.86 -1.40 0.81 115.15 119.32 2d8y h HIS 69 Ca 0.01 0.02 0.04 0.00 -1.16 0.00 0.00 60.37 59.27 2d8y h HIS 69 Cb 0.18 -0.15 -0.06 0.00 1.06 0.00 0.00 27.41 28.44 2d8y h HIS 69 CO -0.51 0.27 -0.43 0.35 0.86 0.00 0.00 177.93 178.46 2d8y h PHE 70 N 0.51 -1.24 0.00 2.45 3.04 0.12 0.94 116.94 122.76 2d8y h PHE 70 Ca 0.18 0.05 -0.11 0.00 3.98 0.00 0.00 57.97 62.06 2d8y h PHE 70 Cb 0.03 0.56 -0.02 0.00 2.56 0.00 0.00 35.95 39.08 2d8y h PHE 70 CO -0.08 -0.49 -0.54 -0.91 -2.02 0.00 0.00 178.31 174.28 2d8y h ASN 71 N -0.53 0.00 0.61 0.41 2.35 -0.31 0.61 115.58 118.71 2d8y h ASN 71 Ca 0.06 0.00 -0.12 0.00 -0.55 0.00 0.00 56.30 55.70 2d8y h ASN 71 Cb 0.64 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.00 2d8y h ASN 71 CO -0.37 0.54 -0.55 -0.61 -1.65 0.00 0.00 177.43 174.78 2d8y h GLN 72 N 0.00 0.00 0.00 0.81 4.15 0.17 -2.50 115.11 117.74 2d8y h GLN 72 Ca -0.01 0.00 -0.15 0.00 0.77 0.00 0.00 58.65 59.26 2d8y h GLN 72 Cb 1.07 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.73 2d8y h GLN 72 CO 0.07 0.55 -1.49 1.28 -1.93 0.00 0.00 178.83 177.31 2d8y n LEU 73 N -3.81 1.91 0.33 -2.39 4.77 0.32 -3.98 117.00 114.13 2d8y n LEU 73 Ca -0.01 0.33 -0.19 0.00 -0.03 0.00 0.00 56.01 56.11 2d8y n LEU 73 Cb 0.57 -0.75 -0.10 0.00 -2.33 0.00 0.00 43.42 40.81 2d8y n LEU 73 CO 0.41 -0.00 0.53 -0.26 -1.33 0.00 0.00 177.39 176.73 2d8y h PHE 74 N -0.97 -1.41 -0.84 -1.77 -1.00 0.09 -2.18 116.94 108.86 2d8y h PHE 74 Ca -0.23 0.01 0.16 0.00 2.81 0.00 0.00 57.97 60.72 2d8y h PHE 74 Cb 1.18 0.54 -0.06 0.00 3.61 0.00 0.00 35.95 41.22 2d8y h PHE 74 CO -0.31 -0.70 0.55 -0.22 -1.61 0.00 0.00 178.31 176.03 2d8y h LYS 75 N -1.06 0.50 -4.34 1.51 1.63 -1.53 -3.43 116.57 109.84 2d8y h LYS 75 Ca -0.07 -0.03 -0.64 0.00 -0.85 0.00 0.00 60.65 59.06 2d8y h LYS 75 Cb 0.91 -0.11 0.01 0.00 -0.60 0.00 0.00 32.23 32.43 2d8y h LYS 75 CO -0.03 0.33 0.49 0.45 -3.45 0.00 0.00 179.45 177.25 2d8y n SER 76 N -4.52 0.86 -4.35 4.20 2.88 -0.82 -4.71 113.62 107.17 2d8y n SER 76 Ca 0.17 0.86 -0.44 0.00 -1.33 0.00 0.00 58.87 58.13 2d8y n SER 76 Cb 0.55 -0.64 -0.01 0.00 -0.75 0.00 0.00 64.21 63.36 2d8y n SER 76 CO 0.00 0.00 0.00 1.17 -1.23 0.00 0.00 175.04 174.98 2d8y n LYS 77 N 2.87 0.05 0.00 -1.46 4.81 -1.26 -4.77 118.16 118.40 2d8y n LYS 77 Ca 0.22 0.02 0.00 0.00 -0.87 0.00 0.00 58.31 57.68 2d8y n LYS 77 Cb -0.04 -1.04 0.00 0.00 0.02 0.00 0.00 35.03 33.97 2d8y n LYS 77 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2d8y n GLY 78 N 2.17 -0.14 0.00 3.14 0.00 -1.26 -5.06 105.19 104.03 2d8y n GLY 78 Ca 0.14 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.81 2d8y n GLY 78 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 2d8y n ASN 79 N 0.00 0.41 -4.55 1.61 6.94 -1.26 -5.10 115.26 113.32 2d8y n ASN 79 Ca 0.00 -1.16 -0.43 0.00 -0.02 0.00 0.00 54.58 52.97 2d8y n ASN 79 Cb 0.00 0.00 -0.00 0.00 -2.36 0.00 0.00 39.78 37.42 