#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1vor n HIS 3 N 0.00 0.37 -3.34 1.43 -0.00 -1.26 -4.77 115.22 107.64 1vor n HIS 3 Ca 0.00 0.11 -0.10 0.00 -0.00 0.00 0.00 57.72 57.73 1vor n HIS 3 Cb 0.00 -0.57 -0.08 0.00 -0.00 0.00 0.00 29.99 29.35 1vor n HIS 3 CO 0.00 0.00 0.00 -0.47 -0.00 0.00 0.00 176.34 175.87 1vor s TYR 4 N -3.31 -0.83 0.00 4.41 6.14 -1.26 -3.15 117.35 119.34 1vor s TYR 4 Ca -0.00 0.59 0.00 0.00 0.64 0.00 0.00 57.07 58.30 1vor s TYR 4 Cb 0.13 -0.08 0.00 0.00 0.42 0.00 0.00 41.96 42.43 1vor s TYR 4 CO 0.83 -0.81 0.00 -3.47 0.64 0.00 0.00 175.55 172.74 1vor n ASP 5 N 5.36 0.00 0.00 4.32 4.64 -1.26 -4.95 116.55 124.65 1vor n ASP 5 Ca -0.02 0.00 0.00 0.00 -1.38 0.00 0.00 54.79 53.39 1vor n ASP 5 Cb 0.50 0.00 0.00 0.00 -1.04 0.00 0.00 41.12 40.58 1vor n ASP 5 CO 0.00 0.00 0.00 -0.38 -0.82 0.00 0.00 177.20 176.00 1vor n ILE 6 N 0.00 0.00 -1.66 5.18 2.08 -1.26 -4.94 119.36 118.76 1vor n ILE 6 Ca 0.00 0.00 -0.46 0.00 0.56 0.00 0.00 62.75 62.85 1vor n ILE 6 Cb 0.00 -0.09 -0.04 0.00 -0.75 0.00 0.00 39.64 38.76 1vor n ILE 6 CO 0.00 0.00 0.00 -0.11 0.56 0.00 0.00 176.55 177.00 1vor n LEU 7 N -1.95 2.88 -3.06 1.39 0.00 -1.26 -4.76 117.00 110.25 1vor n LEU 7 Ca 0.00 1.11 0.03 0.00 0.00 0.00 0.00 56.01 57.15 1vor n LEU 7 Cb 0.00 -1.39 -0.00 0.00 0.00 0.00 0.00 43.42 42.03 1vor n LEU 7 CO 0.00 -0.47 0.32 -1.58 0.00 0.00 0.00 177.39 175.65 1vor s GLN 8 N 0.39 0.40 0.23 1.96 0.74 -1.26 -5.08 119.66 117.04 1vor s GLN 8 Ca 0.76 0.07 0.00 0.00 0.05 0.00 0.00 55.36 56.24 1vor s GLN 8 Cb -0.71 0.10 0.00 0.00 1.10 0.00 0.00 33.01 33.50 1vor s GLN 8 CO 0.43 -0.64 0.00 0.00 -0.55 0.00 0.00 175.29 174.53 1vor n ALA 9 N 4.60 -1.39 -1.04 1.58 0.00 -1.26 -4.14 120.51 118.86 1vor n ALA 9 Ca 0.08 0.34 0.00 0.00 0.00 0.00 0.00 53.44 53.86 1vor n ALA 9 Cb 0.58 -0.61 0.00 0.00 0.00 0.00 0.00 19.45 19.42 1vor n ALA 9 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1vor n PRO 10 N -2.81 0.02 0.00 0.00 -0.04 -1.26 -3.80 135.00 127.11 1vor n PRO 10 Ca -0.03 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.43 1vor n PRO 10 Cb 0.25 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.71 1vor n PRO 10 CO 0.00 0.00 0.00 1.55 -0.04 0.00 0.00 175.50 177.01 1vor n VAL 11 N 0.00 0.00 -2.08 0.52 3.14 -1.26 -3.68 118.33 114.97 1vor n VAL 11 Ca 0.00 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.38 1vor n VAL 11 Cb 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 32.78 1vor n VAL 11 CO 0.00 0.00 0.00 2.30 -6.46 0.00 0.00 176.83 172.67 1vor n ILE 12 N -0.07 -0.99 -4.27 1.55 -5.35 -1.26 -5.04 119.36 103.93 1vor n ILE 12 Ca 0.00 0.18 -0.15 0.00 -0.27 0.00 0.00 62.75 62.52 1vor n ILE 12 Cb 0.00 -1.75 -0.10 0.00 -1.74 0.00 0.00 39.64 36.05 1vor n ILE 12 CO 0.00 0.00 0.00 -0.55 -1.76 0.00 0.00 176.55 174.24 1vor s SER 13 N -0.36 1.56 0.06 7.28 0.15 -1.26 -5.05 113.70 116.08 1vor s SER 13 Ca 0.00 -1.13 0.01 0.00 0.70 0.00 0.00 55.95 55.53 1vor s SER 13 Cb 0.00 0.05 -0.26 0.00 -1.71 0.00 0.00 66.02 64.10 1vor s SER 13 CO 0.00 -0.48 1.08 -0.08 1.20 0.00 0.00 173.24 174.96 1vor h GLU 14 N 