#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1stu h ILE 2 N 0.00 0.00 -0.48 4.25 1.08 -1.92 -1.98 117.51 118.46 1stu h ILE 2 Ca 0.00 -0.21 0.13 0.00 -0.39 0.00 0.00 64.86 64.39 1stu h ILE 2 Cb 0.00 0.00 -0.02 0.00 -3.07 0.00 0.00 36.82 33.73 1stu h ILE 2 CO 0.00 0.00 0.34 -1.28 -0.69 0.00 0.00 178.15 176.52 1stu h SER 3 N -0.52 0.07 0.43 1.72 0.87 -2.00 -1.26 113.55 112.86 1stu h SER 3 Ca -0.03 0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.51 1stu h SER 3 Cb 0.24 -0.01 0.00 0.00 -0.44 0.00 0.00 62.40 62.19 1stu h SER 3 CO 0.05 0.04 -0.21 1.56 -0.53 0.00 0.00 176.83 177.74 1stu h GLN 4 N 0.08 -0.56 0.42 2.24 4.20 -1.99 -0.30 115.11 119.21 1stu h GLN 4 Ca 0.23 0.04 -0.01 0.00 0.06 0.00 0.00 58.65 58.97 1stu h GLN 4 Cb 0.81 0.13 -0.01 0.00 0.30 0.00 0.00 27.48 28.71 1stu h GLN 4 CO -0.02 -0.28 -0.30 0.28 -0.67 0.00 0.00 178.83 177.84 1stu h VAL 5 N -0.77 0.38 -1.07 -0.54 2.07 -0.61 0.33 116.25 116.04 1stu h VAL 5 Ca -0.06 0.00 0.34 0.00 0.82 0.00 0.00 66.70 67.80 1stu h VAL 5 Cb 0.54 0.38 -0.14 0.00 -1.52 0.00 0.00 31.29 30.55 1stu h VAL 5 CO 0.10 0.00 0.63 0.45 0.02 0.00 0.00 177.57 178.77 1stu h HIS 6 N -0.71 0.82 0.19 1.57 3.86 -1.24 0.61 115.15 120.26 1stu h HIS 6 Ca -0.04 0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 59.19 1stu h HIS 6 Cb 0.60 -0.22 0.00 0.00 1.06 0.00 0.00 27.41 28.85 1stu h HIS 6 CO -0.13 -0.17 -0.09 0.93 0.86 0.00 0.00 177.93 179.33 1stu h GLU 7 N 0.27 -0.25 0.03 2.45 4.39 0.88 -1.89 114.58 120.47 1stu h GLU 7 Ca 0.74 0.02 -0.00 0.00 0.34 0.00 0.00 59.36 60.46 1stu h GLU 7 Cb 1.85 0.06 0.00 0.00 -0.10 0.00 0.00 28.75 30.56 1stu h GLU 7 CO -0.54 -0.17 -0.02 -0.84 -1.16 0.00 0.00 179.01 176.28 1stu h ILE 8 N -0.29 1.18 -0.62 3.13 -0.00 -0.53 0.26 117.51 120.63 1stu h ILE 8 Ca -0.03 -0.70 0.09 0.00 -0.00 0.00 0.00 64.86 64.22 1stu h ILE 8 Cb 0.20 1.65 -0.11 0.00 -0.00 0.00 0.00 36.82 38.56 1stu h ILE 8 CO 0.04 0.18 -0.46 1.23 -0.00 0.00 0.00 178.15 179.14 1stu h GLY 9 N -0.35 -0.52 2.00 0.16 0.00 0.09 0.96 103.07 105.41 1stu h GLY 9 Ca -0.00 0.60 -0.10 0.00 0.00 0.00 0.00 47.33 47.82 1stu h GLY 9 CO 0.01 -0.14 -0.47 -2.22 0.00 0.00 0.00 176.54 173.71 1stu h ILE 10 N -0.21 1.30 -0.00 2.60 1.08 -1.31 1.22 117.51 122.20 1stu h ILE 10 Ca 0.18 -1.64 0.00 0.00 -0.39 0.00 0.00 64.86 63.01 1stu h ILE 10 Cb 0.56 1.89 0.00 0.00 -3.07 0.00 0.00 36.82 36.20 1stu h ILE 10 CO -0.72 0.46 -0.00 0.29 -0.69 0.00 0.00 178.15 177.49 1stu n LYS 11 N -3.93 0.68 -0.24 2.37 4.76 0.15 -3.48 118.16 118.47 1stu n LYS 