#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 -0.86 4.25 1.08 -1.94 -2.90 117.51 117.14 1stu h ILE 2 Ca 0.00 -0.77 0.11 0.00 -0.39 0.00 0.00 64.86 63.81 1stu h ILE 2 Cb 0.00 0.00 -0.08 0.00 -3.07 0.00 0.00 36.82 33.67 1stu h ILE 2 CO 0.00 0.00 0.49 -1.28 -0.69 0.00 0.00 178.15 176.67 1stu h SER 3 N -0.77 0.68 0.03 1.72 0.87 -1.99 -0.80 113.55 113.28 1stu h SER 3 Ca 0.00 0.06 0.02 0.00 -1.23 0.00 0.00 61.79 60.64 1stu h SER 3 Cb 0.01 -0.07 -0.02 0.00 -0.44 0.00 0.00 62.40 61.88 1stu h SER 3 CO 0.00 0.36 -0.13 1.56 -0.53 0.00 0.00 176.83 178.09 1stu h GLN 4 N 0.78 -0.23 0.11 2.24 1.08 -2.00 0.17 115.11 117.25 1stu h GLN 4 Ca 0.43 0.02 -0.00 0.00 -1.45 0.00 0.00 58.65 57.64 1stu h GLN 4 Cb 0.47 0.05 -0.00 0.00 -0.05 0.00 0.00 27.48 27.94 1stu h GLN 4 CO -0.28 -0.15 -0.09 0.28 -0.95 0.00 0.00 178.83 177.63 1stu h VAL 5 N -0.23 0.00 -1.17 -0.54 2.07 -1.07 0.17 116.25 115.47 1stu h VAL 5 Ca 0.04 0.00 0.38 0.00 0.82 0.00 0.00 66.70 67.94 1stu h VAL 5 Cb 0.28 0.00 -0.10 0.00 -1.52 0.00 0.00 31.29 29.95 1stu h VAL 5 CO -0.11 0.00 0.78 1.41 0.02 0.00 0.00 177.57 179.67 1stu n HIS 6 N -2.83 0.41 0.07 1.57 8.25 -0.40 0.11 115.22 122.39 1stu n HIS 6 Ca -0.02 0.41 -0.13 0.00 -0.26 0.00 0.00 57.72 57.72 1stu n HIS 6 Cb 0.09 -0.81 -0.09 0.00 1.12 0.00 0.00 29.99 30.30 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 -0.19 -0.07 -0.41 5.08 0.10 -1.75 114.58 117.34 1stu h GLU 7 Ca 0.68 0.01 -0.09 0.00 -1.00 0.00 0.00 59.36 58.97 1stu h GLU 7 Cb 2.35 0.04 0.00 0.00 0.50 0.00 0.00 28.75 31.65 1stu h GLU 7 CO -0.27 0.19 -0.31 0.97 -1.00 0.00 0.00 179.01 178.59 1stu h ILE 8 N -0.63 1.42 -0.30 3.13 -0.00 0.18 -1.18 117.51 120.13 1stu h ILE 8 Ca -0.02 -1.71 0.07 0.00 -0.00 0.00 0.00 64.86 63.19 1stu h ILE 8 Cb 0.47 2.32 -0.08 0.00 -0.00 0.00 0.00 36.82 39.54 1stu h ILE 8 CO 0.03 0.49 -0.24 1.23 -0.00 0.00 0.00 178.15 179.67 1stu h GLY 9 N -0.16 -0.11 0.75 8.18 0.00 -0.87 0.59 103.07 111.45 1stu h GLY 9 Ca -0.02 0.30 -0.03 0.00 0.00 0.00 0.00 47.33 47.58 1stu h GLY 9 CO 0.06 -0.20 -0.03 -2.22 0.00 0.00 0.00 176.54 174.15 1stu h ILE 10 N -0.22 1.29 0.00 2.60 1.08 -1.36 2.22 117.51 123.12 1stu h ILE 10 Ca 0.16 -0.98 0.00 0.00 -0.39 0.00 0.00 64.86 63.65 1stu h ILE 10 Cb 0.46 1.65 0.00 0.00 -3.07 0.00 0.00 36.82 35.87 1stu h ILE 10 CO -0.43 0.29 0.00 0.29 -0.69 0.00 0.00 178.15 177.61 1stu n LYS 11 N -4.71 0.00 0.00 2.37 4.76 -0.45 -1.74 118.16 118.39 1stu n LYS 11 Ca -0.06 0.40 0.00 0.00 -2.87 0.00 0.00 58.31 55.79 1stu n LYS 11 Cb 0.25 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 31.94 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 -1.51 1.65 0.00 1.97 0.63 0.20 -4.96 116.66 114.63 1stu n ARG 12 Ca 0.01 -1.07 0.00 0.00 -0.92 0.00 0.00 57.85 55.87 1stu n ARG 12 Cb 0.07 -0.87 0.00 0.00 0.45 0.00 0.00 32.46 32.11 1stu n ARG 12 CO 0.00 0.00 0.00 -1.71 -2.51 0.00 0.00 177.63 173.41 1stu n ASN 13 N -0.30 0.00 -4.56 6.15 5.15 0.13 -4.93 115.26 116.90 1stu n ASN 13 Ca 0.00 0.00 -0.31 0.00 -0.60 0.00 0.00 54.58 53.67 1stu n ASN 13 Cb 0.27 0.00 -0.04 0.00 -0.53 0.00 0.00 39.78 39.47 1stu n ASN 13 CO 0.00 0.00 0.00 -0.04 1.40 0.00 0.00 177.26 178.62 1stu s MET 14 N -0.01 2.88 0.51 1.20 -1.94 0.71 -4.36 119.30 118.29 1stu s MET 14 Ca 0.00 -0.59 -0.19 0.00 -1.71 0.00 0.00 55.69 53.20 1stu s MET 14 Cb 0.00 -5.16 -0.13 0.00 2.01 0.00 0.00 34.83 31.55 1stu s MET 14 CO 0.00 -3.04 0.16 0.25 -0.01 0.00 0.00 175.02 172.39 1stu n THR 15 N 7.56 0.94 -3.89 2.05 -2.24 -1.26 -3.54 114.28 113.91 1stu n THR 15 Ca 0.38 -0.50 -0.30 0.00 -2.27 0.00 0.00 64.05 61.36 1stu n THR 15 Cb 0.48 -0.27 -0.15 0.00 -2.10 0.00 0.00 70.33 68.29 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 -1.84 1.56 -0.42 2.28 1.01 -1.17 -2.96 120.40 118.87 1stu s VAL 16 Ca 0.62 -1.71 0.03 0.00 0.00 0.00 0.00 61.98 60.92 1stu s VAL 16 Cb -0.50 -2.08 0.12 0.00 0.00 0.00 0.00 36.38 33.91 1stu s VAL 16 CO 0.61 -0.51 0.15 -1.00 0.00 0.00 0.00 175.10 174.36 1stu s HIS 17 N 1.29 3.22 -0.02 5.22 3.76 -0.86 -4.83 115.29 123.07 1stu s HIS 17 Ca 0.06 -2.93 -0.29 0.00 -0.15 0.00 0.00 55.06 51.76 1stu s HIS 17 Cb -0.18 -2.70 -0.03 0.00 1.11 0.00 0.00 32.58 30.78 1stu s HIS 17 CO -0.14 -0.85 0.93 -0.06 -0.85 0.00 0.00 174.74 173.77 1stu s PHE 18 N 0.42 3.64 -0.23 1.40 0.40 -1.26 -1.35 117.98 121.01 1stu s PHE 18 Ca 0.14 1.61 -0.03 0.00 -0.60 0.00 0.00 56.93 58.05 1stu s PHE 18 Cb -0.22 -3.06 0.12 0.00 0.51 0.00 0.00 43.02 40.37 1stu s PHE 18 CO -0.05 -0.00 0.36 0.21 0.70 0.00 0.00 175.22 176.44 1stu s LYS 19 N 1.01 0.32 -0.64 0.44 2.20 0.20 -4.98 119.74 118.30 1stu s LYS 19 Ca 0.49 0.57 -0.28 0.00 -0.36 0.00 0.00 55.97 56.39 1stu s LYS 19 Cb -0.20 -0.44 0.02 0.00 -1.51 0.00 0.00 37.83 35.69 1stu s LYS 19 CO 0.26 -0.59 1.35 0.08 -0.36 0.00 0.00 175.35 176.09 1stu s VAL 20 N 2.53 3.78 -0.20 4.02 1.01 -1.26 -0.97 120.40 129.30 1stu s VAL 20 Ca 0.10 0.59 0.21 0.00 0.00 