2.67 0.16 -1.41 5.44 4.57 -1.97 -3.03 114.58 121.01 1vor h GLU 14 Ca -0.37 -0.28 -0.58 0.00 -1.18 0.00 0.00 59.36 56.95 1vor h GLU 14 Cb 1.20 0.10 -0.23 0.00 -0.16 0.00 0.00 28.75 29.66 1vor h GLU 14 CO 0.64 1.07 0.74 1.17 -1.18 0.00 0.00 179.01 181.45 1vor n LYS 15 N -3.42 2.44 -4.68 1.92 3.00 -1.26 -4.40 118.16 111.75 1vor n LYS 15 Ca -0.08 -2.78 -0.25 0.00 -0.00 0.00 0.00 58.31 55.20 1vor n LYS 15 Cb 1.00 -2.09 -0.16 0.00 0.00 0.00 0.00 35.03 33.78 1vor n LYS 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1vor s ALA 16 N -3.12 1.37 -1.26 3.14 0.00 -1.15 -3.47 121.76 117.28 1vor s ALA 16 Ca 0.53 -0.51 -0.02 0.00 0.00 0.00 0.00 51.96 51.97 1vor s ALA 16 Cb 0.42 -0.57 0.00 0.00 0.00 0.00 0.00 23.12 22.97 1vor s ALA 16 CO -0.10 0.16 0.99 0.98 0.00 0.00 0.00 175.76 177.79 1vor n TYR 17 N 3.65 -2.27 0.00 0.00 4.19 -0.07 -4.56 117.16 118.10 1vor n TYR 17 Ca -0.22 0.94 0.00 0.00 3.31 0.00 0.00 57.90 61.93 1vor n TYR 17 Cb 0.52 -4.94 0.00 0.00 0.49 0.00 0.00 39.34 35.41 1vor n TYR 17 CO 0.00 0.00 0.00 0.45 0.91 0.00 0.00 176.86 178.22 1vor n SER 18 N -3.09 0.00 0.00 2.98 2.88 -1.26 -4.77 113.62 110.36 1vor n SER 18 Ca -0.23 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.31 1vor n SER 18 Cb 0.65 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.11 1vor n SER 18 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1vor n ALA 19 N -0.89 0.80 -3.10 -1.46 0.00 -1.23 -4.84 120.51 109.80 1vor n ALA 19 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 53.44 53.15 1vor n ALA 19 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.40 1vor n ALA 19 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1vor n MET 20 N -0.53 3.24 -0.01 0.00 2.81 -1.26 -4.76 117.12 116.61 1vor n MET 20 Ca 0.00 -4.77 -0.02 0.00 -1.81 0.00 0.00 57.70 51.11 1vor n MET 20 Cb 0.00 -2.28 -0.01 0.00 -0.71 0.00 0.00 33.22 30.22 1vor n MET 20 CO 0.00 0.00 0.00 -1.91 1.51 0.00 0.00 175.97 175.57 1vor n GLU 21 N 0.26 0.68 -0.24 0.03 0.00 -1.26 -0.89 120.64 119.21 1vor n GLU 21 Ca 0.32 0.01 0.28 0.00 0.00 0.00 0.00 57.16 57.77 1vor n GLU 21 Cb 0.38 -1.05 0.67 0.00 0.00 0.00 0.00 31.44 31.44 1vor n GLU 21 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1vor h ARG 22 N 0.00 0.11 0.00 5.31 2.47 -1.95 -3.43 114.38 116.89 1vor h ARG 22 Ca -0.06 -0.01 0.00 0.00 -1.26 0.00 0.00 59.98 58.66 1vor h ARG 22 Cb 1.10 -0.02 0.00 0.00 -1.65 0.00 0.00 29.97 29.39 1vor h ARG 22 CO -0.01 0.07 0.00 0.41 0.56 0.00 0.00 179.97 181.00 1vor n GLY 23 N -1.67 0.88 3.69 0.04 0.00 -1.26 -4.90 105.19 101.98 1vor n GLY 23 Ca 0.21 -0.04 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 1vor n GLY 23 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 173.32 174.87 1vor n VAL 24 N 0.00 2.37 -1.07 1.61 3.14 -0.74 -4.74 118.33 118.90 1vor n VAL 24 Ca 0.00 -0.50 0.00 0.00 -2.96 0.00 0.00 64.34 60.88 1vor n VAL 24 Cb 0.00 -1.54 0.00 0.00 -1.06 0.00 0.00 33.84 31.24 1vor n VAL 24 CO 0.00 0.00 0.00 -1.22 -6.46 0.00 0.00 176.83 169.15 1vor n TYR 25 N -0.05 0.00 -1.73 1.45 4.01 -1.12 -4.52 117.16 115.20 1vor n TYR 25 Ca 0.06 