#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yju n GLY 2 N 0.00 1.24 3.17 3.17 0.00 -1.26 -4.76 105.19 106.75 1yju n GLY 2 Ca 0.00 -0.02 -0.30 0.00 0.00 0.00 0.00 46.02 45.70 1yju n GLY 2 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1yju n ASP 3 N 3.05 -4.15 0.00 1.61 8.00 -1.26 -4.82 116.55 118.98 1yju n ASP 3 Ca 0.00 -0.85 0.00 0.00 0.71 0.00 0.00 54.79 54.65 1yju n ASP 3 Cb 0.00 -0.98 0.00 0.00 -0.02 0.00 0.00 41.12 40.12 1yju n ASP 3 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1yju n GLY 4 N -5.53 3.94 3.69 0.44 0.00 -1.15 -4.98 105.19 101.60 1yju n GLY 4 Ca 0.13 -0.60 -0.31 0.00 0.00 0.00 0.00 46.02 45.24 1yju n GLY 4 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1yju s VAL 5 N 0.00 4.11 -0.26 1.61 -7.23 -1.26 -0.33 120.40 117.04 1yju s VAL 5 Ca 0.00 -0.80 -0.02 0.00 -1.81 0.00 0.00 61.98 59.35 1yju s VAL 5 Cb 0.00 -2.90 0.11 0.00 0.56 0.00 0.00 36.38 34.16 1yju s VAL 5 CO 0.00 0.24 0.24 -0.22 -0.31 0.00 0.00 175.10 175.05 1yju s LEU 6 N -1.96 -0.07 -0.30 1.32 0.20 0.88 -4.79 118.68 113.95 1yju s LEU 6 Ca 0.23 -0.64 -0.14 0.00 0.69 0.00 0.00 54.13 54.27 1yju s LEU 6 Cb -0.12 0.33 -0.03 0.00 -0.43 0.00 0.00 46.19 45.94 1yju s LEU 6 CO 0.15 -0.37 0.34 -0.70 -0.29 0.00 0.00 176.35 175.48 1yju s GLU 7 N 2.31 3.80 0.01 1.98 2.56 -1.26 -0.61 118.70 127.48 1yju s GLU 7 Ca 0.08 -0.22 0.04 0.00 0.00 0.00 0.00 54.97 54.87 1yju s GLU 7 Cb -0.15 -3.73 -0.01 0.00 2.00 0.00 0.00 34.13 32.24 1yju s GLU 7 CO -0.26 -0.38 -0.13 -0.48 -0.56 0.00 0.00 175.26 173.46 1yju s LEU 8 N 2.01 2.08 0.13 2.70 0.05 -0.34 -0.33 118.68 124.96 1yju s LEU 8 Ca 0.12 -0.31 -0.30 0.00 0.05 0.00 0.00 54.13 53.70 1yju s LEU 8 Cb -0.16 -0.61 -0.06 0.00 -2.05 0.00 0.00 46.19 43.31 1yju s LEU 8 CO 0.11 0.10 1.00 -0.69 -0.55 0.00 0.00 176.35 176.33 1yju s VAL 9 N -0.50 4.32 -0.22 1.48 1.01 0.49 -0.35 120.40 126.63 1yju s VAL 9 Ca 0.03 1.94 -0.04 0.00 0.00 0.00 0.00 61.98 63.91 1yju s VAL 9 Cb -0.06 -4.24 -0.01 0.00 0.00 0.00 0.00 36.38 32.07 1yju s VAL 9 CO 0.00 0.30 -0.04 -0.69 0.00 0.00 0.00 175.10 174.68 1yju s VAL 10 N -0.04 3.42 -1.39 2.92 1.01 0.32 -0.41 120.40 126.23 1yju s VAL 10 Ca 0.48 -0.48 -0.08 0.00 0.00 0.00 0.00 61.98 61.90 1yju s VAL 10 Cb -0.25 -2.57 0.08 0.00 0.00 0.00 0.00 36.38 33.64 1yju s VAL 10 CO 0.31 0.41 2.40 0.54 0.00 0.00 0.00 175.10 178.76 1yju n ARG 11 N 4.80 