0.00 0.00 61.98 62.88 1stu s VAL 20 Cb -0.15 -4.65 -0.03 0.00 0.00 0.00 0.00 36.38 31.55 1stu s VAL 20 CO -0.15 -1.45 1.00 0.17 0.00 0.00 0.00 175.10 174.67 1stu h LEU 21 N 13.06 0.00 -8.20 3.92 -0.00 -1.90 -3.47 115.31 118.72 1stu h LEU 21 Ca -0.27 0.00 -0.41 0.00 -0.00 0.00 0.00 57.88 57.21 1stu h LEU 21 Cb 1.07 0.00 -0.26 0.00 -0.00 0.00 0.00 40.66 41.48 1stu h LEU 21 CO 1.22 0.18 -0.78 -0.13 -0.00 0.00 0.00 178.44 178.94 1stu s ARG 22 N -3.22 0.82 -0.16 0.17 3.00 -1.16 -5.00 118.95 113.40 1stu s ARG 22 Ca -0.01 -0.61 -0.02 0.00 0.00 0.00 0.00 55.73 55.10 1stu s ARG 22 Cb 0.09 -0.78 0.05 0.00 0.00 0.00 0.00 34.95 34.31 1stu s ARG 22 CO 0.79 0.20 0.00 -1.21 0.00 0.00 0.00 175.30 175.08 1stu s GLU 23 N -0.86 0.88 -0.82 3.54 2.02 -1.26 -1.39 118.70 120.81 1stu s GLU 23 Ca 0.01 -0.35 -0.18 0.00 0.02 0.00 0.00 54.97 54.47 1stu s GLU 23 Cb -0.07 -1.85 0.03 0.00 0.10 0.00 0.00 34.13 32.34 1stu s GLU 23 CO 0.01 -0.51 0.49 -0.85 0.02 0.00 0.00 175.26 174.41 1stu n GLU 24 N 5.01 -0.65 0.00 1.61 -0.00 0.36 -4.41 120.64 122.57 1stu n GLU 24 Ca -0.09 0.11 0.00 0.00 -0.00 0.00 0.00 57.16 57.18 1stu n GLU 24 Cb 0.48 -1.59 0.00 0.00 -0.00 0.00 0.00 31.44 30.32 1stu n GLU 24 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1stu n GLY 25 N -1.67 1.38 0.11 -1.84 0.00 -1.21 -3.03 105.19 98.92 1stu n GLY 25 Ca -0.13 -0.35 -0.04 0.00 0.00 0.00 0.00 46.02 45.50 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 0.00 -0.27 -0.62 1.61 0.11 -1.98 -3.45 132.00 127.41 1stu h PRO 26 Ca 0.00 0.02 -0.06 0.00 0.11 0.00 0.00 66.00 66.07 1stu h PRO 26 Cb 0.00 0.06 -0.16 0.00 0.11 0.00 0.00 31.00 31.01 1stu h PRO 26 CO 0.00 -0.18 -0.32 0.00 -0.21 0.00 0.00 178.00 177.30 1stu s ALA 27 N -3.60 -3.25 -0.16 -0.75 0.00 -1.17 -5.00 121.76 107.84 1stu s ALA 27 Ca -0.04 0.13 0.10 0.00 0.00 0.00 0.00 51.96 52.15 1stu s ALA 27 Cb 0.00 -2.85 0.25 0.00 0.00 0.00 0.00 23.12 20.53 1stu s ALA 27 CO 0.12 -2.37 1.25 0.72 0.00 0.00 0.00 175.76 175.48 1stu n HIS 28 N 2.92 -0.75 -2.58 0.00 8.25 -1.19 -4.97 115.22 116.90 1stu n HIS 28 Ca 0.14 -1.14 -0.02 0.00 -0.26 0.00 0.00 57.72 56.44 1stu n HIS 28 Cb 0.60 0.82 -0.00 0.00 1.12 0.00 0.00 29.99 32.53 1stu n HIS 28 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1stu n MET 29 N -0.65 -2.87 0.00 -0.41 0.00 -1.26 -4.84 117.12 107.08 1stu n MET 29 Ca -0.18 0.01 0.00 0.00 0.00 0.00 0.00 57.70 57.53 1stu n MET 29 Cb 0.82 -4.48 0.00 0.00 0.00 0.00 0.00 