#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 -0.97 4.25 1.08 -1.91 -1.83 117.51 118.12 1stu h ILE 2 Ca 0.00 -0.46 0.20 0.00 -0.39 0.00 0.00 64.86 64.21 1stu h ILE 2 Cb 0.00 0.00 -0.09 0.00 -3.07 0.00 0.00 36.82 33.66 1stu h ILE 2 CO 0.00 0.00 0.62 -1.28 -0.69 0.00 0.00 178.15 176.80 1stu h SER 3 N -0.98 0.61 0.13 1.72 0.87 -2.00 0.14 113.55 114.05 1stu h SER 3 Ca -0.05 0.07 -0.01 0.00 -1.23 0.00 0.00 61.79 60.57 1stu h SER 3 Cb 0.39 -0.04 0.00 0.00 -0.44 0.00 0.00 62.40 62.32 1stu h SER 3 CO 0.09 0.22 -0.06 1.56 -0.53 0.00 0.00 176.83 178.10 1stu h GLN 4 N 0.59 -0.17 0.16 2.24 1.08 -1.99 -0.36 115.11 116.66 1stu h GLN 4 Ca 0.54 0.01 -0.00 0.00 -1.45 0.00 0.00 58.65 57.75 1stu h GLN 4 Cb 1.07 0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 28.53 1stu h GLN 4 CO -0.29 -0.01 -0.16 0.28 -0.95 0.00 0.00 178.83 177.69 1stu h VAL 5 N -0.30 0.00 -1.05 -0.54 2.07 -0.14 -0.11 116.25 116.18 1stu h VAL 5 Ca -0.02 0.00 0.41 0.00 0.82 0.00 0.00 66.70 67.91 1stu h VAL 5 Cb 0.24 0.00 -0.15 0.00 -1.52 0.00 0.00 31.29 29.86 1stu h VAL 5 CO 0.03 0.00 0.61 1.41 0.02 0.00 0.00 177.57 179.64 1stu n HIS 6 N -3.30 0.93 0.35 1.57 8.25 -0.37 -0.23 115.22 122.41 1stu n HIS 6 Ca -0.04 0.93 -0.14 0.00 -0.26 0.00 0.00 57.72 58.22 1stu n HIS 6 Cb 0.15 -1.35 -0.06 0.00 1.12 0.00 0.00 29.99 29.85 1stu n HIS 6 CO 0.00 0.00 0.00 0.93 0.64 0.00 0.00 176.34 177.91 1stu h GLU 7 N 0.00 -0.85 -0.05 -0.41 5.08 0.75 -1.65 114.58 117.45 1stu h GLU 7 Ca 0.79 0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 59.20 1stu h GLU 7 Cb 2.27 0.19 -0.00 0.00 0.50 0.00 0.00 28.75 31.71 1stu h GLU 7 CO -0.61 -0.57 -0.02 -0.84 -1.00 0.00 0.00 179.01 175.97 1stu h ILE 8 N -0.92 1.32 -0.33 3.13 -0.00 0.18 -0.68 117.51 120.21 1stu h ILE 8 Ca -0.09 -1.00 0.07 0.00 -0.00 0.00 0.00 64.86 63.84 1stu h ILE 8 Cb 0.68 1.89 -0.08 0.00 -0.00 0.00 0.00 36.82 39.31 1stu h ILE 8 CO 0.15 0.27 -0.31 1.23 -0.00 0.00 0.00 178.15 179.49 1stu h GLY 9 N -0.29 -0.25 1.17 0.16 0.00 -0.69 0.65 103.07 103.82 1stu h GLY 9 Ca 0.01 0.39 -0.12 0.00 0.00 0.00 0.00 47.33 47.61 1stu h GLY 9 CO 0.01 -0.21 -0.16 -2.22 0.00 0.00 0.00 176.54 173.96 1stu h ILE 10 N -0.27 1.27 0.00 2.60 1.08 -1.21 2.15 117.51 123.13 1stu h ILE 10 Ca 0.16 -1.30 0.00 0.00 -0.39 0.00 0.00 64.86 63.32 1stu h ILE 10 Cb 0.52 1.05 0.00 0.00 -3.07 0.00 0.00 36.82 35.33 1stu h ILE 10 CO -0.48 0.45 0.00 0.29 -0.69 0.00 0.00 178.15 177.72 1stu n LYS 11 N -4.13 0.03 -0.00 2.37 5.02 -0.26 -2.20 118.16 