2d8y n ASN 79 CO 0.00 0.00 0.00 -1.22 -1.03 0.00 0.00 177.26 175.01 2d8y n TYR 80 N -0.08 0.70 -3.73 -2.53 4.02 -1.26 -4.98 117.16 109.29 2d8y n TYR 80 Ca 0.00 0.66 -0.07 0.00 -0.01 0.00 0.00 57.90 58.48 2d8y n TYR 80 Cb 0.34 -2.16 -0.02 0.00 -0.02 0.00 0.00 39.34 37.48 2d8y n TYR 80 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 2d8y s ASP 81 N -0.73 -0.29 0.00 7.72 2.15 -1.26 -5.04 116.67 119.22 2d8y s ASP 81 Ca 0.61 -0.41 0.23 0.00 0.43 0.00 0.00 52.55 53.42 2d8y s ASP 81 Cb -0.66 0.61 0.11 0.00 -0.30 0.00 0.00 42.92 42.68 2d8y s ASP 81 CO 0.58 -1.09 1.14 1.21 -0.17 0.00 0.00 175.17 176.84 2d8y n GLU 82 N -0.43 0.51 -4.03 4.34 4.07 -1.26 -4.98 120.64 118.87 2d8y n GLU 82 Ca -0.07 -0.39 -0.30 0.00 -0.06 0.00 0.00 57.16 56.34 2d8y n GLU 82 Cb 0.61 -1.49 -0.01 0.00 -0.06 0.00 0.00 31.44 30.48 2d8y n GLU 82 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2d8y n GLY 83 N 1.45 -0.35 3.65 8.31 0.00 -1.26 -4.88 105.19 112.10 2d8y n GLY 83 Ca 0.07 0.15 -0.43 0.00 0.00 0.00 0.00 46.02 45.81 2d8y n GLY 83 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2d8y s PHE 84 N -3.59 3.08 -0.30 1.61 2.19 -1.26 -4.96 117.98 114.76 2d8y s PHE 84 Ca 0.38 1.19 -0.19 0.00 0.33 0.00 0.00 56.93 58.64 2d8y s PHE 84 Cb -0.20 -3.58 0.19 0.00 -1.31 0.00 0.00 43.02 38.11 2d8y s PHE 84 CO 0.89 -0.99 1.30 0.20 1.83 0.00 0.00 175.22 178.45 2d8y s GLY 85 N 1.76 0.21 0.24 13.12 0.00 -1.26 -5.17 107.32 116.23 2d8y s GLY 85 Ca 0.48 3.56 -0.08 0.00 0.00 0.00 0.00 44.72 48.68 2d8y s GLY 85 CO 0.14 3.60 0.54 -0.45 0.00 0.00 0.00 173.10 176.93 2d8y s SER 86 N 2.33 6.56 0.05 1.64 0.15 -1.26 -5.10 113.70 118.07 2d8y s SER 86 Ca -0.03 0.83 0.04 0.00 0.70 0.00 0.00 55.95 57.49 2d8y s SER 86 Cb -0.03 -2.19 -0.04 0.00 -1.71 0.00 0.00 66.02 62.05 2d8y s SER 86 CO -0.13 -0.11 -0.03 -0.83 1.20 0.00 0.00 173.24 173.34 2d8y s GLY 87 N -2.63 1.85 0.38 9.45 0.00 -1.26 -5.10 107.32 110.02 2d8y s GLY 87 Ca 0.46 -1.07 -0.26 0.00 0.00 0.00 0.00 44.72 43.85 2d8y s GLY 87 CO 0.24 -1.00 1.20 2.56 0.00 0.00 0.00 173.10 176.10 2d8y s PRO 88 N -1.90 4.13 0.10 2.90 0.04 -1.26 -5.05 135.00 133.95 2d8y s PRO 88 Ca 0.22 1.92 0.08 0.00 0.04 0.00 0.00 61.00 63.26 2d8y s PRO 88 Cb -0.11 -2.77 -0.03 0.00 0.04 0.00 0.00 34.50 31.62 2d8y s PRO 88 CO 0.13 -0.28 -0.21 -1.12 0.04 0.00 0.00 177.00 175.56 2d8y s SER 89 N -0.99 2.58 0.96 6.66 0.01 -1.26 -5.15 113.70 116.51 2d8y s SER 89 Ca 0.55 -0.67 -0.13 0.00 1.31 0.00 0.00 55.95 57.01 2d8y s SER 89 Cb -0.33 -0.15 0.17 0.00 0.21 0.00 0.00 66.02 65.92 2d8y s SER 89 CO 0.42 0.08 1.13 -0.44 0.41 0.00 0.00 173.24 174.84 2d8y s SER 90 N -1.83 3.05 0.00 2.44 0.01 -1.26 -5.36 113.70 110.75 2d8y s SER 90 Ca 0.07 0.96 0.00 0.00 1.31 0.00 0.00 55.95 58.29 2d8y s SER 90 Cb -0.10 -1.52 0.00 0.00 0.21 0.00 0.00 66.02 64.61 2d8y s SER 90 CO 0.04 -2.84 0.00 0.61 0.41 0.00 0.00 173.24 171.46