4.08 0.00 2.72 1.74 0.14 -4.57 116.66 125.58 1yju n ARG 11 Ca -0.18 -3.14 0.00 0.00 -0.77 0.00 0.00 57.85 53.76 1yju n ARG 11 Cb 0.51 -2.77 0.00 0.00 -1.02 0.00 0.00 32.46 29.17 1yju n ARG 11 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1yju n GLY 12 N 2.51 -1.26 3.24 -0.13 0.00 -1.26 -4.65 105.19 103.63 1yju n GLY 12 Ca 0.61 0.67 -0.10 0.00 0.00 0.00 0.00 46.02 47.20 1yju n GLY 12 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1yju n MET 13 N 0.00 -1.64 0.26 1.61 2.81 -1.26 -4.91 117.12 113.99 1yju n MET 13 Ca 0.00 1.13 0.14 0.00 -1.81 0.00 0.00 57.70 57.15 1yju n MET 13 Cb 0.00 -5.39 0.72 0.00 -0.71 0.00 0.00 33.22 27.84 1yju n MET 13 CO 0.00 0.00 0.00 1.79 1.51 0.00 0.00 175.97 179.27 1yju h THR 14 N -0.36 0.46 -2.03 2.03 1.35 -1.98 -3.44 112.91 108.94 1yju h THR 14 Ca -0.32 -0.57 0.08 0.00 -0.55 0.00 0.00 66.41 65.04 1yju h THR 14 Cb 1.17 1.39 -0.18 0.00 -1.73 0.00 0.00 68.15 68.80 1yju h THR 14 CO 0.37 0.11 0.47 0.00 -0.25 0.00 0.00 175.52 176.22 1yju n ALA 16 N 0.21 0.76 -0.61 0.00 0.00 -1.26 -0.80 120.51 118.81 1yju n ALA 16 Ca -0.11 0.74 0.00 0.00 0.00 0.00 0.00 53.44 54.08 1yju n ALA 16 Cb 0.60 -0.75 0.00 0.00 0.00 0.00 0.00 19.45 19.30 1yju n ALA 16 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1yju n SER 17 N -4.64 0.00 -0.33 0.00 3.41 -1.26 -0.39 113.62 110.41 1yju n SER 17 Ca 0.28 0.70 0.18 0.00 -0.26 0.00 0.00 58.87 59.77 1yju n SER 17 Cb 0.95 -0.20 0.39 0.00 -0.26 0.00 0.00 64.21 65.09 1yju n SER 17 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1yju n VAL 19 N -5.00 0.00 0.33 0.00 0.31 0.02 -3.38 118.33 110.60 1yju n VAL 19 Ca 0.27 1.33 0.12 0.00 -0.01 0.00 0.00 64.34 66.05 1yju n VAL 19 Cb 0.79 -2.13 0.53 0.00 -0.91 0.00 0.00 33.84 32.12 1yju n VAL 19 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1yju n HIS 20 N -1.84 0.82 -0.29 3.52 1.44 0.48 -1.51 115.22 117.83 1yju n HIS 20 Ca 0.00 0.35 -0.04 0.00 -2.01 0.00 0.00 57.72 56.02 1yju n HIS 20 Cb 0.00 -1.06 0.07 0.00 0.12 0.00 0.00 29.99 29.12 1yju n HIS 20 CO 0.00 0.00 0.00 -0.22 -2.81 0.00 0.00 176.34 173.31 1yju h LYS 21 N 0.00 1.04 0.41 -1.40 3.64 -0.78 -0.81 116.57 118.68 1yju h LYS 21 Ca 0.00 -0.06 -0.02 0.00 -1.27 0.00 0.00 60.65 59.30 1yju h LYS 21 Cb 0.27 -0.23 0.00 0.00 -0.41 0.00 0.00 32.23 31.86 1yju h LYS 21 CO 0.00 0.69 -0.20 0.82 -2.27 0.00 0.00 179.45 178.50 1yju h