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.80 1vor n TYR 25 Cb 0.38 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.41 1vor n TYR 25 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 1vor n SER 26 N 0.00 0.00 -0.05 7.72 7.64 -1.17 -4.52 113.62 123.24 1vor n SER 26 Ca 0.00 -0.81 0.00 0.00 1.01 0.00 0.00 58.87 59.07 1vor n SER 26 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1vor n SER 26 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 1vor n PHE 27 N 0.00 -0.47 -2.68 1.43 0.99 -0.96 -0.17 117.46 115.60 1vor n PHE 27 Ca 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 57.45 57.40 1vor n PHE 27 Cb 0.20 0.04 0.06 0.00 -1.00 0.00 0.00 39.48 38.79 1vor n PHE 27 CO 0.00 0.00 0.00 1.87 -0.00 0.00 0.00 176.76 178.63 1vor n TRP 28 N -0.11 -0.87 0.00 1.38 -0.00 -1.24 -4.18 117.44 112.42 1vor n TRP 28 Ca 0.00 -0.78 0.00 0.00 -0.00 0.00 0.00 57.50 56.72 1vor n TRP 28 Cb 0.00 1.14 0.00 0.00 -0.00 0.00 0.00 31.31 32.45 1vor n TRP 28 CO 0.00 0.00 0.00 1.33 -0.00 0.00 0.00 177.69 179.02 1vor n VAL 29 N 1.82 0.00 -4.49 5.87 0.24 -1.26 -4.46 118.33 116.05 1vor n VAL 29 Ca 0.05 0.00 -0.23 0.00 -2.04 0.00 0.00 64.34 62.11 1vor n VAL 29 Cb 0.68 0.00 -0.11 0.00 -1.47 0.00 0.00 33.84 32.95 1vor n VAL 29 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 1vor s SER 30 N -1.32 3.09 0.61 -1.34 1.04 -1.26 -4.80 113.70 109.73 1vor s SER 30 Ca 0.00 -1.25 0.25 0.00 0.48 0.00 0.00 55.95 55.43 1vor s SER 30 Cb 0.00 -0.23 1.35 0.00 0.10 0.00 0.00 66.02 67.24 1vor s SER 30 CO 0.00 -0.37 1.74 -0.65 0.98 0.00 0.00 173.24 174.94 1vor h PRO 31 N 2.12 0.00 -6.26 4.02 0.11 -1.99 -3.38 132.00 126.62 1vor h PRO 31 Ca -0.41 0.00 -0.53 0.00 0.11 0.00 0.00 66.00 65.17 1vor h PRO 31 Cb 1.24 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.29 1vor h PRO 31 CO 0.70 0.00 1.15 0.15 -0.21 0.00 0.00 178.00 179.80 1vor s LYS 32 N -3.97 3.05 0.00 1.05 1.02 -1.26 -4.97 119.74 114.66 1vor s LYS 32 Ca -0.03 0.16 0.00 0.00 0.02 0.00 0.00 55.97 56.12 1vor s LYS 32 Cb 0.07 -4.23 0.00 0.00 -0.52 0.00 0.00 37.83 33.15 1vor s LYS 32 CO 0.23 -2.27 0.00 0.00 -0.92 0.00 0.00 175.35 172.38 1vor n ALA 33 N 10.39 0.00 -0.44 5.17 0.00 -1.26 -4.92 120.51 129.46 1vor n ALA 33 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.54 1vor n ALA 33 Cb 0.50 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.95 1vor n ALA 33 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1vor n THR 34 N 0.00 0.00 -3.14 0.00 -2.24 -1.26 -4.80 114.28 102.84 1vor n THR 34 Ca 0.00 0.00 0.06 0.00 -2.27 0.00 0.00 64.05 61.84 1vor n THR 34 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 1vor n THR 34 CO 0.00 0.00 0.00 -1.59 -0.57 0.00 0.00 175.07 172.91 1vor s LYS 35 N 0.00 0.08 -0.13 -0.78 -2.85 -1.26 -4.98 119.74 109.82 1vor s LYS 35 Ca 0.00 0.08 0.05 0.00 -1.00 0.00 0.00 55.97 55.10 1vor s LYS 35 Cb 0.00 0.04 0.16 0.00 -2.06 0.00 0.00 37.83 35.96 1vor s LYS 35 CO 0.00 -0.15 0.91 2.41 0.10 0.00 0.00 175.35 178.62 1vor n THR 36 N 5.02 0.00 0.23 3.79 -1.04 -1.26 -4.95 114.28 116.06 1vor n THR 36 Ca 0.10 -0.38 0.00 0.00 -2.04 0.00 