11 Ca -0.01 -0.02 0.02 0.00 -2.87 0.00 0.00 58.31 55.43 1stu n LYS 11 Cb 0.50 -1.50 0.02 0.00 -1.84 0.00 0.00 35.03 32.21 1stu n LYS 11 CO 0.00 0.00 0.00 -2.13 -1.37 0.00 0.00 177.40 173.90 1stu n ARG 12 N -1.14 0.50 -0.30 1.97 0.00 0.28 -4.96 116.66 113.00 1stu n ARG 12 Ca 0.18 -1.16 0.00 0.00 -0.00 0.00 0.00 57.85 56.87 1stu n ARG 12 Cb 0.19 -0.71 0.00 0.00 0.00 0.00 0.00 32.46 31.94 1stu n ARG 12 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.63 175.92 1stu n ASN 13 N -0.28 0.00 -4.54 6.15 2.85 -0.49 -4.94 115.26 114.01 1stu n ASN 13 Ca 0.03 0.00 -0.42 0.00 -0.11 0.00 0.00 54.58 54.08 1stu n ASN 13 Cb 0.59 -0.13 -0.03 0.00 1.24 0.00 0.00 39.78 41.45 1stu n ASN 13 CO 0.00 0.00 0.00 -0.04 -2.11 0.00 0.00 177.26 175.11 1stu s MET 14 N -0.02 3.56 0.87 1.20 -1.94 0.41 -3.86 119.30 119.52 1stu s MET 14 Ca 0.00 -1.18 -0.17 0.00 -1.71 0.00 0.00 55.69 52.63 1stu s MET 14 Cb 0.00 -5.20 -0.13 0.00 2.01 0.00 0.00 34.83 31.51 1stu s MET 14 CO 0.00 -2.12 -0.47 0.25 -0.01 0.00 0.00 175.02 172.67 1stu n THR 15 N 6.60 0.11 -3.61 2.05 -2.24 -1.25 -3.23 114.28 112.71 1stu n THR 15 Ca 0.29 -0.47 -0.28 0.00 -2.27 0.00 0.00 64.05 61.33 1stu n THR 15 Cb 0.50 -0.10 -0.11 0.00 -2.10 0.00 0.00 70.33 68.52 1stu n THR 15 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1stu s VAL 16 N -2.03 1.38 -0.42 2.28 1.01 -1.13 -3.22 120.40 118.26 1stu s VAL 16 Ca 0.47 -3.25 0.02 0.00 0.00 0.00 0.00 61.98 59.22 1stu s VAL 16 Cb -0.26 -1.93 0.12 0.00 0.00 0.00 0.00 36.38 34.31 1stu s VAL 16 CO 0.76 -1.12 0.17 -1.00 0.00 0.00 0.00 175.10 173.91 1stu s HIS 17 N -0.48 3.57 0.19 5.22 3.76 -0.88 -4.83 115.29 121.83 1stu s HIS 17 Ca 0.29 -2.89 -0.30 0.00 -0.15 0.00 0.00 55.06 52.01 1stu s HIS 17 Cb -0.02 -3.00 -0.08 0.00 1.11 0.00 0.00 32.58 30.60 1stu s HIS 17 CO -0.17 -0.90 0.96 -0.06 -0.85 0.00 0.00 174.74 173.72 1stu s PHE 18 N 0.59 3.89 -0.19 1.40 0.40 -1.26 -1.54 117.98 121.28 1stu s PHE 18 Ca 0.12 1.86 -0.06 0.00 -0.60 0.00 0.00 56.93 58.25 1stu s PHE 18 Cb -0.21 -3.03 0.09 0.00 0.51 0.00 0.00 43.02 40.38 1stu s PHE 18 CO -0.05 0.30 0.37 -1.59 0.70 0.00 0.00 175.22 174.95 1stu s LYS 19 N -0.69 0.28 -0.01 0.44 -2.85 0.33 -4.98 119.74 112.27 1stu s LYS 19 Ca 0.44 0.89 -0.30 0.00 -1.00 0.00 0.00 55.97 56.00 1stu s LYS 19 Cb -0.25 0.12 -0.03 0.00 -2.06 0.00 0.00 37.83 35.60 1stu s LYS 19 CO 0.31 -0.32 1.02 0.08 0.10 0.00 0.00 175.35 176.55 1stu s VAL 20 N 2.56 4.71 -0.13 1.79 1.01 -1.26 -0.48 120.40 128.60 1stu s VAL 20 Ca 0.01 1.95 0.17 0.00 0.00 0.00 0.00 61.98 64.11 1stu s VAL 20 Cb -0.13 -4.25 -0.11 0.00 0.00 0.00 0.00 36.38 31.90 1stu s VAL 20 CO -0.12 0.13 0.92 -0.07 0.00 0.00 0.00 175.10 175.96 1stu h LEU 21 N 7.00 0.00 0.00 3.92 3.38 -1.84 -3.47 115.31 124.31 1stu h LEU 21 Ca -0.40 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.57 1stu h LEU 21 Cb 1.