118.98 1stu n LYS 11 Ca 0.01 0.24 0.00 0.00 -2.02 0.00 0.00 58.31 56.54 1stu n LYS 11 Cb 0.42 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.93 1stu n LYS 11 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1stu n ARG 12 N -1.47 2.14 0.00 1.97 1.74 0.21 -4.96 116.66 116.29 1stu n ARG 12 Ca 0.04 -1.22 0.00 0.00 -0.77 0.00 0.00 57.85 55.89 1stu n ARG 12 Cb 0.16 -0.86 0.00 0.00 -1.02 0.00 0.00 32.46 30.74 1stu n ARG 12 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 1stu n ASN 13 N -0.36 0.00 -4.56 0.55 6.94 0.84 -4.95 115.26 113.72 1stu n ASN 13 Ca 0.00 0.00 -0.40 0.00 -0.02 0.00 0.00 54.58 54.16 1stu n ASN 13 Cb 0.32 -0.05 -0.03 0.00 -2.36 0.00 0.00 39.78 37.66 1stu n ASN 13 CO 0.00 0.00 0.00 -0.04 -1.03 0.00 0.00 177.26 176.19 1stu s MET 14 N 0.00 3.06 1.02 -3.83 -1.94 0.69 -4.27 119.30 114.03 1stu s MET 14 Ca 0.00 0.26 -0.14 0.00 -1.71 0.00 0.00 55.69 54.10 1stu s MET 14 Cb 0.00 -4.23 0.08 0.00 2.01 0.00 0.00 34.83 32.69 1stu s MET 14 CO 0.00 -2.26 0.34 0.25 -0.01 0.00 0.00 175.02 173.35 1stu n THR 15 N 6.80 0.00 -3.64 2.05 -2.24 -1.26 -3.05 114.28 112.95 1stu n THR 15 Ca 0.12 -0.23 -0.29 0.00 -2.27 0.00 0.00 64.05 61.37 1stu n THR 15 Cb 0.50 -0.65 -0.13 0.00 -2.10 0.00 0.00 70.33 67.94 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 -2.36 0.88 -0.50 2.28 1.01 -1.08 -3.30 120.40 117.34 1stu s VAL 16 Ca 0.58 -2.01 -0.02 0.00 0.00 0.00 0.00 61.98 60.52 1stu s VAL 16 Cb -0.18 -1.63 0.13 0.00 0.00 0.00 0.00 36.38 34.69 1stu s VAL 16 CO 0.66 -0.87 0.29 -1.00 0.00 0.00 0.00 175.10 174.18 1stu s HIS 17 N 0.88 3.50 -0.25 5.22 3.76 -0.90 -4.80 115.29 122.71 1stu s HIS 17 Ca 0.16 -2.62 -0.28 0.00 -0.15 0.00 0.00 55.06 52.18 1stu s HIS 17 Cb -0.22 -3.17 0.01 0.00 1.11 0.00 0.00 32.58 30.30 1stu s HIS 17 CO -0.06 -0.91 0.98 -0.06 -0.85 0.00 0.00 174.74 173.84 1stu s PHE 18 N 0.56 3.30 -0.21 1.40 0.08 -1.26 -1.27 117.98 120.58 1stu s PHE 18 Ca 0.12 1.31 -0.05 0.00 0.12 0.00 0.00 56.93 58.43 1stu s PHE 18 Cb -0.22 -3.27 0.10 0.00 -0.57 0.00 0.00 43.02 39.06 1stu s PHE 18 CO -0.04 -0.51 0.38 0.21 -0.10 0.00 0.00 175.22 175.17 1stu s LYS 19 N 3.16 0.31 -0.23 0.44 2.20 -0.03 -4.99 119.74 120.59 1stu s LYS 19 Ca 0.41 0.79 -0.29 0.00 -0.36 0.00 0.00 55.97 56.52 1stu s LYS 19 Cb -0.15 -0.06 0.01 0.00 -1.51 0.00 0.00 37.83 36.12 1stu s LYS 19 CO 0.08 -0.41 1.09 0.08 -0.36 0.00 0.00 175.35 175.83 1stu s VAL 20 N 2.56 4.56 -0.54 4.02 1.01 -1.26 -0.94 120.40 129.80 1stu s VAL 20 Ca 0.04 1.88 0.05 0.00 0.00 