#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1f5y s SER 2 N 0.00 6.72 -1.09 1.61 0.01 -1.26 -4.92 113.70 114.77 1f5y s SER 2 Ca 0.00 2.25 -0.22 0.00 1.31 0.00 0.00 55.95 59.29 1f5y s SER 2 Cb 0.00 -2.55 0.05 0.00 0.21 0.00 0.00 66.02 63.73 1f5y s SER 2 CO 0.00 -0.83 1.53 0.00 0.41 0.00 0.00 173.24 174.35 1f5y s ALA 3 N 2.97 2.85 1.00 1.44 0.00 -1.26 -4.98 121.76 123.78 1f5y s ALA 3 Ca 0.69 -2.42 0.00 0.00 0.00 0.00 0.00 51.96 50.24 1f5y s ALA 3 Cb -0.34 -4.56 0.00 0.00 0.00 0.00 0.00 23.12 18.22 1f5y s ALA 3 CO 0.29 -3.56 0.00 1.33 0.00 0.00 0.00 175.76 173.82 1f5y n VAL 4 N 6.78 0.00 -2.91 0.00 0.24 -1.26 -3.89 118.33 117.29 1f5y n VAL 4 Ca 0.37 0.00 -0.16 0.00 -2.04 0.00 0.00 64.34 62.51 1f5y n VAL 4 Cb 0.50 -1.56 0.03 0.00 -1.47 0.00 0.00 33.84 31.34 1f5y n VAL 4 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1f5y n GLY 5 N 3.90 -0.14 2.90 7.63 0.00 -1.26 -4.20 105.19 114.01 1f5y n GLY 5 Ca 0.00 -0.11 -0.02 0.00 0.00 0.00 0.00 46.02 45.89 1f5y n GLY 5 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1f5y n ASP 6 N -1.34 -7.52 -4.01 1.61 2.03 -1.26 -4.65 116.55 101.40 1f5y n ASP 6 Ca -0.06 1.03 -0.30 0.00 0.52 0.00 0.00 54.79 55.98 1f5y n ASP 6 Cb 0.57 -4.09 0.20 0.00 -0.72 0.00 0.00 41.12 37.08 1f5y n ASP 6 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1f5y s ARG 7 N -1.52 0.40 0.57 -0.67 1.70 -1.25 -3.89 118.95 114.29 1f5y s ARG 7 Ca 0.03 -0.48 -0.08 0.00 -0.47 0.00 0.00 55.73 54.72 1f5y s ARG 7 Cb -0.01 -1.83 -0.03 0.00 -0.57 0.00 0.00 34.95 32.52 1f5y s ARG 7 CO 0.55 -2.56 0.92 0.00 -1.08 0.00 0.00 175.30 173.13 1f5y n GLU 9 N -2.57 0.00 0.00 0.00 0.28 -1.26 -5.05 120.64 112.05 1f5y n GLU 9 Ca 0.04 -0.36 0.00 0.00 -0.16 0.00 0.00 57.16 56.68 1f5y n GLU 9 Cb 0.55 0.19 0.00 0.00 1.43 0.00 0.00 31.44 33.61 1f5y n GLU 9 CO 0.00 0.00 0.00 2.89 -0.16 0.00 0.00 177.13 179.86 1f5y n ARG 10 N 0.00 0.00 -0.17 3.44 0.00 -1.26 -5.03 116.66 113.65 1f5y n ARG 10 Ca -0.10 0.00 0.06 0.00 -0.00 0.00 0.00 57.85 57.81 1f5y n ARG 10 Cb 0.56 0.00 0.15 0.00 -0.00 0.00 0.00 32.46 33.17 1f5y n ARG 10 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.63 177.90 1f5y n ASN 11 N 0.00 2.88 -4.86 2.89 0.23 -1.26 -5.04 115.26 110.11 1f5y n ASN 11 Ca 0.00 -1.93 -0.31 0.00 -0.53 0.00 0.00 54.58 51.81 1f5y n ASN 11 Cb 0.00 -0.22 0.01 0.00 -2.08 0.00 0.00 39.78 37.49 1f5y n ASN 11 CO 0.00 0.00 0.00 -1.61 -0.93 