33.22 29.57 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 -2.56 0.00 -4.26 3.17 5.02 -1.26 -3.58 118.16 114.69 1stu n LYS 30 Ca 0.01 0.00 -0.19 0.00 -2.02 0.00 0.00 58.31 56.11 1stu n LYS 30 Cb 0.49 -0.04 -0.13 0.00 -0.02 0.00 0.00 35.03 35.33 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 -1.60 1.52 -0.27 4.39 0.02 -1.26 0.46 114.94 118.20 1stu s ASN 31 Ca 0.00 -0.49 -0.09 0.00 -1.02 0.00 0.00 52.86 51.26 1stu s ASN 31 Cb 0.00 -0.07 -0.03 0.00 0.02 0.00 0.00 41.25 41.17 1stu s ASN 31 CO 0.00 -0.02 0.12 -0.36 0.02 0.00 0.00 177.10 176.86 1stu s PHE 32 N -0.99 3.14 -0.87 2.20 0.40 -0.02 0.13 117.98 121.97 1stu s PHE 32 Ca -0.01 -0.28 -0.19 0.00 -0.60 0.00 0.00 56.93 55.85 1stu s PHE 32 Cb -0.08 -2.30 0.12 0.00 0.51 0.00 0.00 43.02 41.27 1stu s PHE 32 CO 0.01 -0.31 1.08 0.42 0.70 0.00 0.00 175.22 177.12 1stu s ILE 33 N 1.66 4.67 -0.38 0.64 -1.09 -0.49 0.35 121.20 126.56 1stu s ILE 33 Ca 0.06 -1.36 -0.22 0.00 -2.23 0.00 0.00 60.65 56.91 1stu s ILE 33 Cb -0.16 -4.75 0.01 0.00 -1.58 0.00 0.00 42.46 35.98 1stu s ILE 33 CO 0.06 -1.49 0.70 -0.89 -1.23 0.00 0.00 174.94 172.10 1stu s THR 34 N 2.91 4.80 -0.31 2.92 2.01 -0.42 -2.83 115.64 124.72 1stu s THR 34 Ca 0.30 0.60 -0.29 0.00 0.31 0.00 0.00 61.69 62.61 1stu s THR 34 Cb -0.07 -4.16 0.02 0.00 0.01 0.00 0.00 72.50 68.29 1stu s THR 34 CO -0.06 -0.44 1.07 0.00 -0.69 0.00 0.00 174.62 174.51 1stu s ALA 35 N 2.92 3.51 -0.26 7.40 0.00 -0.14 0.05 121.76 135.23 1stu s ALA 35 Ca 0.27 -0.04 -0.03 0.00 0.00 0.00 0.00 51.96 52.15 1stu s ALA 35 Cb -0.14 -3.67 0.02 0.00 0.00 0.00 0.00 23.12 19.34 1stu s ALA 35 CO 0.17 -1.46 -0.02 0.00 0.00 0.00 0.00 175.76 174.44 1stu s ILE 37 N 1.38 4.08 -0.03 0.00 -1.16 -0.45 -0.49 121.20 124.51 1stu s ILE 37 Ca 0.01 1.73 0.03 0.00 -0.51 0.00 0.00 60.65 61.91 1stu s ILE 37 Cb -0.17 -4.11 0.00 0.00 0.61 0.00 0.00 42.46 38.80 1stu s ILE 37 CO -0.03 0.27 -0.12 0.54 -2.81 0.00 0.00 174.94 172.80 1stu s VAL 38 N -0.02 0.99 0.00 4.00 0.11 -0.36 -2.03 120.40 123.10 1stu s VAL 38 Ca 0.50 -0.47 0.00 0.00 -2.93 0.00 0.00 61.98 59.08 1stu s VAL 38 Cb -0.28 -0.88 0.00 0.00 -1.53 0.00 0.00 36.38 33.70 1stu s VAL 38 CO 0.33 0.30 0.00 0.61 -3.33 0.00 0.00 175.10 173.01 1stu n GLY 39 N 3.30 3.08 0.91 6.54 0.00 -1.19 -0.97 105.19 116.85 1stu n GLY 39 Ca -0.19 0.04 0.09 0.00 0.00 0.00 0.00 46.02 45.97 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 3.49 3.05 -4.36 1.61 7.64 -1.26 -4.12 