0.00 0.00 61.98 63.94 1stu s VAL 20 Cb -0.13 -4.27 0.05 0.00 0.00 0.00 0.00 36.38 32.03 1stu s VAL 20 CO -0.13 -0.23 0.71 0.00 0.00 0.00 0.00 175.10 175.45 1stu n LEU 21 N 6.50 1.52 -3.76 3.92 -0.00 -1.11 -4.93 117.00 119.14 1stu n LEU 21 Ca 0.12 -1.14 -0.10 0.00 -0.00 0.00 0.00 56.01 54.90 1stu n LEU 21 Cb 0.46 -0.01 -0.05 0.00 -0.00 0.00 0.00 43.42 43.82 1stu n LEU 21 CO 0.54 0.34 0.16 -0.13 -0.00 0.00 0.00 177.39 178.30 1stu s ARG 22 N -0.47 1.21 0.00 1.47 0.52 -1.22 -4.99 118.95 115.47 1stu s ARG 22 Ca 0.06 -0.88 0.00 0.00 -0.52 0.00 0.00 55.73 54.39 1stu s ARG 22 Cb 0.04 0.47 0.00 0.00 0.52 0.00 0.00 34.95 35.98 1stu s ARG 22 CO 0.06 -0.48 0.00 0.39 0.02 0.00 0.00 175.30 175.28 1stu n GLU 23 N -0.26 3.11 -3.50 3.54 1.02 -1.26 -1.14 120.64 122.15 1stu n GLU 23 Ca -0.12 0.00 -0.23 0.00 -0.02 0.00 0.00 57.16 56.79 1stu n GLU 23 Cb 0.63 0.00 -0.13 0.00 -0.02 0.00 0.00 31.44 31.92 1stu n GLU 23 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1stu s GLU 24 N 0.21 0.20 0.57 3.49 0.41 0.18 -4.42 118.70 119.35 1stu s GLU 24 Ca 0.00 -0.18 0.00 0.00 -0.41 0.00 0.00 54.97 54.38 1stu s GLU 24 Cb 0.00 -1.15 0.00 0.00 -1.78 0.00 0.00 34.13 31.20 1stu s GLU 24 CO 0.00 -0.88 0.00 0.41 -0.49 0.00 0.00 175.26 174.30 1stu n GLY 25 N 5.29 -3.04 0.04 -1.39 0.00 -1.26 -3.80 105.19 101.03 1stu n GLY 25 Ca -0.05 -0.92 -0.02 0.00 0.00 0.00 0.00 46.02 45.03 1stu n GLY 25 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1stu h PRO 26 N -1.42 -0.11 0.00 1.61 0.11 -1.99 -3.45 132.00 126.75 1stu h PRO 26 Ca -0.18 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.94 1stu h PRO 26 Cb 1.28 0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.42 1stu h PRO 26 CO 0.07 -0.07 0.00 0.00 -0.21 0.00 0.00 178.00 177.79 1stu n ALA 27 N -2.06 3.00 -1.27 -0.75 0.00 -1.26 -4.84 120.51 113.32 1stu n ALA 27 Ca -0.01 0.00 -0.49 0.00 0.00 0.00 0.00 53.44 52.93 1stu n ALA 27 Cb 0.04 0.15 -0.12 0.00 0.00 0.00 0.00 19.45 19.52 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 -3.12 0.87 -2.23 0.00 -0.00 -1.26 -2.21 115.22 107.27 1stu n HIS 28 Ca 0.00 0.58 -0.04 0.00 -0.00 0.00 0.00 57.72 58.26 1stu n HIS 28 Cb 0.00 -2.20 0.00 0.00 -0.00 0.00 0.00 29.99 27.80 1stu n HIS 28 CO 0.00 0.00 0.00 -1.33 -0.00 0.00 0.00 176.34 175.01 1stu n MET 29 N 7.46 -1.43 -1.83 -1.40 2.00 -1.26 -4.68 117.12 115.98 1stu n MET 29 Ca 0.56 1.46 -0.41 0.00 0.00 0.00 0.00 57.70 59.32 1stu n MET 29 Cb -0.01 -3.74 -0.01 0.00 0.00 0.00 0.00 33.22 29.46 1stu n