0.00 0.00 177.26 174.72 1f5y s GLU 12 N -1.00 3.53 -0.37 -3.83 2.02 -1.26 -4.64 118.70 113.14 1f5y s GLU 12 Ca 0.24 0.83 -0.20 0.00 0.02 0.00 0.00 54.97 55.85 1f5y s GLU 12 Cb 0.13 -2.07 0.01 0.00 0.10 0.00 0.00 34.13 32.29 1f5y s GLU 12 CO 0.17 -0.63 0.64 0.12 0.02 0.00 0.00 175.26 175.58 1f5y s PHE 13 N -3.06 3.14 -0.06 1.61 5.36 0.12 -4.83 117.98 120.26 1f5y s PHE 13 Ca 0.56 0.28 -0.30 0.00 -0.96 0.00 0.00 56.93 56.51 1f5y s PHE 13 Cb -0.12 -3.17 -0.02 0.00 -0.34 0.00 0.00 43.02 39.37 1f5y s PHE 13 CO 0.50 -0.67 1.00 -1.14 -1.46 0.00 0.00 175.22 173.45 1f5y s GLN 14 N 2.73 4.48 1.14 10.12 0.74 -1.26 -1.53 119.66 136.07 1f5y s GLN 14 Ca 0.24 1.41 -0.16 0.00 0.05 0.00 0.00 55.36 56.90 1f5y s GLN 14 Cb -0.14 -3.51 0.25 0.00 1.10 0.00 0.00 33.01 30.71 1f5y s GLN 14 CO 0.16 -0.20 1.08 0.00 -0.55 0.00 0.00 175.29 175.77 1f5y h GLN 16 N -2.38 0.00 0.00 0.00 4.15 -1.93 -0.35 115.11 114.60 1f5y h GLN 16 Ca -0.51 0.00 0.00 0.00 0.77 0.00 0.00 58.65 58.91 1f5y h GLN 16 Cb 1.32 0.00 0.00 0.00 0.21 0.00 0.00 27.48 29.01 1f5y h GLN 16 CO 0.46 0.55 0.00 0.22 -1.93 0.00 0.00 178.83 178.13 1f5y h ASP 17 N 0.00 0.00 0.00 -0.69 1.82 -1.95 -3.47 116.42 112.13 1f5y h ASP 17 Ca -0.01 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.63 1f5y h ASP 17 Cb 1.08 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.09 1f5y h ASP 17 CO 0.07 0.00 0.00 0.61 -1.61 0.00 0.00 179.24 178.31 1f5y n GLY 18 N 0.97 0.73 3.63 -0.78 0.00 -0.14 -5.04 105.19 104.57 1f5y n GLY 18 Ca 0.04 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.63 1f5y n GLY 18 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1f5y s LYS 19 N -0.97 3.78 -0.05 1.61 2.47 -1.26 -4.19 119.74 121.12 1f5y s LYS 19 Ca 0.00 2.03 -0.27 0.00 -1.56 0.00 0.00 55.97 56.18 1f5y s LYS 19 Cb 0.00 -4.14 -0.03 0.00 -1.46 0.00 0.00 37.83 32.20 1f5y s LYS 19 CO 0.00 -1.34 0.84 0.00 0.16 0.00 0.00 175.35 175.01 1f5y s ILE 21 N 1.10 0.47 0.78 0.00 -5.25 -0.58 -4.97 121.20 112.75 1f5y s ILE 21 Ca 0.44 -1.20 -0.09 0.00 -0.99 0.00 0.00 60.65 58.81 1f5y s ILE 21 Cb -0.19 -0.74 0.10 0.00 2.95 0.00 0.00 42.46 44.59 1f5y s ILE 21 CO 0.21 -0.50 1.11 -0.55 -1.79 0.00 0.00 174.94 173.42 1f5y s SER 22 N -1.82 4.32 0.34 4.36 0.15 -1.26 0.12 113.70 119.90 1f5y s SER 22 Ca -0.07 0.35 0.03 0.00 0.70 0.00 0.00 55.95 56.96 1f5y s SER 22 Cb -0.07 -0.80 0.65 0.00 -1.71 0.00 0.00 66.02 64.09 1f5y s SER 