0.00 64.05 61.73 1vor n THR 36 Cb 0.58 0.62 0.00 0.00 -1.82 0.00 0.00 70.33 69.72 1vor n THR 36 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1vor n GLU 37 N -0.59 0.00 -1.75 -2.82 -0.58 -1.26 -5.04 120.64 108.60 1vor n GLU 37 Ca -0.11 0.00 -0.19 0.00 -0.42 0.00 0.00 57.16 56.44 1vor n GLU 37 Cb 0.64 0.00 -0.08 0.00 -0.57 0.00 0.00 31.44 31.43 1vor n GLU 37 CO 0.00 0.00 0.00 -1.50 -0.48 0.00 0.00 177.13 175.15 1vor s ILE 38 N -1.94 3.19 0.00 -3.67 1.10 -1.26 -3.24 121.20 115.38 1vor s ILE 38 Ca 0.00 -0.24 0.00 0.00 -0.51 0.00 0.00 60.65 59.90 1vor s ILE 38 Cb 0.00 -3.78 0.00 0.00 0.15 0.00 0.00 42.46 38.83 1vor s ILE 38 CO 0.00 -0.37 0.00 1.17 -2.11 0.00 0.00 174.94 173.63 1vor n LYS 39 N 8.53 0.00 0.00 3.50 4.81 -1.26 -4.91 118.16 128.83 1vor n LYS 39 Ca 0.44 0.00 0.02 0.00 -0.87 0.00 0.00 58.31 57.90 1vor n LYS 39 Cb 0.46 0.00 0.11 0.00 0.02 0.00 0.00 35.03 35.61 1vor n LYS 39 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 1vor n ASP 40 N 0.00 0.00 -0.03 3.14 4.64 -1.20 -0.38 116.55 122.72 1vor n ASP 40 Ca 0.00 0.20 -0.14 0.00 -1.38 0.00 0.00 54.79 53.47 1vor n ASP 40 Cb 0.00 -0.26 -0.09 0.00 -1.04 0.00 0.00 41.12 39.72 1vor n ASP 40 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 1vor h ALA 41 N 2.20 0.10 -0.70 -1.67 0.00 -1.65 -3.12 119.26 114.43 1vor h ALA 41 Ca 0.00 -0.39 -0.65 0.00 0.00 0.00 0.00 54.91 53.87 1vor h ALA 41 Cb 0.04 -0.01 -0.18 0.00 0.00 0.00 0.00 17.79 17.64 1vor h ALA 41 CO 0.00 0.06 1.30 -0.89 0.00 0.00 0.00 179.25 179.72 1vor n ILE 42 N -4.56 4.39 -3.05 0.00 -0.00 0.49 -4.62 119.36 112.01 1vor n ILE 42 Ca -0.08 -3.96 -0.13 0.00 -0.00 0.00 0.00 62.75 58.58 1vor n ILE 42 Cb 0.42 -1.74 -0.04 0.00 -0.00 0.00 0.00 39.64 38.29 1vor n ILE 42 CO 0.00 0.00 0.00 -1.10 -0.00 0.00 0.00 176.55 175.45 1vor s GLN 43 N -2.01 0.98 0.00 0.38 -1.52 -1.18 -3.52 119.66 112.79 1vor s GLN 43 Ca 0.54 -1.44 0.00 0.00 -1.95 0.00 0.00 55.36 52.52 1vor s GLN 43 Cb 0.29 -0.61 0.00 0.00 -0.22 0.00 0.00 33.01 32.47 1vor s GLN 43 CO -0.18 -1.34 0.00 0.94 -0.25 0.00 0.00 175.29 174.46 1vor n GLN 44 N 3.02 0.00 -1.80 2.91 -0.06 -1.26 -4.97 117.38 115.22 1vor n GLN 44 Ca 0.22 0.00 -0.20 0.00 -2.00 0.00 0.00 57.00 55.02 1vor n GLN 44 Cb 0.52 0.00 -0.09 0.00 -4.06 0.00 0.00 30.24 26.61 1vor n GLN 44 CO 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 177.06 176.86 1vor s ALA 45 N -1.00 1.04 0.00 1.69 0.00 -1.26 -2.47 121.76 119.76 1vor s ALA 45 Ca 0.00 -1.70 0.00 0.00 0.00 0.00 0.00 51.96 50.26 1vor s ALA 45 Cb 0.00 -4.68 0.00 0.00 0.00 0.00 0.00 23.12 18.44 1vor s ALA 45 CO 0.00 -6.14 0.00 0.34 0.00 0.00 0.00 175.76 169.96 1vor n PHE 46 N 17.38 0.00 -2.16 0.00 7.35 -1.26 -5.02 117.46 133.75 1vor n PHE 46 Ca 0.43 0.00 -0.16 0.00 -0.76 0.00 0.00 57.45 56.95 1vor n PHE 46 Cb 0.47 0.04 -0.03 0.00 0.35 0.00 0.00 39.48 40.31 1vor n PHE 46 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1vor n GLY 47 N 0.00 0.08 3.24 7.13 0.00 -1.03 -4.99 105.19 109.62 1vor n GLY 47 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 1vor n GLY 47 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1vor