ILE 22 N 1.07 0.00 -0.10 2.00 2.04 -1.33 0.24 117.51 121.43 1yju h ILE 22 Ca 0.29 -0.06 0.02 0.00 1.00 0.00 0.00 64.86 66.11 1yju h ILE 22 Cb -0.12 0.00 -0.03 0.00 -0.74 0.00 0.00 36.82 35.93 1yju h ILE 22 CO -0.06 0.00 -0.21 1.05 0.00 0.00 0.00 178.15 178.93 1yju h GLU 23 N -0.60 -0.18 -0.80 2.37 -0.00 -1.67 0.10 114.58 113.80 1yju h GLU 23 Ca -0.06 0.01 0.19 0.00 -0.00 0.00 0.00 59.36 59.51 1yju h GLU 23 Cb 0.42 0.04 -0.12 0.00 -0.00 0.00 0.00 28.75 29.09 1yju h GLU 23 CO 0.09 -0.12 0.20 1.03 -0.00 0.00 0.00 179.01 180.21 1yju h SER 24 N -0.19 -0.00 0.72 3.06 0.87 -1.22 0.92 113.55 117.71 1yju h SER 24 Ca 0.02 0.17 -0.04 0.00 -1.23 0.00 0.00 61.79 60.71 1yju h SER 24 Cb 0.25 0.23 0.01 0.00 -0.44 0.00 0.00 62.40 62.44 1yju h SER 24 CO -0.20 -0.09 -0.35 -1.28 -0.53 0.00 0.00 176.83 174.39 1yju h SER 25 N 0.24 -0.82 -0.19 6.23 0.87 -0.51 -3.23 113.55 116.15 1yju h SER 25 Ca 0.47 0.03 0.01 0.00 -1.23 0.00 0.00 61.79 61.07 1yju h SER 25 Cb 0.87 0.21 -0.01 0.00 -0.44 0.00 0.00 62.40 63.04 1yju h SER 25 CO -0.58 -0.57 0.12 -0.07 -0.53 0.00 0.00 176.83 175.21 1yju h LEU 26 N -1.01 0.17 -2.05 2.23 3.38 0.12 0.40 115.31 118.56 1yju h LEU 26 Ca -0.10 -0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.87 1yju h LEU 26 Cb 0.74 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 41.45 1yju h LEU 26 CO 0.16 0.12 0.28 0.74 0.09 0.00 0.00 178.44 179.83 1yju h THR 27 N 0.20 0.00 -0.83 0.22 2.02 -0.87 0.14 112.91 113.79 1yju h THR 27 Ca 0.07 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.29 1yju h THR 27 Cb 0.05 0.68 -0.05 0.00 -1.74 0.00 0.00 68.15 67.09 1yju h THR 27 CO -0.01 0.00 0.55 0.07 0.37 0.00 0.00 175.52 176.49 1yju h LYS 28 N 0.00 0.99 -7.29 6.66 5.09 -1.00 -3.44 116.57 117.58 1yju h LYS 28 Ca 0.00 -0.06 -0.48 0.00 0.09 0.00 0.00 60.65 60.20 1yju h LYS 28 Cb 0.56 -0.22 0.17 0.00 0.10 0.00 0.00 32.23 32.83 1yju h LYS 28 CO 0.00 0.66 0.20 -1.01 -2.09 0.00 0.00 179.45 177.21 1yju s HIS 29 N -5.87 2.04 -0.30 0.07 0.09 0.47 -4.99 115.29 106.79 1yju s HIS 29 Ca -0.11 1.32 0.12 0.00 -0.00 0.00 0.00 55.06 56.39 1yju s HIS 29 Cb 0.19 -3.18 0.47 0.00 -0.00 0.00 0.00 32.58 30.06 1yju s HIS 29 CO 0.79 -2.72 1.14 0.54 -0.00 0.00 0.00 174.74 174.49 1yju n ARG 30 N -4.12 2.90 -0.40 1.40 5.12 -1.26 -4.56 116.66 115.74 1yju n ARG 30 Ca 0.07 -3.97 0.00 0.00 -1.93 0.00 0.00 57.85 52.02 1yju