22 CO -0.01 -1.94 1.95 1.88 1.20 0.00 0.00 173.24 176.32 1f5y h TYR 23 N -0.89 0.87 -0.17 3.44 0.05 -1.94 -0.04 116.97 118.29 1f5y h TYR 23 Ca -0.44 0.02 0.05 0.00 0.05 0.00 0.00 58.73 58.42 1f5y h TYR 23 Cb 1.29 -0.29 -0.01 0.00 1.01 0.00 0.00 36.73 38.74 1f5y h TYR 23 CO -0.08 0.47 0.33 0.87 -1.05 0.00 0.00 178.16 178.70 1f5y h LYS 24 N 0.87 0.00 0.04 4.88 6.56 -1.99 0.11 116.57 127.05 1f5y h LYS 24 Ca 0.33 0.00 -0.31 0.00 -1.06 0.00 0.00 60.65 59.62 1f5y h LYS 24 Cb 0.20 0.00 -0.04 0.00 -0.57 0.00 0.00 32.23 31.82 1f5y h LYS 24 CO -0.11 0.00 -1.72 -1.49 -2.06 0.00 0.00 179.45 174.07 1f5y h TRP 25 N 0.00 0.16 -4.07 -1.35 4.06 -1.36 -3.45 115.95 109.95 1f5y h TRP 25 Ca 0.08 -0.12 -0.46 0.00 2.06 0.00 0.00 58.89 60.45 1f5y h TRP 25 Cb 0.73 -0.01 0.00 0.00 -1.00 0.00 0.00 29.16 28.89 1f5y h TRP 25 CO 0.00 1.23 0.36 0.14 -3.56 0.00 0.00 178.44 176.61 1f5y s VAL 26 N -2.60 4.07 -1.46 1.49 -7.23 0.40 -4.07 120.40 111.01 1f5y s VAL 26 Ca -0.09 1.29 -0.15 0.00 -1.81 0.00 0.00 61.98 61.22 1f5y s VAL 26 Cb 0.08 -3.52 0.15 0.00 0.56 0.00 0.00 36.38 33.65 1f5y s VAL 26 CO 0.81 -0.27 0.39 0.00 -0.31 0.00 0.00 175.10 175.72 1f5y h ASP 28 N -0.80 0.78 0.00 0.00 2.03 -1.86 -3.47 116.42 113.11 1f5y h ASP 28 Ca -0.49 -0.80 0.00 0.00 -0.73 0.00 0.00 57.03 55.01 1f5y h ASP 28 Cb 1.11 -0.25 0.00 0.00 -0.83 0.00 0.00 39.33 39.36 1f5y h ASP 28 CO 0.69 1.62 0.00 0.61 -1.03 0.00 0.00 179.24 181.13 1f5y n GLY 29 N 1.59 -0.18 3.19 7.15 0.00 -1.26 -5.14 105.19 110.53 1f5y n GLY 29 Ca -0.15 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.76 1f5y n GLY 29 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1f5y s SER 30 N 0.00 0.29 -0.36 1.61 0.15 -1.26 -5.13 113.70 108.99 1f5y s SER 30 Ca 0.00 -1.31 -0.13 0.00 0.70 0.00 0.00 55.95 55.21 1f5y s SER 30 Cb 0.00 0.33 -0.00 0.00 -1.71 0.00 0.00 66.02 64.64 1f5y s SER 30 CO 0.00 -0.78 0.25 0.00 1.20 0.00 0.00 173.24 173.91 1f5y s ALA 31 N -4.08 3.46 -0.17 5.45 0.00 -1.26 -4.52 121.76 120.64 1f5y s ALA 31 Ca 0.33 -1.52 0.19 0.00 0.00 0.00 0.00 51.96 50.96 1f5y s ALA 31 Cb 0.07 -2.71 -0.09 0.00 0.00 0.00 0.00 23.12 20.39 1f5y s ALA 31 CO 0.08 -1.16 0.89 0.39 0.00 0.00 0.00 175.76 175.96 1f5y n GLU 32 N 5.11 0.62 0.23 0.00 4.71 -1.26 -3.89 120.64 126.15 1f5y n GLU 32 Ca -0.12 0.16 0.13 0.00 -0.01 0.00 0.00 57.16 57.32 1f5y n GLU 32 Cb 0.48 -1.80 0.28 0.00 -1.01 0.00 0.00 31.44 29.39 1f5y n