113.62 119.68 1stu n SER 40 Ca 0.00 -1.89 -0.26 0.00 1.01 0.00 0.00 58.87 57.73 1stu n SER 40 Cb 0.00 -0.20 -0.12 0.00 -1.01 0.00 0.00 64.21 62.88 1stu n SER 40 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 1stu s ILE 41 N -1.27 2.06 0.45 0.44 1.09 -0.15 -5.13 121.20 118.69 1stu s ILE 41 Ca 0.30 -1.78 -0.03 0.00 -1.10 0.00 0.00 60.65 58.05 1stu s ILE 41 Cb 0.18 -1.88 -0.03 0.00 -1.06 0.00 0.00 42.46 39.67 1stu s ILE 41 CO 0.25 -0.05 0.72 -0.69 -0.10 0.00 0.00 174.94 175.06 1stu s VAL 42 N -1.35 4.74 -0.36 2.92 1.01 -1.26 -1.22 120.40 124.87 1stu s VAL 42 Ca 0.13 -0.08 0.04 0.00 0.00 0.00 0.00 61.98 62.07 1stu s VAL 42 Cb -0.09 -3.78 0.16 0.00 0.00 0.00 0.00 36.38 32.67 1stu s VAL 42 CO 0.06 -0.67 0.42 -0.89 0.00 0.00 0.00 175.10 174.02 1stu s THR 43 N -2.63 -0.48 0.36 3.92 2.01 0.35 -4.79 115.64 114.39 1stu s THR 43 Ca 0.46 -0.72 -0.06 0.00 0.31 0.00 0.00 61.69 61.68 1stu s THR 43 Cb -0.10 -0.62 0.08 0.00 0.01 0.00 0.00 72.50 71.87 1stu s THR 43 CO 0.42 -0.45 0.49 -1.84 -0.69 0.00 0.00 174.62 172.55 1stu n GLU 44 N 4.46 -0.40 -3.21 4.92 0.00 -1.26 -1.49 120.64 123.66 1stu n GLU 44 Ca 0.09 -0.81 0.03 0.00 0.00 0.00 0.00 57.16 56.46 1stu n GLU 44 Cb 0.48 -0.49 -0.02 0.00 0.00 0.00 0.00 31.44 31.41 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 -4.03 -0.93 -1.34 -1.84 0.00 0.11 -4.74 107.32 94.54 1stu s GLY 45 Ca 0.28 1.83 -0.17 0.00 0.00 0.00 0.00 44.72 46.67 1stu s GLY 45 CO 0.20 3.30 1.95 -1.84 0.00 0.00 0.00 173.10 176.71 1stu n GLU 46 N 5.43 2.93 -0.74 2.90 0.28 -1.23 -1.30 120.64 128.91 1stu n GLU 46 Ca -0.02 -2.92 -0.34 0.00 -0.16 0.00 0.00 57.16 53.72 1stu n GLU 46 Cb 0.51 -3.40 0.14 0.00 1.43 0.00 0.00 31.44 30.12 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 4.86 -2.61 3.11 -1.84 0.00 0.16 -4.40 105.19 104.47 1stu n GLY 47 Ca 0.50 -0.65 -0.36 0.00 0.00 0.00 0.00 46.02 45.51 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 -1.66 5.21 0.00 1.61 -0.87 -1.26 -0.84 114.94 117.13 1stu s ASN 48 Ca 0.52 -2.19 0.00 0.00 -1.57 0.00 0.00 52.86 49.62 1stu s ASN 48 Cb -0.07 -1.82 0.00 0.00 -0.02 0.00 0.00 41.25 39.34 1stu s ASN 48 CO 0.66 -0.50 0.00 0.61 -2.57 0.00 0.00 177.10 175.30 1stu n GLY 49 N 4.37 0.44 4.04 0.66 0.00 0.17 -4.80 105.19 110.07 1stu n GLY 49 Ca -0.00 -0.54 0.03 0.00 0.00 0.00 0.00 46.02 45.50 1stu n GLY 49 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1stu n LYS 50 N 0.00 -0.39 -1.76 1.61 2.85 -1.26 -3.35 