#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 1.47 -0.95 0.52 1.08 -1.96 -3.00 117.51 114.66 1stu h ILE 2 Ca 0.00 -1.82 0.19 0.00 -0.39 0.00 0.00 64.86 62.83 1stu h ILE 2 Cb 0.00 2.64 -0.08 0.00 -3.07 0.00 0.00 36.82 36.31 1stu h ILE 2 CO 0.00 0.45 0.61 -1.28 -0.69 0.00 0.00 178.15 177.23 1stu h SER 3 N -0.86 0.62 0.31 1.72 0.87 -2.01 -0.11 113.55 114.10 1stu h SER 3 Ca -0.00 0.06 -0.02 0.00 -1.23 0.00 0.00 61.79 60.61 1stu h SER 3 Cb 0.75 -0.05 0.00 0.00 -0.44 0.00 0.00 62.40 62.67 1stu h SER 3 CO 0.00 0.25 -0.15 1.56 -0.53 0.00 0.00 176.83 177.96 1stu h GLN 4 N 0.62 -0.41 0.10 2.24 4.20 -1.99 -0.05 115.11 119.82 1stu h GLN 4 Ca 0.51 0.03 -0.00 0.00 0.06 0.00 0.00 58.65 59.25 1stu h GLN 4 Cb 0.98 0.09 -0.00 0.00 0.30 0.00 0.00 27.48 28.85 1stu h GLN 4 CO -0.27 -0.17 -0.11 0.28 -0.67 0.00 0.00 178.83 177.90 1stu h VAL 5 N -0.58 0.00 -0.94 -0.54 2.07 -1.07 0.14 116.25 115.34 1stu h VAL 5 Ca -0.04 0.00 0.37 0.00 0.82 0.00 0.00 66.70 67.85 1stu h VAL 5 Cb 0.42 0.00 -0.14 0.00 -1.52 0.00 0.00 31.29 30.05 1stu h VAL 5 CO 0.07 0.00 0.54 1.41 0.02 0.00 0.00 177.57 179.61 1stu n HIS 6 N -2.94 0.88 0.42 1.57 8.25 -0.18 0.33 115.22 123.54 1stu n HIS 6 Ca -0.03 0.88 -0.16 0.00 -0.26 0.00 0.00 57.72 58.16 1stu n HIS 6 Cb 0.10 -1.30 -0.08 0.00 1.12 0.00 0.00 29.99 29.83 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 -1.02 0.04 -0.41 5.08 0.97 -1.82 114.58 117.42 1stu h GLU 7 Ca 0.73 0.07 -0.00 0.00 -1.00 0.00 0.00 59.36 59.15 1stu h GLU 7 Cb 2.04 0.23 0.00 0.00 0.50 0.00 0.00 28.75 31.53 1stu h GLU 7 CO -0.58 -0.68 -0.02 -0.84 -1.00 0.00 0.00 179.01 175.89 1stu h ILE 8 N -1.06 1.34 -0.73 3.13 -0.00 0.52 0.41 117.51 121.12 1stu h ILE 8 Ca -0.11 -1.52 0.13 0.00 -0.00 0.00 0.00 64.86 63.37 1stu h ILE 8 Cb 0.81 2.30 -0.14 0.00 -0.00 0.00 0.00 36.82 39.79 1stu h ILE 8 CO 0.18 0.37 -0.28 1.23 -0.00 0.00 0.00 178.15 179.64 1stu h GLY 9 N -0.76 0.20 1.40 0.16 0.00 -0.23 0.11 103.07 103.95 1stu h GLY 9 Ca -0.01 0.37 -0.28 0.00 0.00 0.00 0.00 47.33 47.42 1stu h GLY 9 CO 0.01 -0.24 -1.19 -2.22 0.00 0.00 0.00 176.54 172.89 1stu h ILE 10 N -0.07 1.36 0.00 2.60 1.08 -0.97 2.32 117.51 123.83 1stu h ILE 10 Ca 0.31 -2.61 0.00 0.00 -0.39 0.00 0.00 64.86 62.17 1stu h ILE 10 Cb 0.57 2.71 