GLU 32 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1f5y n GLN 34 N -3.11 -1.77 0.00 0.00 0.00 -1.25 -4.86 117.38 106.40 1f5y n GLN 34 Ca 0.03 0.20 0.00 0.00 -0.00 0.00 0.00 57.00 57.23 1f5y n GLN 34 Cb 0.49 -3.34 0.00 0.00 0.00 0.00 0.00 30.24 27.39 1f5y n GLN 34 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.06 176.81 1f5y n ASP 35 N 0.49 -0.02 0.00 1.69 9.92 -1.26 -5.03 116.55 122.34 1f5y n ASP 35 Ca -0.00 0.02 0.00 0.00 -0.53 0.00 0.00 54.79 54.27 1f5y n ASP 35 Cb 0.52 0.07 0.00 0.00 -0.64 0.00 0.00 41.12 41.07 1f5y n ASP 35 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1f5y n GLY 36 N 1.19 0.84 0.46 0.44 0.00 -1.26 -5.00 105.19 101.85 1f5y n GLY 36 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.87 1f5y n GLY 36 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1f5y h SER 37 N 0.00 -1.58 0.27 1.61 0.87 -1.96 1.39 113.55 114.15 1f5y h SER 37 Ca 0.00 0.18 0.00 0.00 -1.23 0.00 0.00 61.79 60.74 1f5y h SER 37 Cb 0.00 0.61 0.00 0.00 -0.44 0.00 0.00 62.40 62.57 1f5y h SER 37 CO 0.00 -0.50 0.00 -2.24 -0.53 0.00 0.00 176.83 173.56 1f5y h ASP 38 N -0.63 0.00 -0.08 6.23 3.04 -1.94 -1.61 116.42 121.43 1f5y h ASP 38 Ca 0.03 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.82 1f5y h ASP 38 Cb 0.70 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 38.99 1f5y h ASP 38 CO -0.37 0.00 0.00 1.21 -2.04 0.00 0.00 179.24 178.04 1f5y n GLU 39 N -2.74 1.43 -1.01 4.15 4.07 0.55 -0.61 120.64 126.48 1f5y n GLU 39 Ca -0.01 -1.57 -0.22 0.00 -0.06 0.00 0.00 57.16 55.30 1f5y n GLU 39 Cb 0.12 -1.32 0.08 0.00 -0.06 0.00 0.00 31.44 30.26 1f5y n GLU 39 CO 0.00 0.00 0.00 0.45 -0.06 0.00 0.00 177.13 177.52 1f5y n SER 40 N 0.91 5.89 0.00 4.31 2.88 0.45 -4.83 113.62 123.23 1f5y n SER 40 Ca 0.10 -3.29 0.00 0.00 -1.33 0.00 0.00 58.87 54.35 1f5y n SER 40 Cb 0.41 -0.93 0.00 0.00 -0.75 0.00 0.00 64.21 62.94 1f5y n SER 40 CO 0.00 0.00 0.00 1.67 -1.23 0.00 0.00 175.04 175.48 1f5y n GLN 41 N -0.34 0.00 -0.45 -1.46 7.27 -1.26 -4.79 117.38 116.35 1f5y n GLN 41 Ca 0.43 0.00 0.37 0.00 0.07 0.00 0.00 57.00 57.88 1f5y n GLN 41 Cb 0.84 -3.90 0.68 0.00 2.41 0.00 0.00 30.24 30.28 1f5y n GLN 41 CO 0.00 0.00 0.00 0.93 0.07 0.00 0.00 177.06 178.06 1f5y h GLU 42 N 0.03 0.10 0.00 3.69 3.07 -1.89 -3.37 114.58 116.20 1f5y h GLU 42 Ca 0.00 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 58.85 1f5y h GLU 42 Cb 0.00 -0.02 0.00 