MET 29 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 175.97 177.60 1stu n LYS 30 N -0.25 3.72 -2.45 0.03 5.02 -0.94 -4.37 118.16 118.92 1stu n LYS 30 Ca 0.05 -2.94 -0.24 0.00 -2.02 0.00 0.00 58.31 53.16 1stu n LYS 30 Cb 0.21 -2.90 0.07 0.00 -0.02 0.00 0.00 35.03 32.39 1stu n LYS 30 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 1stu s ASN 31 N 1.61 4.83 -0.05 4.39 -0.87 -1.25 0.54 114.94 124.15 1stu s ASN 31 Ca 0.53 0.09 -0.06 0.00 -1.57 0.00 0.00 52.86 51.85 1stu s ASN 31 Cb 0.15 -0.75 0.01 0.00 -0.02 0.00 0.00 41.25 40.64 1stu s ASN 31 CO -0.06 -1.52 0.16 -0.36 -2.57 0.00 0.00 177.10 172.75 1stu s PHE 32 N -3.06 -0.14 -0.67 2.20 0.40 -0.45 0.50 117.98 116.77 1stu s PHE 32 Ca 0.61 0.35 -0.22 0.00 -0.60 0.00 0.00 56.93 57.07 1stu s PHE 32 Cb -0.09 0.04 0.08 0.00 0.51 0.00 0.00 43.02 43.56 1stu s PHE 32 CO 0.42 -0.12 0.93 0.42 0.70 0.00 0.00 175.22 177.57 1stu s ILE 33 N -0.14 4.45 -0.38 0.64 -1.09 -0.29 0.35 121.20 124.73 1stu s ILE 33 Ca -0.02 -0.57 -0.22 0.00 -2.23 0.00 0.00 60.65 57.61 1stu s ILE 33 Cb -0.02 -4.66 0.01 0.00 -1.58 0.00 0.00 42.46 36.21 1stu s ILE 33 CO 0.00 -1.40 0.72 -0.89 -1.23 0.00 0.00 174.94 172.14 1stu s THR 34 N 3.70 4.78 -0.24 2.92 2.01 0.67 -2.76 115.64 126.72 1stu s THR 34 Ca 0.21 0.62 -0.28 0.00 0.31 0.00 0.00 61.69 62.55 1stu s THR 34 Cb -0.17 -4.18 0.01 0.00 0.01 0.00 0.00 72.50 68.16 1stu s THR 34 CO 0.08 -0.46 1.01 0.00 -0.69 0.00 0.00 174.62 174.56 1stu s ALA 35 N 2.97 3.66 -0.25 7.40 0.00 -0.12 0.39 121.76 135.81 1stu s ALA 35 Ca 0.28 0.09 -0.02 0.00 0.00 0.00 0.00 51.96 52.31 1stu s ALA 35 Cb -0.14 -3.52 0.02 0.00 0.00 0.00 0.00 23.12 19.48 1stu s ALA 35 CO 0.17 -1.09 -0.05 0.00 0.00 0.00 0.00 175.76 174.79 1stu s ILE 37 N 1.36 4.06 -0.06 0.00 -1.16 -0.40 -0.86 121.20 124.14 1stu s ILE 37 Ca 0.01 1.69 0.02 0.00 -0.51 0.00 0.00 60.65 61.87 1stu s ILE 37 Cb -0.16 -4.08 0.01 0.00 0.61 0.00 0.00 42.46 38.84 1stu s ILE 37 CO -0.04 0.25 -0.12 0.54 -2.81 0.00 0.00 174.94 172.76 1stu s VAL 38 N 0.08 1.09 0.00 4.00 0.11 -0.11 -2.11 120.40 123.46 1stu s VAL 38 Ca 0.51 -0.47 0.00 0.00 -2.93 0.00 0.00 61.98 59.09 1stu s VAL 38 Cb -0.28 -0.99 0.00 0.00 -1.53 0.00 0.00 36.38 33.58 1stu s VAL 38 CO 0.33 0.34 0.00 0.61 -3.33 0.00 0.00 175.10 173.05 1stu n GLY 39 N 3.69 0.00 0.34 6.54 0.00 -1.24 0.58 105.19 115.11 1stu n GLY 39 Ca -0.22 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.72 1stu n GLY 39 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1stu n SER 