n ARG 30 Cb 0.55 -2.02 0.01 0.00 -1.16 0.00 0.00 32.46 29.84 1yju n ARG 30 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1yju n GLY 31 N -0.60 0.21 3.50 -0.13 0.00 -1.26 -5.03 105.19 101.88 1yju n GLY 31 Ca 0.31 -0.06 -0.30 0.00 0.00 0.00 0.00 46.02 45.97 1yju n GLY 31 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1yju s ILE 32 N -0.15 2.92 -0.09 -0.61 -5.25 -1.26 -1.38 121.20 115.37 1yju s ILE 32 Ca 0.02 -1.40 0.03 0.00 -0.99 0.00 0.00 60.65 58.30 1yju s ILE 32 Cb 0.01 -2.32 -0.07 0.00 2.95 0.00 0.00 42.46 43.03 1yju s ILE 32 CO 0.00 0.15 -0.06 0.18 -1.79 0.00 0.00 174.94 173.43 1yju n LEU 33 N 0.94 2.13 -3.60 0.37 4.77 0.62 -4.90 117.00 117.34 1yju n LEU 33 Ca -0.15 -0.04 -0.10 0.00 -0.03 0.00 0.00 56.01 55.68 1yju n LEU 33 Cb 0.52 -0.19 -0.03 0.00 -2.33 0.00 0.00 43.42 41.39 1yju n LEU 33 CO 0.29 0.53 0.33 -0.47 -1.33 0.00 0.00 177.39 176.74 1yju s TYR 34 N -2.20 -0.32 -0.42 -1.77 5.04 -1.15 -4.93 117.35 111.60 1yju s TYR 34 Ca -0.11 0.03 0.06 0.00 -2.44 0.00 0.00 57.07 54.62 1yju s TYR 34 Cb 0.03 0.47 0.22 0.00 0.35 0.00 0.00 41.96 43.04 1yju s TYR 34 CO 0.26 -0.88 0.51 0.00 -1.34 0.00 0.00 175.55 174.10 1yju s SER 36 N -0.70 6.69 -0.56 0.00 0.01 0.59 -4.69 113.70 115.04 1yju s SER 36 Ca 0.34 -2.08 -0.21 0.00 1.31 0.00 0.00 55.95 55.31 1yju s SER 36 Cb 0.12 -2.58 0.07 0.00 0.21 0.00 0.00 66.02 63.84 1yju s SER 36 CO -0.15 -1.32 0.78 0.54 0.41 0.00 0.00 173.24 173.50 1yju s VAL 37 N 4.59 4.65 -0.47 3.43 0.11 -1.26 -0.55 120.40 130.91 1yju s VAL 37 Ca 0.51 -0.40 -0.09 0.00 -2.93 0.00 0.00 61.98 59.08 1yju s VAL 37 Cb 0.02 -4.46 0.12 0.00 -1.53 0.00 0.00 36.38 30.53 1yju s VAL 37 CO 0.02 -1.06 0.35 0.00 -3.33 0.00 0.00 175.10 171.07 1yju s ALA 38 N 3.21 3.39 0.38 1.54 0.00 0.56 -4.93 121.76 125.90 1yju s ALA 38 Ca 0.19 -2.53 0.19 0.00 0.00 0.00 0.00 51.96 49.81 1yju s ALA 38 Cb -0.18 -2.83 1.17 0.00 0.00 0.00 0.00 23.12 21.28 1yju s ALA 38 CO 0.12 -1.90 1.68 1.25 0.00 0.00 0.00 175.76 176.91 1yju h LEU 39 N 8.46 0.44 -1.82 0.00 6.46 -1.93 -0.07 115.31 126.84 1yju h LEU 39 Ca -0.21 0.15 0.20 0.00 -0.12 0.00 0.00 57.88 57.90 1yju h LEU 39 Cb 1.07 0.10 -0.04 0.00 -0.73 0.00 0.00 40.66 41.06 1yju h LEU 39 CO 0.86 -0.09 0.55 0.00 -0.62 0.00 0.00 178.44 179.14 1yju h ALA 40 N 1.73 2.49 0.00 1.25 0.00 -1.94 0.84 119.26 123.64 1yju h ALA 40 Ca 0.72 