s VAL 48 N -2.70 1.94 -0.03 1.61 1.01 -1.26 -5.10 120.40 115.87 1vor s VAL 48 Ca 0.00 -1.00 0.07 0.00 0.00 0.00 0.00 61.98 61.05 1vor s VAL 48 Cb 0.00 -1.65 -0.02 0.00 0.00 0.00 0.00 36.38 34.71 1vor s VAL 48 CO 0.00 0.54 -0.22 -0.13 0.00 0.00 0.00 175.10 175.29 1vor s ARG 49 N -0.07 2.24 0.02 2.72 0.52 -1.26 -4.25 118.95 118.87 1vor s ARG 49 Ca -0.05 -0.86 0.06 0.00 -0.52 0.00 0.00 55.73 54.36 1vor s ARG 49 Cb -0.14 -2.15 -0.02 0.00 0.52 0.00 0.00 34.95 33.16 1vor s ARG 49 CO 0.04 0.58 -0.19 0.14 0.02 0.00 0.00 175.30 175.89 1vor s VAL 50 N -0.64 1.51 -0.09 3.52 -7.23 -1.23 -5.00 120.40 111.24 1vor s VAL 50 Ca 0.10 -1.03 -0.30 0.00 -1.81 0.00 0.00 61.98 58.95 1vor s VAL 50 Cb -0.10 -1.30 0.11 0.00 0.56 0.00 0.00 36.38 35.65 1vor s VAL 50 CO -0.00 0.24 0.93 -0.51 -0.31 0.00 0.00 175.10 175.45 1vor s ILE 51 N -0.68 0.00 0.00 -0.62 1.10 -1.26 -4.85 121.20 114.89 1vor s ILE 51 Ca 0.06 0.00 0.00 0.00 -0.51 0.00 0.00 60.65 60.20 1vor s ILE 51 Cb -0.08 -1.00 0.00 0.00 0.15 0.00 0.00 42.46 41.53 1vor s ILE 51 CO 0.01 0.00 0.00 0.61 -2.11 0.00 0.00 174.94 173.45 1vor n GLY 52 N 0.31 0.96 3.34 1.50 0.00 -1.26 -3.49 105.19 106.55 1vor n GLY 52 Ca -0.10 -0.55 -0.33 0.00 0.00 0.00 0.00 46.02 45.03 1vor n GLY 52 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1vor n ILE 53 N -2.78 0.00 0.06 -0.61 0.13 -1.26 -3.11 119.36 111.79 1vor n ILE 53 Ca 0.00 -0.24 0.00 0.00 -1.10 0.00 0.00 62.75 61.41 1vor n ILE 53 Cb 0.32 -0.52 0.00 0.00 -0.84 0.00 0.00 39.64 38.60 1vor n ILE 53 CO 0.00 0.00 0.00 -1.20 2.80 0.00 0.00 176.55 178.15 1vor n SER 54 N -0.54 0.76 -1.84 9.51 7.64 -1.26 -4.51 113.62 123.38 1vor n SER 54 Ca 0.05 0.18 0.00 0.00 1.01 0.00 0.00 58.87 60.11 1vor n SER 54 Cb 0.55 -0.17 0.00 0.00 -1.01 0.00 0.00 64.21 63.57 1vor n SER 54 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1vor n THR 55 N -3.42 -6.41 0.00 0.44 -2.24 -1.25 -4.85 114.28 96.55 1vor n THR 55 Ca 0.00 2.67 0.00 0.00 -2.27 0.00 0.00 64.05 64.45 1vor n THR 55 Cb 0.06 -3.61 0.00 0.00 -2.10 0.00 0.00 70.33 64.68 1vor n THR 55 CO 0.00 0.00 0.00 0.80 -0.57 0.00 0.00 175.07 175.30 1vor n MET 56 N 0.63 0.00 0.00 -0.78 1.56 -0.93 -4.90 117.12 112.69 1vor n MET 56 Ca 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.43 1vor n MET 56 Cb 0.00 0.00 0.00 0.00 2.15 0.00 0.00 33.22 35.37 1vor n MET 56 CO 0.00 0.00 0.00 0.27 -0.73 0.00 0.00 175.97 175.51 1vor n ASN 57 N 0.00 0.00 -0.88 6.12 2.04 -1.26 -4.90 115.26 116.38 1vor n ASN 57 Ca 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 54.58 54.14 1vor n ASN 57 Cb 0.00 0.00 0.00 0.00 -2.53 0.00 0.00 39.78 37.25 1vor n ASN 57 CO 0.00 0.00 0.00 0.52 -0.44 0.00 0.00 177.26 177.34 1vor n VAL 58 N 0.00 -2.49 0.00 3.53 0.31 -1.26 -3.88 118.33 114.54 1vor n VAL 58 Ca 0.00 0.14 0.00 0.00 -0.01 0.00 0.00 64.34 64.47 1vor n VAL 58 Cb 0.00 -2.78 0.00 0.00 -0.91 0.00 0.00 33.84 30.15 1vor n VAL 58 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 1vor n PRO 59 N 0.08 1.67 0.00 5.55 -0.04 -1.25 -4.16 135.00 136.85 1vor n PRO 59 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1vor