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.96 1stu h LEU 21 CO 0.78 0.55 0.00 0.54 0.09 0.00 0.00 178.44 180.40 1stu n ARG 22 N -2.93 -0.57 -3.87 1.13 1.74 -1.26 -5.04 116.66 105.85 1stu n ARG 22 Ca -0.08 0.00 -0.28 0.00 -0.77 0.00 0.00 57.85 56.72 1stu n ARG 22 Cb 0.82 0.00 -0.12 0.00 -1.02 0.00 0.00 32.46 32.13 1stu n ARG 22 CO 0.00 0.00 0.00 -1.83 -1.52 0.00 0.00 177.63 174.28 1stu s GLU 23 N -1.80 2.23 2.16 5.56 -1.05 -1.26 -2.47 118.70 122.06 1stu s GLU 23 Ca 0.00 -3.07 0.00 0.00 -0.15 0.00 0.00 54.97 51.75 1stu s GLU 23 Cb 0.00 -3.24 0.00 0.00 -0.44 0.00 0.00 34.13 30.45 1stu s GLU 23 CO 0.00 -1.25 0.00 -1.91 0.95 0.00 0.00 175.26 173.05 1stu n GLU 24 N 2.32 0.00 0.00 -4.83 4.07 -1.16 -4.04 120.64 117.00 1stu n GLU 24 Ca 0.17 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.27 1stu n GLU 24 Cb 0.35 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.73 1stu n GLU 24 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 1stu n GLY 25 N 0.00 0.81 0.00 8.31 0.00 -1.26 -4.97 105.19 108.08 1stu n GLY 25 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1stu n GLY 25 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1stu n PRO 26 N 0.00 0.00 0.00 1.61 -0.01 -1.26 -4.92 135.00 130.42 1stu n PRO 26 Ca 0.00 0.11 0.00 0.00 -0.01 0.00 0.00 63.50 63.60 1stu n PRO 26 Cb 0.00 -1.09 0.00 0.00 -0.01 0.00 0.00 33.50 32.40 1stu n PRO 26 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 175.50 175.49 1stu n ALA 27 N -0.82 0.00 -3.75 3.55 0.00 -1.26 -4.79 120.51 113.44 1stu n ALA 27 Ca 0.00 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.16 1stu n ALA 27 Cb 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.42 1stu n ALA 27 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 1stu n HIS 28 N 0.00 -1.62 0.44 0.00 -0.00 -1.26 -4.71 115.22 108.07 1stu n HIS 28 Ca 0.00 0.52 0.05 0.00 -0.00 0.00 0.00 57.72 58.30 1stu n HIS 28 Cb 0.00 -2.29 0.25 0.00 -0.00 0.00 0.00 29.99 27.95 1stu n HIS 28 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 1stu n MET 29 N -3.75 0.07 -0.28 -1.40 0.00 -1.26 -2.99 117.12 107.51 1stu n MET 29 Ca 0.05 0.25 0.23 0.00 0.00 0.00 0.00 57.70 58.23 1stu n MET 29 Cb 0.50 -1.50 0.56 0.00 