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.62 1yju h ALA 40 Cb 1.85 0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.66 1yju h ALA 40 CO -0.49 -0.72 -0.03 -2.37 0.00 0.00 0.00 179.25 175.64 1yju n THR 41 N -4.39 1.36 -4.47 0.00 5.66 -0.20 -5.01 114.28 107.24 1yju n THR 41 Ca 0.16 -1.56 -0.39 0.00 -3.05 0.00 0.00 64.05 59.21 1yju n THR 41 Cb 0.74 0.13 -0.09 0.00 -1.55 0.00 0.00 70.33 69.57 1yju n THR 41 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 175.07 172.61 1yju n ASN 42 N -0.94 -0.87 -3.90 1.09 4.13 0.29 -4.90 115.26 110.16 1yju n ASN 42 Ca 0.09 -1.26 -0.11 0.00 1.68 0.00 0.00 54.58 54.98 1yju n ASN 42 Cb 0.50 -1.61 -0.12 0.00 -1.54 0.00 0.00 39.78 37.01 1yju n ASN 42 CO 0.00 0.00 0.00 -0.75 0.28 0.00 0.00 177.26 176.79 1yju s LYS 43 N -7.29 0.18 -0.44 3.52 2.36 -0.97 -0.52 119.74 116.58 1yju s LYS 43 Ca 0.54 -0.21 -0.16 0.00 -2.55 0.00 0.00 55.97 53.59 1yju s LYS 43 Cb -0.32 0.07 0.04 0.00 -1.05 0.00 0.00 37.83 36.57 1yju s LYS 43 CO 1.02 -0.03 0.39 0.00 1.55 0.00 0.00 175.35 178.28 1yju s ALA 44 N -0.61 3.48 -1.19 3.13 0.00 0.52 -0.32 121.76 126.77 1yju s ALA 44 Ca -0.07 -1.79 -0.19 0.00 0.00 0.00 0.00 51.96 49.91 1yju s ALA 44 Cb -0.04 -3.03 0.08 0.00 0.00 0.00 0.00 23.12 20.13 1yju s ALA 44 CO -0.00 -1.63 1.58 -1.58 0.00 0.00 0.00 175.76 174.14 1yju s HIS 45 N 1.87 2.82 0.44 0.00 2.46 0.29 -1.20 115.29 121.96 1yju s HIS 45 Ca 0.07 -1.46 -0.15 0.00 0.47 0.00 0.00 55.06 54.00 1yju s HIS 45 Cb -0.20 -4.66 -0.08 0.00 -0.13 0.00 0.00 32.58 27.51 1yju s HIS 45 CO 0.10 -1.78 0.87 0.42 -2.47 0.00 0.00 174.74 171.88 1yju s ILE 46 N 4.02 4.63 0.01 0.89 1.01 0.22 -0.30 121.20 131.67 1yju s ILE 46 Ca 0.49 1.00 0.08 0.00 0.00 0.00 0.00 60.65 62.22 1yju s ILE 46 Cb 0.01 -3.69 -0.02 0.00 0.01 0.00 0.00 42.46 38.77 1yju s ILE 46 CO 0.01 -0.50 -0.24 -0.54 0.00 0.00 0.00 174.94 173.67 1yju s LYS 47 N -3.71 1.80 0.16 2.79 1.02 0.35 -0.08 119.74 122.07 1yju s LYS 47 Ca 0.56 -0.93 -0.24 0.00 0.02 0.00 0.00 55.97 55.37 1yju s LYS 47 Cb -0.10 -1.83 0.06 0.00 -0.52 0.00 0.00 37.83 35.44 1yju s LYS 47 CO 0.27 0.49 0.78 1.52 -0.92 0.00 0.00 175.35 177.49 1yju s TYR 48 N -0.66 -0.29 -0.37 3.18 1.13 0.56 -0.27 117.35 120.61 1yju s TYR 48 Ca 0.10 -0.00 0.03 0.00 -1.41 0.00 0.00 57.07 55.79 1yju s TYR 48 Cb -0.09 0.62 0.11 0.00 -1.10 0.00 0.00 41.96 41.50 1yju s TYR 48 CO 0.00 -0.90 0.11 -0.51 -2.51 0.00 