n PRO 59 Cb 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 1vor n PRO 59 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1vor n GLY 60 N 4.27 -0.09 2.02 0.55 0.00 -1.26 -4.14 105.19 106.54 1vor n GLY 60 Ca 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 45.99 1vor n GLY 60 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1vor n LYS 61 N -1.46 -2.27 -2.97 1.61 4.81 -1.26 -4.91 118.16 111.70 1vor n LYS 61 Ca 0.00 1.96 -0.22 0.00 -0.87 0.00 0.00 58.31 59.18 1vor n LYS 61 Cb 0.00 -2.98 -0.03 0.00 0.02 0.00 0.00 35.03 32.04 1vor n LYS 61 CO 0.00 0.00 0.00 0.54 1.17 0.00 0.00 177.40 179.11 1vor n ARG 62 N 0.84 2.27 -2.43 1.64 3.00 -1.26 -4.81 116.66 115.91 1vor n ARG 62 Ca -0.21 -4.17 -0.37 0.00 -0.01 0.00 0.00 57.85 53.09 1vor n ARG 62 Cb 0.32 -1.97 -0.03 0.00 0.00 0.00 0.00 32.46 30.77 1vor n ARG 62 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.63 177.84 1vor s LYS 63 N -3.07 3.33 -0.11 5.56 2.36 -1.24 -2.76 119.74 123.80 1vor s LYS 63 Ca 0.44 -0.94 -0.12 0.00 -2.55 0.00 0.00 55.97 52.80 1vor s LYS 63 Cb 0.33 -5.29 -0.05 0.00 -1.05 0.00 0.00 37.83 31.77 1vor s LYS 63 CO -0.11 -2.53 -0.25 0.54 1.55 0.00 0.00 175.35 174.55 1vor n ARG 64 N 8.86 0.39 -1.04 4.03 1.74 -1.26 -5.03 116.66 124.35 1vor n ARG 64 Ca 0.35 0.16 -0.33 0.00 -0.77 0.00 0.00 57.85 57.26 1vor n ARG 64 Cb 0.50 -1.17 0.13 0.00 -1.02 0.00 0.00 32.46 30.90 1vor n ARG 64 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1vor s VAL 65 N -2.61 2.02 0.27 1.55 1.01 -1.26 -4.88 120.40 116.51 1vor s VAL 65 Ca -0.22 0.01 0.00 0.00 0.00 0.00 0.00 61.98 61.78 1vor s VAL 65 Cb 0.04 -2.35 0.26 0.00 0.00 0.00 0.00 36.38 34.33 1vor s VAL 65 CO 0.31 -0.01 1.81 1.23 0.00 0.00 0.00 175.10 178.44 1vor h GLY 66 N -1.07 1.55 0.00 4.51 0.00 -1.95 -3.31 103.07 102.79 1vor h GLY 66 Ca -0.46 -0.36 0.00 0.00 0.00 0.00 0.00 47.33 46.51 1vor h GLY 66 CO 0.45 0.08 0.00 0.54 0.00 0.00 0.00 176.54 177.61 1vor n ARG 67 N -4.72 0.00 0.00 4.80 1.74 -1.26 -4.99 116.66 112.23 1vor n ARG 67 Ca 0.18 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.26 1vor n ARG 67 Cb 0.39 -0.22 0.00 0.00 -1.02 0.00 0.00 32.46 31.61 1vor n ARG 67 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 1vor n PHE 68 N 0.00 0.00 -1.66 -1.55 3.72 -1.25 -5.05 117.46 111.67 1vor n PHE 68 Ca 0.00 0.00 -0.38 0.00 -0.05 0.00 0.00 57.45 57.02 1vor n PHE 68 Cb 0.00 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.51 1vor n PHE 68 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 1vor s ILE 69 N 0.00 3.08 0.00 4.37 -1.09 -1.26 -4.75 121.20 121.56 1vor s ILE 69 Ca 0.00 0.06 0.00 0.00 -2.23 0.00 0.00 60.65 58.48 1vor s ILE 69 Cb 0.00 -3.18 0.00 0.00 -1.58 0.00 0.00 42.46 37.70 1vor s ILE 69 CO 0.00 -0.17 0.00 0.61 -1.23 0.00 0.00 174.94 174.15 1vor n GLY 70 N 5.88 3.91 0.00 6.18 0.00 -1.26 -4.22 105.19 115.68 1vor n GLY 70 Ca 0.32 -0.43 0.00 0.00 0.00 0.00 0.00 46.02 45.92 1vor n GLY 70 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1vor n GLN 71 N -0.09 0.00 -0.01 1.61 -0.06 -1.11 -3.63 117.38 114.08 1vor n GLN 71 