0.00 -0.84 0.00 0.00 28.75 27.89 1f5y h GLU 42 CO 0.00 0.07 0.00 0.25 -1.40 0.00 0.00 179.01 177.93 1f5y n THR 43 N -4.41 0.00 -1.82 1.13 -2.24 -1.26 -4.89 114.28 100.79 1f5y n THR 43 Ca 0.34 0.00 -0.19 0.00 -2.27 0.00 0.00 64.05 61.93 1f5y n THR 43 Cb 1.41 0.00 -0.06 0.00 -2.10 0.00 0.00 70.33 69.58 1f5y n THR 43 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1f5y n LEU 45 N -2.47 2.87 0.00 0.00 4.77 -1.26 -4.85 117.00 116.06 1f5y n LEU 45 Ca -0.20 0.02 0.00 0.00 -0.03 0.00 0.00 56.01 55.80 1f5y n LEU 45 Cb 0.63 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.71 1f5y n LEU 45 CO 0.28 -0.01 0.00 -1.20 -1.33 0.00 0.00 177.39 175.13 1f5y n SER 46 N -0.53 0.00 0.00 -1.43 7.64 -1.26 -2.83 113.62 115.21 1f5y n SER 46 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1f5y n SER 46 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1f5y n SER 46 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 1f5y n VAL 47 N 0.00 0.00 -1.71 0.44 0.24 -1.26 -3.71 118.33 112.34 1f5y n VAL 47 Ca 0.00 0.00 -0.40 0.00 -2.04 0.00 0.00 64.34 61.90 1f5y n VAL 47 Cb 0.00 -0.52 -0.01 0.00 -1.47 0.00 0.00 33.84 31.84 1f5y n VAL 47 CO 0.00 0.00 0.00 1.07 -2.14 0.00 0.00 176.83 175.76 1f5y n THR 48 N 0.00 4.55 -0.17 3.34 5.66 -1.25 -3.25 114.28 123.16 1f5y n THR 48 Ca 0.00 -3.43 -0.11 0.00 -3.05 0.00 0.00 64.05 57.46 1f5y n THR 48 Cb 0.00 -2.40 0.11 0.00 -1.55 0.00 0.00 70.33 66.49 1f5y n THR 48 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1f5y n LYS 50 N -2.59 -1.57 -3.20 0.00 4.81 -1.26 -0.63 118.16 113.73 1f5y n LYS 50 Ca 0.05 0.77 -0.12 0.00 -0.87 0.00 0.00 58.31 58.13 1f5y n LYS 50 Cb 0.22 -5.14 0.06 0.00 0.02 0.00 0.00 35.03 30.19 1f5y n LYS 50 CO 0.00 0.00 0.00 0.45 1.17 0.00 0.00 177.40 179.02 1f5y n SER 51 N -0.98 -6.82 0.00 3.14 2.88 -1.25 -4.57 113.62 106.02 1f5y n SER 51 Ca -0.15 -0.59 0.00 0.00 -1.33 0.00 0.00 58.87 56.81 1f5y n SER 51 Cb 0.51 -5.19 0.00 0.00 -0.75 0.00 0.00 64.21 58.78 1f5y n SER 51 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1f5y n GLY 52 N -1.33 1.53 0.00 0.46 0.00 -0.35 -5.14 105.19 100.36 1f5y n GLY 52 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.96 1f5y n GLY 52 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1f5y n ASP 53 N 0.00 1.28 -3.81 1.61 9.92 0.20 -4.08 116.55 121.68 1f5y n ASP 53 Ca 0.00 0.00 -0.30 0.00 -0.53 0.00 0.00 54.79 53.96 1f5y n ASP 53 Cb 