118.16 115.85 1stu n LYS 50 Ca 0.00 0.26 -0.19 0.00 -1.05 0.00 0.00 58.31 57.33 1stu n LYS 50 Cb 0.00 -0.48 -0.07 0.00 -0.65 0.00 0.00 35.03 33.83 1stu n LYS 50 CO 0.00 0.00 0.00 0.21 -0.05 0.00 0.00 177.40 177.56 1stu s LYS 51 N -0.62 1.94 0.00 -1.58 2.47 -1.26 -4.76 119.74 115.93 1stu s LYS 51 Ca 0.00 0.09 0.00 0.00 -1.56 0.00 0.00 55.97 54.50 1stu s LYS 51 Cb 0.00 -4.91 0.00 0.00 -1.46 0.00 0.00 37.83 31.46 1stu s LYS 51 CO 0.00 -4.13 0.00 1.55 0.16 0.00 0.00 175.35 172.93 1stu n VAL 52 N 8.45 0.00 0.00 4.02 3.14 -1.21 -4.87 118.33 127.86 1stu n VAL 52 Ca 0.44 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.82 1stu n VAL 52 Cb 0.45 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.23 1stu n VAL 52 CO 0.00 0.00 0.00 -1.54 -6.46 0.00 0.00 176.83 168.83 1stu n SER 53 N 0.00 0.00 -0.04 6.55 3.41 -1.26 -4.43 113.62 117.84 1stu n SER 53 Ca 0.00 0.00 -0.15 0.00 -0.26 0.00 0.00 58.87 58.46 1stu n SER 53 Cb 0.00 0.00 -0.13 0.00 -0.26 0.00 0.00 64.21 63.82 1stu n SER 53 CO 0.00 0.00 0.00 0.07 -0.16 0.00 0.00 175.04 174.95 1stu h LYS 54 N 0.00 0.06 -0.00 4.33 2.10 -1.92 -0.54 116.57 120.61 1stu h LYS 54 Ca 0.00 -0.11 -0.09 0.00 -2.00 0.00 0.00 60.65 58.45 1stu h LYS 54 Cb 0.00 0.04 -0.01 0.00 -0.90 0.00 0.00 32.23 31.36 1stu h LYS 54 CO 0.00 1.05 -0.43 0.87 -2.00 0.00 0.00 179.45 178.94 1stu h LYS 55 N -0.87 0.00 0.20 0.07 1.57 -1.90 -1.73 116.57 113.93 1stu h LYS 55 Ca -0.03 -0.00 -0.32 0.00 -1.87 0.00 0.00 60.65 58.43 1stu h LYS 55 Cb 1.14 -0.00 0.03 0.00 0.08 0.00 0.00 32.23 33.48 1stu h LYS 55 CO 0.03 0.43 -1.38 0.00 -0.57 0.00 0.00 179.45 177.96 1stu h ARG 56 N 0.00 0.50 -0.05 3.15 2.47 -1.87 -1.27 114.38 117.32 1stu h ARG 56 Ca -0.00 -0.81 -0.00 0.00 -1.26 0.00 0.00 59.98 57.90 1stu h ARG 56 Cb 0.76 0.29 -0.00 0.00 -1.65 0.00 0.00 29.97 29.37 1stu h ARG 56 CO 0.06 1.38 0.02 0.00 0.56 0.00 0.00 179.97 181.99 1stu h ALA 57 N 0.28 0.06 0.36 0.04 0.00 -0.93 -0.64 119.26 118.42 1stu h ALA 57 Ca -0.22 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.60 1stu h ALA 57 Cb 2.07 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.85 1stu h ALA 57 CO 0.25 -0.37 -0.17 0.00 0.00 0.00 0.00 179.25 178.97 1stu h ALA 58 N 0.87 -0.48 -0.89 0.00 0.00 -1.40 0.70 119.26 118.06 1stu h ALA 58 Ca 0.02 -0.17 0.21 0.00 0.00 0.00 0.00 54.91 54.96 1stu h ALA 58 Cb 0.15 0.19 -0.12 0.00 0.00 0.00 0.00 17.79 18.00 1stu h ALA 58 CO -0.00 -0.64 0.39 0.93 0.00 0.00 0.00 179.25 