0.00 0.00 0.00 33.22 32.77 1stu n MET 29 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 175.97 176.84 1stu h LYS 30 N 0.00 0.31 -6.85 3.17 1.57 -1.84 -3.41 116.57 109.52 1stu h LYS 30 Ca 0.00 -0.02 -0.48 0.00 -1.87 0.00 0.00 60.65 58.28 1stu h LYS 30 Cb 0.15 -0.07 0.03 0.00 0.08 0.00 0.00 32.23 32.42 1stu h LYS 30 CO 0.00 0.20 0.03 -0.80 -0.57 0.00 0.00 179.45 178.31 1stu s ASN 31 N -5.41 6.08 -0.07 0.86 0.01 -1.16 0.61 114.94 115.86 1stu s ASN 31 Ca -0.08 0.69 0.01 0.00 -0.71 0.00 0.00 52.86 52.77 1stu s ASN 31 Cb 0.24 -2.00 0.02 0.00 0.41 0.00 0.00 41.25 39.92 1stu s ASN 31 CO 0.79 -0.63 -0.07 -0.36 -1.51 0.00 0.00 177.10 175.33 1stu s PHE 32 N -2.67 1.10 -0.82 2.20 0.40 -0.40 -2.99 117.98 114.81 1stu s PHE 32 Ca 0.47 -0.42 -0.20 0.00 -0.60 0.00 0.00 56.93 56.18 1stu s PHE 32 Cb -0.10 -0.93 0.10 0.00 0.51 0.00 0.00 43.02 42.60 1stu s PHE 32 CO 0.42 -0.32 1.06 0.42 0.70 0.00 0.00 175.22 177.50 1stu s ILE 33 N 1.21 4.56 -0.41 0.64 -1.09 -1.03 0.22 121.20 125.30 1stu s ILE 33 Ca -0.06 -1.08 -0.22 0.00 -2.23 0.00 0.00 60.65 57.06 1stu s ILE 33 Cb -0.14 -4.74 0.02 0.00 -1.58 0.00 0.00 42.46 36.02 1stu s ILE 33 CO -0.02 -1.49 0.72 -0.89 -1.23 0.00 0.00 174.94 172.04 1stu s THR 34 N 3.26 4.75 -0.29 2.92 2.01 -0.42 -2.34 115.64 125.54 1stu s THR 34 Ca 0.28 0.47 -0.29 0.00 0.31 0.00 0.00 61.69 62.46 1stu s THR 34 Cb -0.10 -4.23 0.01 0.00 0.01 0.00 0.00 72.50 68.19 1stu s THR 34 CO -0.02 -0.56 1.17 0.00 -0.69 0.00 0.00 174.62 174.53 1stu s ALA 35 N 3.03 3.48 -0.25 7.40 0.00 0.36 -0.00 121.76 135.78 1stu s ALA 35 Ca 0.27 0.07 -0.05 0.00 0.00 0.00 0.00 51.96 52.25 1stu s ALA 35 Cb -0.13 -3.70 -0.01 0.00 0.00 0.00 0.00 23.12 19.28 1stu s ALA 35 CO 0.19 -1.52 0.02 0.00 0.00 0.00 0.00 175.76 174.45 1stu s ILE 37 N 1.51 4.88 -0.04 0.00 -1.16 -0.59 -1.28 121.20 124.52 1stu s ILE 37 Ca 0.05 1.38 -0.06 0.00 -0.51 0.00 0.00 60.65 61.51 1stu s ILE 37 Cb -0.15 -4.00 0.01 0.00 0.61 0.00 0.00 42.46 38.93 1stu s ILE 37 CO -0.00 0.38 0.14 0.68 -2.81 0.00 0.00 174.94 173.33 1stu s VAL 38 N -0.02 0.03 -1.47 4.00 -7.23 -0.62 -2.07 120.40 113.01 1stu s VAL 38 Ca 0.34 -0.22 0.00 0.00 -1.81 0.00 0.00 61.98 60.29 1stu s VAL 38 Cb -0.19 -0.27 0.00 0.00 0.56 0.00 0.00 36.38 36.48 1stu s VAL 38 CO 0.19 -0.12 0.00 0.61 -0.31 0.00 0.00 175.10 175.47 1stu n GLY 39 N 2.54 1.32 2.51 2.32 0.00 -1.25 -0.32 105.19 112.31 1stu n GLY 39 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.86 1stu n GLY 39 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1stu n SER 