0.00 175.55 171.74 1yju s ASP 49 N -2.80 4.48 0.62 -0.18 1.11 -0.48 -2.92 116.67 116.51 1yju s ASP 49 Ca 0.08 -2.26 0.39 0.00 0.18 0.00 0.00 52.55 50.94 1yju s ASP 49 Cb -0.03 -1.46 2.05 0.00 1.07 0.00 0.00 42.92 44.55 1yju s ASP 49 CO -0.02 -0.35 2.25 1.55 1.18 0.00 0.00 175.17 179.77 1yju h PRO 50 N 7.43 0.00 -0.96 8.23 0.13 -1.87 0.63 132.00 145.59 1yju h PRO 50 Ca -0.06 0.00 0.27 0.00 -0.87 0.00 0.00 66.00 65.34 1yju h PRO 50 Cb 0.99 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.07 1yju h PRO 50 CO 0.54 0.01 0.68 1.05 -0.23 0.00 0.00 178.00 180.05 1yju h GLU 51 N 0.00 0.08 0.00 0.86 9.09 -1.94 -3.35 114.58 119.31 1yju h GLU 51 Ca -0.00 -0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.40 1yju h GLU 51 Cb 0.15 -0.02 0.00 0.00 -1.65 0.00 0.00 28.75 27.23 1yju h GLU 51 CO 0.00 0.05 -0.09 1.51 0.05 0.00 0.00 179.01 180.53 1yju n ILE 52 N -4.31 0.41 -3.51 -1.06 0.00 -0.18 -5.04 119.36 105.67 1yju n ILE 52 Ca 0.20 0.21 -0.40 0.00 0.00 0.00 0.00 62.75 62.76 1yju n ILE 52 Cb 0.97 -1.36 -0.10 0.00 0.00 0.00 0.00 39.64 39.15 1yju n ILE 52 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 176.55 176.04 1yju s ILE 53 N -1.40 5.26 0.58 9.51 2.07 0.04 -5.06 121.20 132.19 1yju s ILE 53 Ca -0.03 -0.09 -0.08 0.00 -1.41 0.00 0.00 60.65 59.04 1yju s ILE 53 Cb 0.00 -3.72 -0.02 0.00 0.13 0.00 0.00 42.46 38.86 1yju s ILE 53 CO 0.04 0.01 0.92 -0.83 -1.91 0.00 0.00 174.94 173.17 1yju s GLY 54 N 1.73 1.59 0.34 1.50 0.00 -1.26 -3.57 107.32 107.64 1yju s GLY 54 Ca 0.08 -0.43 0.07 0.00 0.00 0.00 0.00 44.72 44.44 1yju s GLY 54 CO 0.11 -0.18 1.86 -0.56 0.00 0.00 0.00 173.10 174.33 1yju h PRO 55 N -0.14 0.74 -0.80 2.90 0.13 -1.97 -0.18 132.00 132.68 1yju h PRO 55 Ca -0.45 -0.04 0.13 0.00 -0.87 0.00 0.00 66.00 64.76 1yju h PRO 55 Cb 1.22 -0.17 -0.13 0.00 0.13 0.00 0.00 31.00 32.05 1yju h PRO 55 CO 0.62 0.49 -0.29 2.89 -0.23 0.00 0.00 178.00 181.47 1yju n ARG 56 N -4.58 -0.17 0.02 0.86 1.85 -1.26 -0.43 116.66 112.95 1yju n ARG 56 Ca 0.18 1.23 -0.12 0.00 -1.00 0.00 0.00 57.85 58.14 1yju n ARG 56 Cb 0.45 -1.83 -0.09 0.00 -1.05 0.00 0.00 32.46 29.94 1yju n ARG 56 CO 0.00 0.00 0.00 -0.44 -0.01 0.00 0.00 177.63 177.18 1yju h ASP 57 N 0.00 -0.10 -0.00 2.89 3.32 -1.39 -0.64 116.42 120.50 1yju h ASP 57 Ca 0.30 -0.46 0.02 0.00 0.02 0.00 0.00 57.03 56.91 1yju h ASP 57 Cb 0.50 0.03 -0.03 0.00 0.22 0.00 