40 N -0.12 -0.82 -0.82 1.61 7.64 -1.26 -4.82 113.62 115.03 1stu n SER 40 Ca 0.00 1.45 0.00 0.00 1.01 0.00 0.00 58.87 61.33 1stu n SER 40 Cb 0.00 -0.21 0.00 0.00 -1.01 0.00 0.00 64.21 62.99 1stu n SER 40 CO 0.00 0.00 0.00 2.30 -3.01 0.00 0.00 175.04 174.33 1stu n ILE 41 N -5.04 0.00 -3.21 0.44 -6.64 0.20 -5.13 119.36 99.97 1stu n ILE 41 Ca 0.03 0.00 -0.39 0.00 -1.77 0.00 0.00 62.75 60.62 1stu n ILE 41 Cb 0.23 0.00 -0.06 0.00 -1.44 0.00 0.00 39.64 38.37 1stu n ILE 41 CO 0.00 0.00 0.00 -0.69 -1.77 0.00 0.00 176.55 174.09 1stu s VAL 42 N -2.90 4.98 -0.31 7.28 1.01 -1.26 -0.93 120.40 128.28 1stu s VAL 42 Ca 0.00 1.22 0.03 0.00 0.00 0.00 0.00 61.98 63.23 1stu s VAL 42 Cb 0.00 -3.92 0.09 0.00 0.00 0.00 0.00 36.38 32.54 1stu s VAL 42 CO 0.00 0.38 0.00 -0.89 0.00 0.00 0.00 175.10 174.59 1stu s THR 43 N 0.08 2.05 0.00 3.92 2.01 -0.04 -4.88 115.64 118.78 1stu s THR 43 Ca 0.31 -1.97 0.00 0.00 0.31 0.00 0.00 61.69 60.34 1stu s THR 43 Cb -0.18 -2.40 0.00 0.00 0.01 0.00 0.00 72.50 69.93 1stu s THR 43 CO 0.16 -0.41 0.00 -1.84 -0.69 0.00 0.00 174.62 171.84 1stu n GLU 44 N 4.39 0.25 -3.88 4.92 0.28 -1.26 -1.56 120.64 123.78 1stu n GLU 44 Ca -0.03 0.00 -0.10 0.00 -0.16 0.00 0.00 57.16 56.87 1stu n GLU 44 Cb 0.42 0.00 0.01 0.00 1.43 0.00 0.00 31.44 33.30 1stu n GLU 44 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 177.13 177.17 1stu s GLY 45 N -2.74 0.67 -0.55 -1.84 0.00 0.16 -4.71 107.32 98.30 1stu s GLY 45 Ca 0.00 -0.96 0.04 0.00 0.00 0.00 0.00 44.72 43.80 1stu s GLY 45 CO 0.00 -0.49 0.38 -1.83 0.00 0.00 0.00 173.10 171.16 1stu s GLU 46 N -2.46 1.73 1.09 2.90 -1.05 -1.25 -0.24 118.70 119.43 1stu s GLU 46 Ca 0.19 -2.66 -0.17 0.00 -0.15 0.00 0.00 54.97 52.18 1stu s GLU 46 Cb -0.04 -2.60 0.11 0.00 -0.44 0.00 0.00 34.13 31.16 1stu s GLU 46 CO 0.14 -1.28 0.17 0.41 0.95 0.00 0.00 175.26 175.65 1stu n GLY 47 N 2.62 -2.35 2.64 -3.83 0.00 0.15 -4.56 105.19 99.87 1stu n GLY 47 Ca 0.20 -0.81 -0.28 0.00 0.00 0.00 0.00 46.02 45.13 1stu n GLY 47 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1stu s ASN 48 N -1.93 3.09 0.00 1.61 3.84 -1.26 -1.34 114.94 118.96 1stu s ASN 48 Ca 0.57 -3.32 0.00 0.00 0.21 0.00 0.00 52.86 50.33 1stu s ASN 48 Cb -0.15 -0.99 0.00 0.00 -0.55 0.00 0.00 41.25 39.56 1stu s ASN 48 CO 0.66 -0.15 0.00 0.61 -2.79 0.00 0.00 177.10 175.43 1stu n GLY 49 N 2.60 -1.19 2.84 1.21 0.00 0.19 -4.87 105.19 105.96 1stu n GLY 49 Ca 0.23 -2.17 -0.22 0.00 0.00 0.00 0.00 46.02 43.86 1stu n GLY 49 