0.00 0.00 -3.07 0.00 0.00 36.82 37.03 1stu h ILE 10 CO -0.78 0.78 0.00 0.11 -0.69 0.00 0.00 178.15 177.57 1stu h LYS 11 N 0.21 0.00 0.00 2.37 1.79 0.94 -3.19 116.57 118.69 1stu h LYS 11 Ca -0.16 0.00 -0.08 0.00 -2.18 0.00 0.00 60.65 58.24 1stu h LYS 11 Cb 1.87 0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 32.51 1stu h LYS 11 CO 0.22 0.00 -1.28 -2.13 -1.08 0.00 0.00 179.45 175.18 1stu n ARG 12 N -2.58 0.12 0.00 3.15 3.00 0.19 -5.02 116.66 115.51 1stu n ARG 12 Ca -0.02 0.04 0.00 0.00 -0.00 0.00 0.00 57.85 57.87 1stu n ARG 12 Cb 0.06 -0.93 0.00 0.00 0.00 0.00 0.00 32.46 31.60 1stu n ARG 12 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.63 177.72 1stu n ASN 13 N -2.88 0.00 -4.61 6.15 4.13 -0.29 -5.10 115.26 112.66 1stu n ASN 13 Ca -0.09 0.00 -0.43 0.00 1.68 0.00 0.00 54.58 55.74 1stu n ASN 13 Cb 0.58 0.00 -0.02 0.00 -1.54 0.00 0.00 39.78 38.80 1stu n ASN 13 CO 0.00 0.00 0.00 -0.04 0.28 0.00 0.00 177.26 177.50 1stu s MET 14 N 0.00 3.61 0.01 3.52 -1.94 0.77 -4.38 119.30 120.88 1stu s MET 14 Ca 0.00 1.28 -0.30 0.00 -1.71 0.00 0.00 55.69 54.96 1stu s MET 14 Cb 0.00 -4.06 -0.07 0.00 2.01 0.00 0.00 34.83 32.71 1stu s MET 14 CO 0.00 -1.52 1.71 0.95 -0.01 0.00 0.00 175.02 176.15 1stu s THR 15 N 5.63 3.28 -0.41 2.05 -4.23 -1.25 -2.42 115.64 118.30 1stu s THR 15 Ca 0.68 0.50 -0.16 0.00 -1.18 0.00 0.00 61.69 61.53 1stu s THR 15 Cb -0.19 -3.32 0.02 0.00 1.34 0.00 0.00 72.50 70.34 1stu s THR 15 CO 0.31 -0.03 0.37 -0.69 -0.54 0.00 0.00 174.62 174.04 1stu s VAL 16 N 3.61 5.17 -0.34 2.29 1.01 -1.24 -2.56 120.40 128.35 1stu s VAL 16 Ca 0.76 -0.43 -0.01 0.00 0.00 0.00 0.00 61.98 62.30 1stu s VAL 16 Cb -0.37 -3.96 0.12 0.00 0.00 0.00 0.00 36.38 32.16 1stu s VAL 16 CO 0.33 -0.33 0.16 -1.00 0.00 0.00 0.00 175.10 174.26 1stu s HIS 17 N 1.93 1.02 0.13 5.22 3.76 -0.80 -4.86 115.29 121.69 1stu s HIS 17 Ca 0.09 -1.54 -0.30 0.00 -0.15 0.00 0.00 55.06 53.16 1stu s HIS 17 Cb -0.18 -1.25 -0.06 0.00 1.11 0.00 0.00 32.58 32.20 1stu s HIS 17 CO 0.12 -0.83 1.00 -0.06 -0.85 0.00 0.00 174.74 174.12 1stu s PHE 18 N 1.42 3.76 -0.23 1.40 0.40 -1.26 -1.51 117.98 121.95 1stu s PHE 18 Ca 0.13 1.74 -0.03 0.00 -0.60 0.00 0.00 56.93 58.18 1stu s PHE 18 Cb -0.20 -3.12 0.13 0.00 0.51 0.00 0.00 43.02 