0.00 39.33 40.04 1yju h ASP 57 CO -0.80 0.45 -0.16 0.40 -1.72 0.00 0.00 179.24 177.41 1yju h ILE 58 N -0.69 0.61 0.12 0.35 2.04 -1.47 0.20 117.51 118.67 1yju h ILE 58 Ca -0.01 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.87 1yju h ILE 58 Cb 0.55 0.61 -0.04 0.00 -0.74 0.00 0.00 36.82 37.20 1yju h ILE 58 CO 0.02 0.00 -0.37 0.40 0.00 0.00 0.00 178.15 178.20 1yju h ILE 59 N -0.26 0.23 -0.88 -0.67 2.04 -0.68 0.23 117.51 117.52 1yju h ILE 59 Ca 0.05 0.00 0.08 0.00 1.00 0.00 0.00 64.86 65.99 1yju h ILE 59 Cb 0.33 0.23 -0.06 0.00 -0.74 0.00 0.00 36.82 36.58 1yju h ILE 59 CO -0.15 0.00 0.57 0.45 0.00 0.00 0.00 178.15 179.01 1yju h HIS 60 N -0.60 0.97 -0.21 1.37 3.86 -0.86 0.42 115.15 120.10 1yju h HIS 60 Ca 0.03 0.03 -0.02 0.00 -1.16 0.00 0.00 60.37 59.24 1yju h HIS 60 Cb 0.63 -0.32 -0.01 0.00 1.06 0.00 0.00 27.41 28.78 1yju h HIS 60 CO -0.33 0.49 0.04 1.15 0.86 0.00 0.00 177.93 180.14 1yju h THR 61 N 0.94 1.22 -0.30 2.45 2.02 0.58 0.14 112.91 119.96 1yju h THR 61 Ca 0.39 -0.73 -0.01 0.00 0.77 0.00 0.00 66.41 66.82 1yju h THR 61 Cb 0.28 1.30 -0.01 0.00 -1.74 0.00 0.00 68.15 67.97 1yju h THR 61 CO -0.15 0.23 0.13 0.40 0.37 0.00 0.00 175.52 176.50 1yju h ILE 62 N 0.15 1.17 0.20 3.11 2.04 0.29 0.17 117.51 124.64 1yju h ILE 62 Ca 0.07 -0.49 0.01 0.00 1.00 0.00 0.00 64.86 65.45 1yju h ILE 62 Cb 0.31 0.94 -0.03 0.00 -0.74 0.00 0.00 36.82 37.30 1yju h ILE 62 CO 0.00 0.17 -0.32 -0.33 0.00 0.00 0.00 178.15 177.68 1yju h GLU 63 N 0.34 -0.57 -0.61 2.37 5.08 -0.68 0.12 114.58 120.63 1yju h GLU 63 Ca 0.10 0.04 0.11 0.00 -1.00 0.00 0.00 59.36 58.61 1yju h GLU 63 Cb 0.15 0.13 -0.09 0.00 0.50 0.00 0.00 28.75 29.44 1yju h GLU 63 CO -0.01 -0.38 0.14 1.03 -1.00 0.00 0.00 179.01 178.79 1yju h SER 64 N -0.59 0.03 -0.28 1.42 0.87 -0.42 -2.04 113.55 112.54 1yju h SER 64 Ca 0.01 0.11 -0.05 0.00 -1.23 0.00 0.00 61.79 60.63 1yju h SER 64 Cb 0.58 0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 62.68 1yju h SER 64 CO -0.13 0.02 -0.03 -0.07 -0.53 0.00 0.00 176.83 176.09 1yju h LEU 65 N 0.28 0.50 0.00 2.23 3.38 -0.44 -3.46 115.31 117.80 1yju h LEU 65 Ca 0.32 -0.34 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1yju h LEU 65 Cb 0.48 -0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.09 1yju h LEU 65 CO -0.40 0.72 0.00 0.61 0.09 0.00 0.00 178.44 179.46 1yju n GLY 66 N -0.25 -0.37 3.06 0.83 0.00 