179.93 1stu h GLU 59 N -0.73 0.41 -0.79 0.00 5.08 -1.23 1.01 114.58 118.33 1stu h GLU 59 Ca -0.05 -0.02 -0.04 0.00 -1.00 0.00 0.00 59.36 58.25 1stu h GLU 59 Cb 0.50 -0.09 -0.04 0.00 0.50 0.00 0.00 28.75 29.62 1stu h GLU 59 CO 0.08 0.27 0.34 -0.22 -1.00 0.00 0.00 179.01 178.49 1stu h LYS 60 N 0.42 1.16 0.00 2.33 1.63 -0.82 0.80 116.57 122.09 1stu h LYS 60 Ca 0.55 -0.19 0.00 0.00 -0.85 0.00 0.00 60.65 60.16 1stu h LYS 60 Cb 1.01 -0.20 0.00 0.00 -0.60 0.00 0.00 32.23 32.44 1stu h LYS 60 CO -0.51 0.91 0.00 -0.12 -3.45 0.00 0.00 179.45 176.29 1stu n MET 61 N -4.29 0.00 0.06 1.90 1.56 0.33 -0.57 117.12 116.10 1stu n MET 61 Ca 0.07 0.43 -0.13 0.00 -0.27 0.00 0.00 57.70 57.80 1stu n MET 61 Cb 0.16 -1.28 -0.06 0.00 2.15 0.00 0.00 33.22 34.19 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 -1.22 -1.07 -0.89 3.38 -0.96 0.32 115.31 114.87 1stu h LEU 62 Ca 0.00 0.15 0.28 0.00 0.09 0.00 0.00 57.88 58.40 1stu h LEU 62 Cb 0.00 0.48 -0.13 0.00 0.09 0.00 0.00 40.66 41.10 1stu h LEU 62 CO 0.00 -0.45 0.61 0.58 0.09 0.00 0.00 178.44 179.27 1stu h VAL 63 N -0.56 0.45 0.15 1.22 2.07 -0.95 -1.25 116.25 117.39 1stu h VAL 63 Ca 0.05 -0.16 -0.01 0.00 0.82 0.00 0.00 66.70 67.40 1stu h VAL 63 Cb 0.64 -0.05 0.00 0.00 -1.52 0.00 0.00 31.29 30.36 1stu h VAL 63 CO -0.30 0.08 -0.07 -0.33 0.02 0.00 0.00 177.57 176.97 1stu h GLU 64 N 0.46 -0.20 -1.01 1.57 4.39 0.21 -2.67 114.58 117.34 1stu h GLU 64 Ca 0.67 0.01 0.29 0.00 0.34 0.00 0.00 59.36 60.68 1stu h GLU 64 Cb 1.45 0.05 -0.04 0.00 -0.10 0.00 0.00 28.75 30.11 1stu h GLU 64 CO -0.49 -0.13 0.85 1.37 -1.16 0.00 0.00 179.01 179.45 1stu h LEU 65 N -0.22 0.00 -0.33 1.33 -0.00 -0.59 0.85 115.31 116.34 1stu h LEU 65 Ca -0.02 0.00 0.06 0.00 -0.00 0.00 0.00 57.88 57.92 1stu h LEU 65 Cb 0.16 0.00 -0.06 0.00 -0.00 0.00 0.00 40.66 40.76 1stu h LEU 65 CO 0.03 0.00 -0.04 1.56 -0.00 0.00 0.00 178.44 180.00 1stu h GLN 66 N 0.00 0.05 0.06 0.17 1.08 -0.88 -2.73 115.11 112.86 1stu h GLN 66 Ca 0.48 -0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 57.67 1stu h GLN 66 Cb 2.18 -0.01 0.00 0.00 -0.05 0.00 0.00 27.48 29.60 1stu h GLN 66 CO -0.01 0.03 -0.03 0.87 -0.95 0.00 0.00 178.83 178.75 1stu h LYS 67 N 0.05 -0.08 0.00 1.46 6.56 -0.84 -3.52 116.57 120.20 1stu h LYS 67 Ca 0.16 0.01 0.00 0.00 -1.06 0.00 0.00 60.65 59.76 1stu h LYS 67 Cb 0.24 0.02 0.00 0.00 -0.57 0.00 0.00 32.23 31.91 1stu h LYS 67 CO -0.31 0.37 0.00 1.28 -2.06 0.00 0.00 179.45 178.73