0.00 0.00 -0.14 0.00 -0.64 0.00 0.00 41.12 40.34 1f5y n ASP 53 CO 0.00 0.00 0.00 0.12 0.13 0.00 0.00 177.20 177.45 1f5y s PHE 54 N 1.40 2.40 -0.11 1.24 5.36 0.12 -4.23 117.98 124.16 1f5y s PHE 54 Ca 0.00 -2.48 -0.29 0.00 -0.96 0.00 0.00 56.93 53.20 1f5y s PHE 54 Cb 0.00 -2.17 -0.04 0.00 -0.34 0.00 0.00 43.02 40.47 1f5y s PHE 54 CO 0.00 -0.83 1.58 0.45 -1.46 0.00 0.00 175.22 174.96 1f5y s SER 55 N 0.65 6.64 0.18 6.13 0.15 -1.20 -0.81 113.70 125.44 1f5y s SER 55 Ca 0.14 2.00 -0.14 0.00 0.70 0.00 0.00 55.95 58.65 1f5y s SER 55 Cb -0.22 -2.53 0.14 0.00 -1.71 0.00 0.00 66.02 61.70 1f5y s SER 55 CO -0.07 -0.98 1.73 0.00 1.20 0.00 0.00 173.24 175.11 1f5y n GLY 57 N -1.26 -0.51 0.09 0.00 0.00 -1.10 -4.87 105.19 97.53 1f5y n GLY 57 Ca 0.04 -0.92 -0.03 0.00 0.00 0.00 0.00 46.02 45.11 1f5y n GLY 57 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1f5y n GLY 58 N 0.00 -1.11 0.16 -0.02 0.00 -1.26 -4.01 105.19 98.95 1f5y n GLY 58 Ca 0.00 -0.12 -0.08 0.00 0.00 0.00 0.00 46.02 45.82 1f5y n GLY 58 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1f5y h ARG 59 N 0.00 0.43 -4.22 1.61 0.11 -2.02 -3.41 114.38 106.88 1f5y h ARG 59 Ca -0.23 -0.03 -0.38 0.00 0.10 0.00 0.00 59.98 59.44 1f5y h ARG 59 Cb 1.76 -0.10 -0.32 0.00 1.11 0.00 0.00 29.97 32.43 1f5y h ARG 59 CO 0.05 0.28 -0.77 0.14 0.10 0.00 0.00 179.97 179.78 1f5y s VAL 60 N -6.16 0.53 -0.74 0.08 -7.23 -1.26 -5.10 120.40 100.52 1f5y s VAL 60 Ca -0.13 -0.19 -0.08 0.00 -1.81 0.00 0.00 61.98 59.77 1f5y s VAL 60 Cb 0.10 -0.51 0.19 0.00 0.56 0.00 0.00 36.38 36.73 1f5y s VAL 60 CO 0.71 0.19 0.61 0.21 -0.31 0.00 0.00 175.10 176.52 1f5y s ASN 61 N 0.44 5.98 -0.18 4.85 2.47 -1.26 -2.70 114.94 124.54 1f5y s ASN 61 Ca -0.06 -2.84 -0.06 0.00 0.42 0.00 0.00 52.86 50.33 1f5y s ASN 61 Cb -0.09 -2.02 0.08 0.00 -1.45 0.00 0.00 41.25 37.77 1f5y s ASN 61 CO 0.00 -0.45 0.36 -0.60 -3.72 0.00 0.00 177.10 172.69 1f5y s ARG 62 N -0.04 0.26 -0.04 0.43 3.52 -1.26 -5.03 118.95 116.78 1f5y s ARG 62 Ca 0.18 0.89 -0.30 0.00 -0.13 0.00 0.00 55.73 56.37 1f5y s ARG 62 Cb -0.15 0.13 -0.02 0.00 -1.56 0.00 0.00 34.95 33.35 1f5y s ARG 62 CO -0.06 -0.29 1.01 0.00 -0.81 0.00 0.00 175.30 175.14 1f5y s ILE 64 N 1.46 4.86 0.04 0.00 -1.09 0.01 -4.80 121.20 121.68 1f5y s ILE 64 Ca 0.51 -0.03 -0.35 0.00 -2.23 0.00 0.00 60.65 58.54 1f5y s ILE 64 Cb -0.20 -3.10 -0.14 0.00 -1.58 0.00 0.00 42.46 37.44 1f5y s ILE 64 CO 