0.21 -5.09 105.19 103.58 1yju n GLY 66 Ca -0.03 -0.01 -0.23 0.00 0.00 0.00 0.00 46.02 45.75 1yju n GLY 66 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1yju s PHE 67 N -1.65 1.34 0.56 1.61 0.08 0.04 -4.88 117.98 115.08 1yju s PHE 67 Ca 0.00 -0.38 -0.16 0.00 0.12 0.00 0.00 56.93 56.51 1yju s PHE 67 Cb 0.00 -0.93 -0.06 0.00 -0.57 0.00 0.00 43.02 41.46 1yju s PHE 67 CO 0.00 -0.15 1.02 -1.83 -0.10 0.00 0.00 175.22 174.16 1yju s GLU 68 N 0.20 3.64 0.15 0.44 -1.05 -1.26 -2.59 118.70 118.22 1yju s GLU 68 Ca -0.05 1.05 -0.06 0.00 -0.15 0.00 0.00 54.97 55.77 1yju s GLU 68 Cb -0.11 -2.09 -0.02 0.00 -0.44 0.00 0.00 34.13 31.47 1yju s GLU 68 CO 0.02 -0.53 0.18 0.00 0.95 0.00 0.00 175.26 175.88 1yju s ALA 69 N -2.59 0.36 -0.18 -0.84 0.00 -1.26 -0.69 121.76 116.57 1yju s ALA 69 Ca 0.61 -1.13 -0.02 0.00 0.00 0.00 0.00 51.96 51.42 1yju s ALA 69 Cb -0.13 0.85 0.05 0.00 0.00 0.00 0.00 23.12 23.89 1yju s ALA 69 CO 0.35 -0.57 0.00 -1.12 0.00 0.00 0.00 175.76 174.42 1yju s SER 70 N -3.00 2.86 -1.19 0.00 0.01 0.45 -4.96 113.70 107.87 1yju s SER 70 Ca 0.20 -0.75 -0.21 0.00 1.31 0.00 0.00 55.95 56.49 1yju s SER 70 Cb 0.05 -0.71 -0.05 0.00 0.21 0.00 0.00 66.02 65.53 1yju s SER 70 CO 0.00 -0.26 1.89 -0.11 0.41 0.00 0.00 173.24 175.17 1yju n LEU 71 N 4.98 3.85 -0.11 2.44 7.94 -1.26 -0.38 117.00 134.47 1yju n LEU 71 Ca -0.10 -3.40 -0.02 0.00 -1.11 0.00 0.00 56.01 51.38 1yju n LEU 71 Cb 0.47 -1.68 0.21 0.00 0.53 0.00 0.00 43.42 42.95 1yju n LEU 71 CO 0.14 -1.01 0.98 -0.37 -1.11 0.00 0.00 177.39 176.02 1yju h VAL 72 N 5.73 1.22 -6.57 1.96 -1.51 -1.87 -3.48 116.25 111.73 1yju h VAL 72 Ca 0.32 -0.80 -0.43 0.00 -1.23 0.00 0.00 66.70 64.56 1yju h VAL 72 Cb 0.88 0.70 -0.00 0.00 -2.13 0.00 0.00 31.29 30.74 1yju h VAL 72 CO 1.39 0.29 -0.93 1.17 -1.23 0.00 0.00 177.57 178.26 1yju n LYS 73 N -4.28 -1.18 -1.43 5.19 0.00 0.55 -4.86 118.16 112.15 1yju n LYS 73 Ca 0.04 0.54 -0.40 0.00 0.00 0.00 0.00 58.31 58.48 1yju n LYS 73 Cb 0.22 -1.87 0.02 0.00 0.00 0.00 0.00 35.03 33.40 1yju n LYS 73 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.40 177.84 1yju n ILE 74 N -2.60 1.69 0.00 3.15 -5.35 -1.26 -4.96 119.36 110.03 1yju n ILE 74 Ca -0.25 -0.50 0.00 0.00 -0.27 0.00 0.00 62.75 61.73 1yju n ILE 74 Cb 0.58 -0.51 0.00 0.00 -1.74 0.00 0.00 39.64 37.96 1yju n ILE 74 CO 0.00 0.00 0.00 1.21 -1.76 0.00 0.00 176.55 176.00