40.34 1stu s PHE 18 CO -0.17 -0.02 0.35 0.15 0.70 0.00 0.00 175.22 176.23 1stu s LYS 19 N -0.14 0.32 -0.25 0.44 1.02 0.18 -4.98 119.74 116.32 1stu s LYS 19 Ca 0.47 0.51 -0.29 0.00 0.02 0.00 0.00 55.97 56.68 1stu s LYS 19 Cb -0.25 -0.55 0.01 0.00 -0.52 0.00 0.00 37.83 36.51 1stu s LYS 19 CO 0.31 -0.63 1.12 0.08 -0.92 0.00 0.00 175.35 175.32 1stu s VAL 20 N 2.51 4.49 -0.12 3.17 1.01 -1.26 -0.95 120.40 129.25 1stu s VAL 20 Ca 0.11 1.77 0.02 0.00 0.00 0.00 0.00 61.98 63.88 1stu s VAL 20 Cb -0.15 -4.26 0.05 0.00 0.00 0.00 0.00 36.38 32.01 1stu s VAL 20 CO -0.15 -0.29 1.04 0.00 0.00 0.00 0.00 175.10 175.69 1stu n LEU 21 N 6.68 2.14 -4.18 3.92 -0.00 -1.20 -4.93 117.00 119.42 1stu n LEU 21 Ca 0.13 -2.03 -0.11 0.00 -0.00 0.00 0.00 56.01 54.00 1stu n LEU 21 Cb 0.46 -0.04 -0.10 0.00 -0.00 0.00 0.00 43.42 43.74 1stu n LEU 21 CO 0.56 0.54 -0.28 -0.13 -0.00 0.00 0.00 177.39 178.08 1stu s ARG 22 N -1.05 1.05 -0.34 1.47 0.52 -1.23 -4.95 118.95 114.42 1stu s ARG 22 Ca 0.04 -1.52 0.13 0.00 -0.52 0.00 0.00 55.73 53.86 1stu s ARG 22 Cb 0.02 0.17 0.42 0.00 0.52 0.00 0.00 34.95 36.08 1stu s ARG 22 CO 0.02 -0.29 1.43 0.39 0.02 0.00 0.00 175.30 176.88 1stu n GLU 23 N -0.18 1.36 -1.65 3.54 1.02 -1.26 -4.10 120.64 119.37 1stu n GLU 23 Ca -0.03 -1.69 0.00 0.00 -0.02 0.00 0.00 57.16 55.42 1stu n GLU 23 Cb 0.64 0.03 0.00 0.00 -0.02 0.00 0.00 31.44 32.09 1stu n GLU 23 CO 0.00 0.00 0.00 -0.85 1.18 0.00 0.00 177.13 177.46 1stu n GLU 24 N -1.18 0.00 0.00 3.49 0.28 0.20 -4.70 120.64 118.72 1stu n GLU 24 Ca -0.11 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.89 1stu n GLU 24 Cb 0.86 0.00 0.00 0.00 1.43 0.00 0.00 31.44 33.73 1stu n GLU 24 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1stu n GLY 25 N 0.00 5.45 0.41 -1.84 0.00 -1.16 -3.87 105.19 104.18 1stu n GLY 25 Ca 0.00 -1.17 -0.16 0.00 0.00 0.00 0.00 46.02 44.69 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 -1.00 0.00 1.61 0.11 -1.97 -3.44 132.00 127.30 1stu h PRO 26 Ca 0.00 0.07 -0.05 0.00 0.11 0.00 0.00 66.00 66.13 1stu h PRO 26 Cb 0.00 0.23 -0.04 0.00 0.11 0.00 0.00 31.00 31.30 1stu h PRO 26 CO 0.00 -0.67 -0.06 0.00 -0.21 0.00 0.00 178.00 177.06 1stu n ALA 27 N -2.54 -0.75 0.00 -0.75 0.00 -1.26 -5.06 120.51 110.15 1stu n ALA 27 