40 N -0.66 0.00 -4.72 1.61 3.41 -1.26 -4.95 113.62 107.05 1stu n SER 40 Ca -0.14 0.00 -0.39 0.00 -0.26 0.00 0.00 58.87 58.08 1stu n SER 40 Cb 0.49 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.38 1stu n SER 40 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1stu s ILE 41 N -1.54 5.11 -0.06 -1.33 1.09 0.56 -5.04 121.20 119.99 1stu s ILE 41 Ca 0.00 1.18 -0.19 0.00 -1.10 0.00 0.00 60.65 60.54 1stu s ILE 41 Cb 0.00 -3.92 -0.05 0.00 -1.06 0.00 0.00 42.46 37.43 1stu s ILE 41 CO 0.00 0.30 0.52 -0.69 -0.10 0.00 0.00 174.94 174.98 1stu s VAL 42 N 0.62 5.06 -0.26 2.92 1.01 -1.26 -1.59 120.40 126.89 1stu s VAL 42 Ca 0.31 1.07 -0.00 0.00 0.00 0.00 0.00 61.98 63.36 1stu s VAL 42 Cb -0.16 -3.86 0.08 0.00 0.00 0.00 0.00 36.38 32.44 1stu s VAL 42 CO 0.14 0.39 0.02 -0.89 0.00 0.00 0.00 175.10 174.76 1stu s THR 43 N 0.13 1.22 0.28 3.92 2.01 -0.41 -4.93 115.64 117.87 1stu s THR 43 Ca 0.28 -1.28 -0.04 0.00 0.31 0.00 0.00 61.69 60.96 1stu s THR 43 Cb -0.17 -1.71 0.06 0.00 0.01 0.00 0.00 72.50 70.70 1stu s THR 43 CO 0.14 -0.36 0.39 -1.84 -0.69 0.00 0.00 174.62 172.25 1stu n GLU 44 N 4.75 -0.30 -3.34 4.92 0.00 -1.26 -1.75 120.64 123.66 1stu n GLU 44 Ca -0.06 -0.64 -0.03 0.00 0.00 0.00 0.00 57.16 56.43 1stu n GLU 44 Cb 0.44 -0.38 -0.05 0.00 0.00 0.00 0.00 31.44 31.44 1stu n GLU 44 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.13 177.33 1stu s GLY 45 N -3.79 -0.68 -1.29 -1.84 0.00 1.00 -4.76 107.32 95.97 1stu s GLY 45 Ca 0.22 1.52 -0.18 0.00 0.00 0.00 0.00 44.72 46.28 1stu s GLY 45 CO 0.15 2.96 1.85 -1.84 0.00 0.00 0.00 173.10 176.22 1stu n GLU 46 N 5.40 2.83 -0.44 2.90 0.28 -1.24 -1.30 120.64 129.08 1stu n GLU 46 Ca -0.04 -3.00 -0.24 0.00 -0.16 0.00 0.00 57.16 53.72 1stu n GLU 46 Cb 0.50 -3.49 0.20 0.00 1.43 0.00 0.00 31.44 30.09 1stu n GLU 46 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1stu n GLY 47 N 5.25 -2.92 2.71 -1.84 0.00 0.13 -4.45 105.19 104.08 1stu n GLY 47 Ca 0.49 -1.12 -0.29 0.00 0.00 0.00 0.00 46.02 45.10 1stu n GLY 47 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1stu s ASN 48 N -2.34 3.59 0.00 1.61 0.01 -1.26 -1.27 114.94 115.27 1stu s ASN 48 Ca 0.50 -2.94 0.00 0.00 -0.71 0.00 0.00 52.86 49.71 1stu s ASN 48 Cb -0.10 -1.09 0.00 0.00 0.41 0.00 0.00 41.25 40.47 1stu s ASN 48 CO 0.46 -0.22 0.00 0.61 -1.51 0.00 0.00 177.10 176.44 1stu n GLY 49 N 3.13 4.07 0.28 0.66 0.00 0.20 -4.88 105.19 108.65 1stu n GLY 49 Ca 0.13 -1.27 -0.08 0.00 0.00 0.00 0.00 46.02 44.80 1stu n GLY 49 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1stu