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1stu n LYS 50 N -0.08 -1.24 -1.72 1.61 5.02 -1.26 -3.73 118.16 116.75 1stu n LYS 50 Ca 0.00 -1.50 -0.09 0.00 -2.02 0.00 0.00 58.31 54.70 1stu n LYS 50 Cb 0.00 -1.06 -0.03 0.00 -0.02 0.00 0.00 35.03 33.93 1stu n LYS 50 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1stu n LYS 51 N -3.25 -1.66 0.00 1.97 5.02 -1.26 -4.80 118.16 114.18 1stu n LYS 51 Ca 0.12 0.52 0.00 0.00 -2.02 0.00 0.00 58.31 56.93 1stu n LYS 51 Cb 0.43 -4.84 0.00 0.00 -0.02 0.00 0.00 35.03 30.60 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 -2.21 0.00 0.00 -0.18 3.14 -1.24 -4.90 118.33 112.94 1stu n VAL 52 Ca -0.10 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.28 1stu n VAL 52 Cb 0.41 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.19 1stu n VAL 52 CO 0.00 0.00 0.00 -0.24 -6.46 0.00 0.00 176.83 170.13 1stu n SER 53 N 0.00 0.00 0.00 6.55 2.88 -1.26 -4.47 113.62 117.32 1stu n SER 53 Ca 0.00 0.00 -0.17 0.00 -1.33 0.00 0.00 58.87 57.37 1stu n SER 53 Cb 0.00 0.00 -0.11 0.00 -0.75 0.00 0.00 64.21 63.35 1stu n SER 53 CO 0.00 0.00 0.00 0.07 -1.23 0.00 0.00 175.04 173.88 1stu h LYS 54 N 0.00 0.42 -0.33 -1.46 -0.00 -1.96 -0.63 116.57 112.61 1stu h LYS 54 Ca 0.00 -0.44 -0.05 0.00 -0.00 0.00 0.00 60.65 60.16 1stu h LYS 54 Cb 0.00 0.12 -0.01 0.00 -0.00 0.00 0.00 32.23 32.34 1stu h LYS 54 CO 0.00 1.10 0.01 0.87 -0.00 0.00 0.00 179.45 181.43 1stu h LYS 55 N -0.08 0.57 0.53 0.07 1.57 -1.91 -1.48 116.57 115.84 1stu h LYS 55 Ca -0.07 -0.18 -0.03 0.00 -1.87 0.00 0.00 60.65 58.51 1stu h LYS 55 Cb 1.30 -0.05 0.01 0.00 0.08 0.00 0.00 32.23 33.56 1stu h LYS 55 CO 0.12 0.69 -0.25 -0.09 -0.57 0.00 0.00 179.45 179.34 1stu h ARG 56 N 0.38 -0.68 -0.96 3.15 1.12 -1.89 -1.66 114.38 113.83 1stu h ARG 56 Ca 0.09 0.05 0.26 0.00 -1.11 0.00 0.00 59.98 59.27 1stu h ARG 56 Cb 0.43 0.15 -0.17 0.00 -0.01 0.00 0.00 29.97 30.37 1stu h ARG 56 CO 0.01 -0.45 0.06 0.00 -3.11 0.00 0.00 179.97 176.48 1stu h ALA 57 N -1.62 1.18 0.68 2.80 0.00 -1.15 -0.42 119.26 120.73 1stu h ALA 57 Ca -0.07 0.32 -0.03 0.00 0.00 0.00 0.00 54.91 55.13 1stu h ALA 57 Cb 0.54 0.55 -0.00 0.00 0.00 0.00 0.00 17.79 18.88 1stu h ALA 57 CO 0.12 -0.56 -0.42 0.00 0.00 0.00 0.00 179.25 178.39 1stu h ALA 58 N 1.94 -1.22 -0.72 0.00 0.00 -1.01 -0.12 119.26 118.13 1stu h ALA 58 Ca 0.59 -0.22 0.14 0.00 0.00 0.00 0.00 54.91 55.42 1stu h ALA 58 Cb 1.21 0.54 -0.14 0.00 0.00 0.00 0.00 17.79 19.40 1stu h ALA 58 CO -0.87 -1.18 -0.19 0.93 0.00 0.00 0.00 179.25 177.93 1stu