Ca -0.13 -0.27 0.00 0.00 0.00 0.00 0.00 53.44 53.04 1stu n ALA 27 Cb 0.41 -0.60 0.00 0.00 0.00 0.00 0.00 19.45 19.26 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 -0.42 0.00 0.00 0.00 -0.00 -1.26 -5.15 115.22 108.40 1stu n HIS 28 Ca -0.05 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.67 1stu n HIS 28 Cb 0.60 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.59 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 0.00 0.00 -1.99 -1.40 2.00 -1.26 -5.01 117.12 109.46 1stu n MET 29 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 57.70 57.45 1stu n MET 29 Cb 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 33.22 33.16 1stu n MET 29 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 175.97 176.12 1stu s LYS 30 N 0.00 2.33 -0.11 0.03 3.01 -1.26 -3.00 119.74 120.74 1stu s LYS 30 Ca 0.00 -0.68 0.03 0.00 -1.01 0.00 0.00 55.97 54.32 1stu s LYS 30 Cb 0.00 -5.12 0.00 0.00 -1.01 0.00 0.00 37.83 31.70 1stu s LYS 30 CO 0.00 -3.94 -0.23 -0.80 0.51 0.00 0.00 175.35 170.89 1stu s ASN 31 N 7.52 3.08 -0.22 2.83 0.01 -1.25 0.39 114.94 127.30 1stu s ASN 31 Ca 0.72 -0.57 -0.10 0.00 -0.71 0.00 0.00 52.86 52.19 1stu s ASN 31 Cb -0.04 -1.42 -0.05 0.00 0.41 0.00 0.00 41.25 40.15 1stu s ASN 31 CO 0.08 0.13 0.15 -0.36 -1.51 0.00 0.00 177.10 175.60 1stu s PHE 32 N 0.52 3.36 -0.73 2.20 0.40 -0.58 -0.63 117.98 122.52 1stu s PHE 32 Ca -0.15 0.28 -0.21 0.00 -0.60 0.00 0.00 56.93 56.25 1stu s PHE 32 Cb -0.17 -2.23 0.09 0.00 0.51 0.00 0.00 43.02 41.22 1stu s PHE 32 CO 0.05 0.16 0.99 0.42 0.70 0.00 0.00 175.22 177.54 1stu s ILE 33 N 0.77 4.46 -0.29 0.64 1.09 -1.26 -0.56 121.20 126.05 1stu s ILE 33 Ca 0.08 -0.72 -0.24 0.00 -1.10 0.00 0.00 60.65 58.67 1stu s ILE 33 Cb -0.13 -4.70 -0.00 0.00 -1.06 0.00 0.00 42.46 36.57 1stu s ILE 33 CO 0.02 -1.45 0.80 -0.89 -0.10 0.00 0.00 174.94 173.31 1stu s THR 34 N 3.63 4.81 -0.37 2.92 2.01 -0.20 -3.24 115.64 125.20 1stu s THR 34 Ca 0.24 1.30 -0.27 0.00 0.31 0.00 0.00 61.69 63.27 1stu s THR 34 Cb -0.14 -4.13 0.02 0.00 0.01 0.00 0.00 72.50 68.25 1stu s THR 34 CO 0.05 -0.20 1.01 0.00 -0.69 0.00 0.00 174.62 174.79 1stu s ALA 35 N 2.92 3.40 -0.30 7.40 0.00 -0.12 -0.06 121.76 135.01 1stu s ALA 35 Ca 0.33 -0.31 -0.06 0.00 0.00 0.00 0.00 51.96 