0.24 0.58 1.61 -2.65 -1.23 0.00 0.00 174.94 173.49 1f5y n PRO 65 N 2.34 1.81 -0.34 2.79 -0.02 -1.26 0.16 135.00 140.48 1f5y n PRO 65 Ca -0.19 0.66 0.17 0.00 -2.02 0.00 0.00 63.50 62.12 1f5y n PRO 65 Cb 0.54 -2.41 0.38 0.00 -0.02 0.00 0.00 33.50 31.99 1f5y n PRO 65 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 1f5y h GLN 66 N 6.52 0.53 0.00 -0.52 4.15 -1.85 0.11 115.11 124.05 1f5y h GLN 66 Ca -0.47 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 58.92 1f5y h GLN 66 Cb 1.28 -0.12 0.00 0.00 0.21 0.00 0.00 27.48 28.86 1f5y h GLN 66 CO 0.88 0.35 0.00 1.97 -1.93 0.00 0.00 178.83 180.10 1f5y n PHE 67 N -4.92 0.05 1.88 3.99 -1.74 -1.26 -1.14 117.46 114.32 1f5y n PHE 67 Ca 0.27 0.02 0.02 0.00 -0.56 0.00 0.00 57.45 57.20 1f5y n PHE 67 Cb 0.75 -0.54 0.13 0.00 1.52 0.00 0.00 39.48 41.34 1f5y n PHE 67 CO 0.00 0.00 0.00 0.91 -0.56 0.00 0.00 176.76 177.11 1f5y n TRP 68 N -1.55 0.00 -2.82 2.97 7.02 0.03 -4.63 117.44 118.45 1f5y n TRP 68 Ca 0.01 0.00 -0.41 0.00 -1.02 0.00 0.00 57.50 56.07 1f5y n TRP 68 Cb 0.04 0.00 -0.04 0.00 -2.42 0.00 0.00 31.31 28.89 1f5y n TRP 68 CO 0.00 0.00 0.00 0.50 -2.02 0.00 0.00 177.69 176.17 1f5y s ARG 69 N -2.00 4.51 -1.47 -0.99 3.00 -0.30 -3.17 118.95 118.53 1f5y s ARG 69 Ca 0.07 1.23 -0.08 0.00 -1.00 0.00 0.00 55.73 55.95 1f5y s ARG 69 Cb 0.03 -3.46 0.02 0.00 0.00 0.00 0.00 34.95 31.55 1f5y s ARG 69 CO 0.05 -0.02 0.81 0.00 0.00 0.00 0.00 175.30 176.14 1f5y n ASP 71 N -2.68 0.96 0.00 0.00 2.03 -0.84 -4.95 116.55 111.07 1f5y n ASP 71 Ca -0.05 -1.36 0.00 0.00 0.52 0.00 0.00 54.79 53.91 1f5y n ASP 71 Cb 0.58 -0.01 0.00 0.00 -0.72 0.00 0.00 41.12 40.97 1f5y n ASP 71 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1f5y n GLY 72 N 1.09 1.76 3.39 0.27 0.00 -1.26 -4.91 105.19 105.54 1f5y n GLY 72 Ca 0.20 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.78 1f5y n GLY 72 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1f5y s GLN 73 N 0.00 2.95 0.06 1.61 0.74 -1.26 -5.00 119.66 118.76 1f5y s GLN 73 Ca 0.00 -1.30 -0.31 0.00 0.05 0.00 0.00 55.36 53.80 1f5y s GLN 73 Cb 0.00 -4.08 -0.08 0.00 1.10 0.00 0.00 33.01 29.95 1f5y s GLN 73 CO 0.00 -0.98 1.56 0.08 -0.55 0.00 0.00 175.29 175.40 1f5y s VAL 74 N 1.63 3.19 -0.07 1.34 1.01 -1.26 -4.84 120.40 121.41 1f5y s VAL 74 Ca 0.04 0.67 0.01 0.00 0.00 0.00 0.00 61.98 62.70 1f5y s VAL 74 Cb -0.23 -3.43 -0.05 0.00 0.00 0.00 0.00 36.38 32.67 1f5y