h LYS 50 N 0.00 -0.13 0.00 1.61 1.57 -1.92 -3.39 116.57 114.31 1stu h LYS 50 Ca 0.00 0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1stu h LYS 50 Cb 0.00 0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.34 1stu h LYS 50 CO 0.00 -0.08 0.00 1.63 -0.57 0.00 0.00 179.45 180.43 1stu n LYS 51 N -4.43 1.14 0.00 3.15 5.02 -1.26 -4.36 118.16 117.41 1stu n LYS 51 Ca -0.01 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.28 1stu n LYS 51 Cb 0.19 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.20 1stu n LYS 51 CO 0.00 0.00 0.00 1.55 -0.52 0.00 0.00 177.40 178.43 1stu n VAL 52 N -0.38 0.00 -0.32 -0.18 3.14 -1.26 -4.65 118.33 114.68 1stu n VAL 52 Ca 0.00 0.00 0.13 0.00 -2.96 0.00 0.00 64.34 61.51 1stu n VAL 52 Cb 0.00 0.00 0.28 0.00 -1.06 0.00 0.00 33.84 33.06 1stu n VAL 52 CO 0.00 0.00 0.00 0.77 -6.46 0.00 0.00 176.83 171.14 1stu h SER 53 N 0.00 -0.37 -0.47 6.55 4.64 -1.76 1.23 113.55 123.37 1stu h SER 53 Ca 0.00 0.25 -0.01 0.00 -0.47 0.00 0.00 61.79 61.56 1stu h SER 53 Cb 0.00 0.43 -0.02 0.00 -0.31 0.00 0.00 62.40 62.49 1stu h SER 53 CO 0.00 -0.30 0.24 0.11 -0.87 0.00 0.00 176.83 176.01 1stu h LYS 54 N 0.05 0.67 0.00 4.77 6.56 -1.92 -0.81 116.57 125.89 1stu h LYS 54 Ca 0.57 -0.09 0.00 0.00 -1.06 0.00 0.00 60.65 60.07 1stu h LYS 54 Cb 1.15 -0.12 0.00 0.00 -0.57 0.00 0.00 32.23 32.69 1stu h LYS 54 CO -0.84 0.55 0.00 1.63 -2.06 0.00 0.00 179.45 178.73 1stu n LYS 55 N -4.65 0.00 -0.37 3.15 5.02 0.40 -1.53 118.16 120.17 1stu n LYS 55 Ca 0.01 0.32 0.34 0.00 -2.02 0.00 0.00 58.31 56.96 1stu n LYS 55 Cb 0.10 -1.26 0.60 0.00 -0.02 0.00 0.00 35.03 34.45 1stu n LYS 55 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 1stu n ARG 56 N -1.45 -0.05 0.08 1.97 3.00 0.43 0.12 116.66 120.77 1stu n ARG 56 Ca 0.00 1.26 -0.13 0.00 -0.00 0.00 0.00 57.85 58.98 1stu n ARG 56 Cb 0.00 -2.36 -0.08 0.00 0.00 0.00 0.00 32.46 30.02 1stu n ARG 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.63 177.63 1stu h ALA 57 N 1.73 -0.16 0.60 5.13 0.00 -0.97 -0.87 119.26 124.72 1stu h ALA 57 Ca 0.82 -0.09 -0.03 0.00 0.00 0.00 0.00 54.91 55.61 1stu h ALA 57 Cb 2.40 0.06 0.01 0.00 0.00 0.00 0.00 17.79 20.26 1stu h ALA 57 CO -0.60 -0.52 -0.29 0.00 0.00 0.00 0.00 179.25 177.83 1stu h ALA 58 N 0.58 -0.80 -0.87 0.00 0.00 0.21 0.08 119.26 118.45 1stu h ALA 58 Ca -0.02 -0.20 0.22 0.00 0.00 0.00 0.00 54.91 54.91 1stu h ALA 58 Cb 0.23 0.31 -0.13 0.00 0.00 0.00 0.00 17.79 18.20 1stu h ALA 58 CO 0.03 -0.82 0.30 0.93 0.00 0.00 0.00 179.25 179.68 1stu