h GLU 59 N -1.03 -0.01 -0.69 0.00 3.07 -0.15 0.90 114.58 116.67 1stu h GLU 59 Ca -0.09 0.00 0.13 0.00 -0.50 0.00 0.00 59.36 58.90 1stu h GLU 59 Cb 0.83 0.00 -0.09 0.00 -0.84 0.00 0.00 28.75 28.65 1stu h GLU 59 CO 0.09 -0.01 0.21 -0.22 -1.40 0.00 0.00 179.01 177.69 1stu h LYS 60 N -0.01 0.33 0.00 2.33 1.63 -0.94 0.95 116.57 120.86 1stu h LYS 60 Ca 0.34 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 60.12 1stu h LYS 60 Cb 0.53 -0.08 0.00 0.00 -0.60 0.00 0.00 32.23 32.08 1stu h LYS 60 CO -0.74 0.22 0.00 -0.12 -3.45 0.00 0.00 179.45 175.36 1stu n MET 61 N -5.08 0.00 -0.07 1.90 1.56 0.29 0.07 117.12 115.80 1stu n MET 61 Ca 0.12 0.48 -0.08 0.00 -0.27 0.00 0.00 57.70 57.95 1stu n MET 61 Cb 0.39 -1.39 -0.06 0.00 2.15 0.00 0.00 33.22 34.30 1stu n MET 61 CO 0.00 0.00 0.00 -0.07 -0.73 0.00 0.00 175.97 175.17 1stu h LEU 62 N 0.00 -1.08 -1.99 -0.89 3.38 -0.83 0.68 115.31 114.58 1stu h LEU 62 Ca 0.00 0.14 0.23 0.00 0.09 0.00 0.00 57.88 58.34 1stu h LEU 62 Cb 0.00 0.44 -0.03 0.00 0.09 0.00 0.00 40.66 41.16 1stu h LEU 62 CO 0.00 -0.24 0.60 0.58 0.09 0.00 0.00 178.44 179.47 1stu h VAL 63 N -0.25 0.55 0.36 1.22 2.07 -0.91 0.51 116.25 119.79 1stu h VAL 63 Ca 0.04 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.54 1stu h VAL 63 Cb 0.36 0.58 0.00 0.00 -1.52 0.00 0.00 31.29 30.71 1stu h VAL 63 CO -0.34 0.00 -0.17 -0.33 0.02 0.00 0.00 177.57 176.75 1stu h GLU 64 N 0.00 -0.46 -0.49 1.57 4.39 0.43 -2.96 114.58 117.06 1stu h GLU 64 Ca 0.38 0.03 0.00 0.00 0.34 0.00 0.00 59.36 60.11 1stu h GLU 64 Cb 1.58 0.11 0.00 0.00 -0.10 0.00 0.00 28.75 30.34 1stu h GLU 64 CO -0.00 -0.14 0.00 1.47 -1.16 0.00 0.00 179.01 179.17 1stu n LEU 65 N -5.15 2.94 -0.00 1.33 -0.00 -0.41 -3.27 117.00 112.44 1stu n LEU 65 Ca -0.09 -1.41 0.10 0.00 -0.00 0.00 0.00 56.01 54.61 1stu n LEU 65 Cb 0.28 -0.32 -0.13 0.00 -0.00 0.00 0.00 43.42 43.25 1stu n LEU 65 CO 0.28 0.70 -0.28 0.00 -0.00 0.00 0.00 177.39 178.10 1stu n GLN 66 N 1.12 0.47 -0.05 1.47 6.02 0.17 -4.51 117.38 122.07 1stu n GLN 66 Ca 0.19 -0.06 -0.06 0.00 -0.01 0.00 0.00 57.00 57.05 1stu n GLN 66 Cb 0.48 -1.46 -0.05 0.00 1.02 0.00 0.00 30.24 30.23 1stu n GLN 66 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.06 177.22 1stu n LYS 67 N -1.72 0.99 0.00 -1.09 0.00 -1.12 -5.00 118.16 110.23 1stu n LYS 67 Ca 0.01 0.04 0.09 0.00 0.00 0.00 0.00 58.31 58.45 1stu n LYS 67 Cb 0.39 -1.21 0.53 0.00 0.00 0.00 0.00 35.03 34.74 1stu n LYS 67 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68