Ca 0.00 0.00 -0.00 0.00 -2.00 0.00 0.00 57.00 55.00 1vor n GLN 71 Cb 0.00 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.18 1vor n GLN 71 CO 0.00 0.00 0.00 0.54 -0.20 0.00 0.00 177.06 177.40 1vor n ARG 72 N 0.00 0.00 0.00 3.69 5.12 -1.26 -4.14 116.66 120.07 1vor n ARG 72 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 1vor n ARG 72 Cb 0.00 -0.01 0.00 0.00 -1.16 0.00 0.00 32.46 31.29 1vor n ARG 72 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 1vor n ASN 73 N 0.03 0.00 0.00 0.55 4.05 -1.26 -4.80 115.26 113.82 1vor n ASN 73 Ca -0.00 -0.19 0.00 0.00 0.45 0.00 0.00 54.58 54.84 1vor n ASN 73 Cb 0.00 0.00 0.00 0.00 1.23 0.00 0.00 39.78 41.01 1vor n ASN 73 CO 0.00 0.00 0.00 0.47 -3.05 0.00 0.00 177.26 174.68 1vor n ASP 74 N 0.00 0.00 -1.05 1.20 10.43 -1.26 -4.88 116.55 120.99 1vor n ASP 74 Ca 0.00 0.00 0.12 0.00 2.57 0.00 0.00 54.79 57.48 1vor n ASP 74 Cb 0.05 0.00 -0.07 0.00 1.84 0.00 0.00 41.12 42.94 1vor n ASP 74 CO 0.00 0.00 0.00 0.54 -1.07 0.00 0.00 177.20 176.67 1vor n ARG 75 N 0.00 -2.45 0.00 -1.24 3.00 -1.26 -3.84 116.66 110.87 1vor n ARG 75 Ca 0.00 2.01 0.00 0.00 -0.01 0.00 0.00 57.85 59.85 1vor n ARG 75 Cb 0.00 -2.85 0.00 0.00 0.00 0.00 0.00 32.46 29.61 1vor n ARG 75 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.63 179.26 1vor n LYS 76 N -3.66 2.04 0.00 5.56 4.76 -1.25 -4.19 118.16 121.41 1vor n LYS 76 Ca -0.07 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.37 1vor n LYS 76 Cb 0.50 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.69 1vor n LYS 76 CO 0.00 0.00 0.00 0.36 -1.37 0.00 0.00 177.40 176.39 1vor n LYS 77 N 0.00 0.00 -3.50 1.97 2.85 -1.26 -4.65 118.16 113.57 1vor n LYS 77 Ca 0.00 0.00 -0.29 0.00 -1.05 0.00 0.00 58.31 56.97 1vor n LYS 77 Cb 0.00 0.00 -0.13 0.00 -0.65 0.00 0.00 35.03 34.25 1vor n LYS 77 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1vor s ALA 78 N -2.00 0.77 0.19 0.58 0.00 0.76 -2.19 121.76 119.87 1vor s ALA 78 Ca 0.00 -1.48 -0.13 0.00 0.00 0.00 0.00 51.96 50.35 1vor s ALA 78 Cb 0.00 -1.50 0.22 0.00 0.00 0.00 0.00 23.12 21.84 1vor s ALA 78 CO 0.00 -1.89 1.69 0.82 0.00 0.00 0.00 175.76 176.38 1vor h ILE 79 N 5.69 0.62 0.00 0.00 1.08 -1.79 -2.55 117.51 120.57 1vor h ILE 79 Ca -0.07 -0.05 0.00 0.00 -0.39 0.00 0.00 64.86 64.35 1vor h ILE 79 Cb 0.99 0.45 0.00 0.00 -3.07 0.00 0.00 36.82 35.19 1vor h ILE 79 CO 0.35 0.03 0.00 0.52 -0.69 0.00 0.00 178.15 178.36 1vor n VAL 80 N -5.20 0.00 0.15 1.67 0.31 -1.26 -2.78 118.33 111.22 1vor n VAL 80 Ca 0.06 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.39 1vor n VAL 80 Cb 0.28 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.21 1vor n VAL 80 CO 0.00 0.00 0.00 -1.14 -1.32 0.00 0.00 176.83 174.37 1vor n ARG 81 N 7.32 0.00 -2.31 5.55 3.00 -1.18 -4.58 116.66 124.45 1vor n ARG 81 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 1vor n ARG 81 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.46 1vor n ARG 81 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.63 177.52 1vor n LEU 82 N -3.22 -6.43 0.00 6.15 0.00 -1.23 -1.80 117.00 110.48 1vor n LEU 82 Ca 0.00 