h GLU 59 N -1.06 0.28 -0.65 0.00 5.08 -1.12 1.32 114.58 118.42 1stu h GLU 59 Ca -0.08 -0.02 0.01 0.00 -1.00 0.00 0.00 59.36 58.27 1stu h GLU 59 Cb 0.67 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 29.83 1stu h GLU 59 CO 0.14 0.18 0.43 -0.22 -1.00 0.00 0.00 179.01 178.54 1stu h LYS 60 N 0.29 0.86 0.00 2.33 3.64 -0.97 0.50 116.57 123.22 1stu h LYS 60 Ca 0.54 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.87 1stu h LYS 60 Cb 1.07 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.69 1stu h LYS 60 CO -0.59 0.57 0.00 -1.33 -2.27 0.00 0.00 179.45 175.83 1stu n MET 61 N -4.63 0.00 0.16 1.90 2.81 0.44 -0.09 117.12 117.70 1stu n MET 61 Ca 0.05 0.47 -0.15 0.00 -1.81 0.00 0.00 57.70 56.27 1stu n MET 61 Cb 0.02 -1.40 -0.07 0.00 -0.71 0.00 0.00 33.22 31.06 1stu n MET 61 CO 0.00 0.00 0.00 -0.07 1.51 0.00 0.00 175.97 177.41 1stu h LEU 62 N 0.00 -1.10 -1.77 4.03 3.38 -1.13 0.34 115.31 119.06 1stu h LEU 62 Ca 0.00 0.11 0.33 0.00 0.09 0.00 0.00 57.88 58.41 1stu h LEU 62 Cb 0.00 0.40 -0.07 0.00 0.09 0.00 0.00 40.66 41.08 1stu h LEU 62 CO 0.00 -0.49 0.81 0.58 0.09 0.00 0.00 178.44 179.43 1stu h VAL 63 N -0.68 0.42 0.34 1.22 2.07 -0.95 -0.80 116.25 117.87 1stu h VAL 63 Ca 0.01 -0.04 -0.02 0.00 0.82 0.00 0.00 66.70 67.47 1stu h VAL 63 Cb 0.67 0.28 0.00 0.00 -1.52 0.00 0.00 31.29 30.72 1stu h VAL 63 CO -0.17 0.02 -0.16 -0.33 0.02 0.00 0.00 177.57 176.95 1stu h GLU 64 N 0.13 -0.44 -0.29 1.57 3.07 0.32 -0.87 114.58 118.06 1stu h GLU 64 Ca 0.59 0.03 0.08 0.00 -0.50 0.00 0.00 59.36 59.57 1stu h GLU 64 Cb 2.07 0.10 -0.01 0.00 -0.84 0.00 0.00 28.75 30.07 1stu h GLU 64 CO -0.12 -0.29 0.40 1.37 -1.40 0.00 0.00 179.01 178.96 1stu h LEU 65 N -0.65 0.00 0.08 1.33 -0.00 -0.37 0.28 115.31 115.98 1stu h LEU 65 Ca -0.05 0.00 -0.25 0.00 -0.00 0.00 0.00 57.88 57.58 1stu h LEU 65 Cb 0.35 0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 41.00 1stu h LEU 65 CO 0.08 0.00 -1.17 1.56 -0.00 0.00 0.00 178.44 178.91 1stu h GLN 66 N 0.00 0.17 -0.42 0.17 1.08 -1.06 -3.27 115.11 111.77 1stu h GLN 66 Ca 0.14 -0.29 -0.12 0.00 -1.45 0.00 0.00 58.65 56.93 1stu h GLN 66 Cb 0.93 0.11 -0.01 0.00 -0.05 0.00 0.00 27.48 28.45 1stu h GLN 66 CO -0.00 1.13 -0.20 0.87 -0.95 0.00 0.00 178.83 179.68 1stu h LYS 67 N 0.05 0.88 0.00 1.46 1.57 0.10 -3.51 116.57 117.12 1stu h LYS 67 Ca -0.09 -0.38 0.00 0.00 -1.87 0.00 0.00 60.65 58.30 1stu h LYS 67 Cb 1.90 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 34.18 1stu h LYS 67 CO 0.17 1.03 0.00 1.28 -0.57 0.00 0.00 179.45 181.36