s VAL 74 CO 0.07 0.01 -0.06 0.47 0.00 0.00 0.00 175.10 175.58 1f5y n ASP 75 N 5.28 3.46 -4.84 3.32 8.00 -1.26 -5.01 116.55 125.50 1f5y n ASP 75 Ca 0.15 -0.04 -0.37 0.00 0.71 0.00 0.00 54.79 55.24 1f5y n ASP 75 Cb 0.41 -0.09 -0.06 0.00 -0.02 0.00 0.00 41.12 41.37 1f5y n ASP 75 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1f5y h ASP 77 N 4.34 0.46 0.49 0.00 3.58 -1.95 -0.16 116.42 123.18 1f5y h ASP 77 Ca -0.50 0.01 0.00 0.00 0.42 0.00 0.00 57.03 56.95 1f5y h ASP 77 Cb 1.21 -0.09 0.00 0.00 1.72 0.00 0.00 39.33 42.17 1f5y h ASP 77 CO 0.63 0.32 0.00 -0.46 -2.88 0.00 0.00 179.24 176.86 1f5y n ASN 78 N -4.82 0.55 -2.22 2.28 0.23 -1.26 -4.85 115.26 105.17 1f5y n ASN 78 Ca 0.04 0.67 -0.21 0.00 -0.53 0.00 0.00 54.58 54.55 1f5y n ASN 78 Cb 0.09 -0.77 -0.03 0.00 -2.08 0.00 0.00 39.78 36.99 1f5y n ASN 78 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1f5y n GLY 79 N -0.40 0.07 0.57 4.83 0.00 -0.07 -4.82 105.19 105.37 1f5y n GLY 79 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 1f5y n GLY 79 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1f5y n SER 80 N -1.85 0.82 0.00 1.61 7.64 -1.26 0.12 113.62 120.70 1f5y n SER 80 Ca -0.24 -1.27 0.00 0.00 1.01 0.00 0.00 58.87 58.37 1f5y n SER 80 Cb 0.68 -0.32 0.00 0.00 -1.01 0.00 0.00 64.21 63.57 1f5y n SER 80 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 1f5y n ASP 81 N 0.25 0.76 0.13 6.43 5.75 -1.26 -4.06 116.55 124.55 1f5y n ASP 81 Ca 0.00 -1.17 0.00 0.00 -0.01 0.00 0.00 54.79 53.61 1f5y n ASP 81 Cb 0.18 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.27 1f5y n ASP 81 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 1f5y n GLU 82 N -0.09 0.00 0.01 0.11 4.71 -0.57 0.62 120.64 125.43 1f5y n GLU 82 Ca 0.00 0.00 -0.16 0.00 -0.01 0.00 0.00 57.16 56.99 1f5y n GLU 82 Cb 0.17 -0.09 -0.05 0.00 -1.01 0.00 0.00 31.44 30.47 1f5y n GLU 82 CO 0.00 0.00 0.00 1.96 0.09 0.00 0.00 177.13 179.18 1f5y h GLN 83 N 0.00 0.68 -0.33 3.49 1.08 -0.64 -3.07 115.11 116.32 1f5y h GLN 83 Ca 0.00 -0.58 0.00 0.00 -1.45 0.00 0.00 58.65 56.62 1f5y h GLN 83 Cb 0.00 0.13 0.00 0.00 -0.05 0.00 0.00 27.48 27.56 1f5y h GLN 83 CO 0.00 1.19 0.00 0.41 -0.95 0.00 0.00 178.83 179.48 1f5y n GLY 84 N 0.73 0.34 0.00 3.46 0.00 -0.58 -4.95 105.19 104.18 1f5y n GLY 84 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.95 1f5y n GLY 84 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32