2.95 0.00 0.00 0.00 0.00 0.00 56.01 58.96 1vor n LEU 82 Cb 0.00 -3.23 0.00 0.00 0.00 0.00 0.00 43.42 40.19 1vor n LEU 82 CO 0.00 -2.70 0.00 0.00 0.00 0.00 0.00 177.39 174.69 1vor n ALA 83 N 1.89 0.00 -2.02 1.96 0.00 -1.26 -4.35 120.51 116.73 1vor n ALA 83 Ca 0.00 0.00 -0.42 0.00 0.00 0.00 0.00 53.44 53.02 1vor n ALA 83 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 1vor n ALA 83 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1vor s GLU 84 N -0.92 4.07 0.00 0.00 2.12 -1.26 -4.08 118.70 118.63 1vor s GLU 84 Ca 0.00 2.07 0.00 0.00 0.36 0.00 0.00 54.97 57.40 1vor s GLU 84 Cb 0.00 -4.01 0.00 0.00 0.26 0.00 0.00 34.13 30.38 1vor s GLU 84 CO 0.00 -0.98 0.00 0.41 -0.54 0.00 0.00 175.26 174.15 1vor n GLY 85 N 4.29 0.04 2.76 -1.50 0.00 -1.26 -5.09 105.19 104.43 1vor n GLY 85 Ca 0.18 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.04 1vor n GLY 85 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1vor s GLN 86 N 0.00 0.72 -0.01 1.61 1.11 -1.26 -5.06 119.66 116.78 1vor s GLN 86 Ca 0.00 -0.98 -0.00 0.00 0.01 0.00 0.00 55.36 54.39 1vor s GLN 86 Cb 0.00 -0.68 -0.00 0.00 -1.01 0.00 0.00 33.01 31.32 1vor s GLN 86 CO 0.00 -1.23 0.02 1.03 0.01 0.00 0.00 175.29 175.12 1vor h SER 87 N 6.71 -0.00 0.00 5.90 0.87 -1.91 -3.46 113.55 121.66 1vor h SER 87 Ca 0.08 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.64 1vor h SER 87 Cb 1.05 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 63.01 1vor h SER 87 CO 0.19 0.03 0.00 0.00 -0.53 0.00 0.00 176.83 176.52 1vor n ILE 88 N -2.18 0.00 -3.64 2.23 3.06 -1.26 -4.92 119.36 112.66 1vor n ILE 88 Ca -0.00 0.00 -0.27 0.00 -2.50 0.00 0.00 62.75 59.98 1vor n ILE 88 Cb 0.00 0.00 -0.02 0.00 0.54 0.00 0.00 39.64 40.16 1vor n ILE 88 CO 0.00 0.00 0.00 1.21 -2.50 0.00 0.00 176.55 175.26 1vor n GLU 89 N -3.03 -2.92 -1.59 9.51 2.13 -1.26 -4.45 120.64 119.03 1vor n GLU 89 Ca 0.00 0.35 0.00 0.00 0.66 0.00 0.00 57.16 58.17 1vor n GLU 89 Cb 0.00 -5.03 0.00 0.00 0.27 0.00 0.00 31.44 26.68 1vor n GLU 89 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1vor n ALA 90 N -3.68 -1.94 -1.60 4.31 0.00 -1.26 -5.10 120.51 111.24 1vor n ALA 90 Ca 0.03 0.47 0.00 0.00 0.00 0.00 0.00 53.44 53.94 1vor n ALA 90 Cb 0.51 -1.44 0.00 0.00 0.00 0.00 0.00 19.45 18.52 1vor n ALA 90 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1vor n LEU 91 N -1.72 0.00 -2.78 0.00 -0.00 -1.26 -5.08 117.00 106.15 1vor n LEU 91 Ca 0.00 0.00 -0.06 0.00 -0.00 0.00 0.00 56.01 55.95 1vor n LEU 91 Cb 0.23 0.00 0.02 0.00 -0.00 0.00 0.00 43.42 43.67 1vor n LEU 91 CO 0.00 0.00 0.12 0.00 -0.00 0.00 0.00 177.39 177.51 1vor n ALA 92 N -3.00 -1.60 0.00 1.96 0.00 -1.26 -5.04 120.51 111.56 1vor n ALA 92 Ca 0.00 -1.20 0.00 0.00 0.00 0.00 0.00 53.44 52.24 1vor n ALA 92 Cb 0.00 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.02 1vor n ALA 92 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1vor n GLY 93 N 2.59 -1.44 3.89 0.00 0.00 -1.26 -5.17 105.19 103.80 1vor n GLY 93 Ca 0.16 0.94 0.00 0.00 0.00 0.00 0.00 46.02 47.12 1vor n GLY 93 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14