51.93 1stu s ALA 35 Cb -0.14 -3.64 0.02 0.00 0.00 0.00 0.00 23.12 19.36 1stu s ALA 35 CO 0.11 -1.65 0.06 0.00 0.00 0.00 0.00 175.76 174.27 1stu s ILE 37 N 1.43 4.03 0.04 0.00 -1.16 -0.57 -0.46 121.20 124.50 1stu s ILE 37 Ca 0.00 1.96 0.04 0.00 -0.51 0.00 0.00 60.65 62.15 1stu s ILE 37 Cb -0.18 -4.25 -0.02 0.00 0.61 0.00 0.00 42.46 38.62 1stu s ILE 37 CO 0.01 0.43 -0.13 0.54 -2.81 0.00 0.00 174.94 172.99 1stu s VAL 38 N -0.94 0.98 0.00 4.00 0.11 -0.38 -1.91 120.40 122.27 1stu s VAL 38 Ca 0.43 -0.99 0.00 0.00 -2.93 0.00 0.00 61.98 58.49 1stu s VAL 38 Cb -0.27 -0.91 0.00 0.00 -1.53 0.00 0.00 36.38 33.67 1stu s VAL 38 CO 0.33 -0.07 0.00 0.61 -3.33 0.00 0.00 175.10 172.64 1stu n GLY 39 N 1.84 1.96 0.07 6.54 0.00 -1.20 -0.82 105.19 113.58 1stu n GLY 39 Ca -0.19 0.50 0.01 0.00 0.00 0.00 0.00 46.02 46.34 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 4.34 1.40 -4.41 1.61 7.64 -1.26 -3.83 113.62 119.12 1stu n SER 40 Ca 0.00 -1.32 -0.26 0.00 1.01 0.00 0.00 58.87 58.30 1stu n SER 40 Cb 0.00 -0.01 -0.12 0.00 -1.01 0.00 0.00 64.21 63.07 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 -0.37 2.27 0.44 0.44 1.09 0.00 -5.13 121.20 119.93 1stu s ILE 41 Ca 0.02 -2.00 -0.03 0.00 -1.10 0.00 0.00 60.65 57.54 1stu s ILE 41 Cb 0.01 -2.07 -0.03 0.00 -1.06 0.00 0.00 42.46 39.31 1stu s ILE 41 CO 0.02 -0.14 0.70 -0.69 -0.10 0.00 0.00 174.94 174.74 1stu s VAL 42 N -1.69 4.92 -0.38 2.92 1.01 -1.26 -1.25 120.40 124.67 1stu s VAL 42 Ca 0.20 -0.06 0.04 0.00 0.00 0.00 0.00 61.98 62.16 1stu s VAL 42 Cb -0.08 -3.84 0.16 0.00 0.00 0.00 0.00 36.38 32.62 1stu s VAL 42 CO 0.09 -0.73 0.42 -0.89 0.00 0.00 0.00 175.10 174.00 1stu s THR 43 N -2.59 -0.46 0.28 3.92 2.01 0.39 -4.81 115.64 114.37 1stu s THR 43 Ca 0.45 -0.79 -0.04 0.00 0.31 0.00 0.00 61.69 61.61 1stu s THR 43 Cb -0.10 -0.56 0.06 0.00 0.01 0.00 0.00 72.50 71.91 1stu s THR 43 CO 0.42 -0.47 0.38 -0.62 -0.69 0.00 0.00 174.62 173.63 1stu n GLU 44 N 4.31 -0.31 -3.41 4.92 1.02 -1.26 -1.51 120.64 124.41 1stu n GLU 44 Ca 0.11 -0.61 0.01 0.00 -0.02 0.00 0.00 57.16 56.65 1stu n GLU 44 Cb 0.47 -0.38 -0.04 0.00 -0.02 0.00 0.00 31.44 31.48 1stu n GLU 44 CO 0.00 0.00 0.00 0.20 1.18 0.00 0.00 177.13 178.51 1stu s GLY 45 N -3.78 -0.24 -0.96 0.62 0.00 0.92 -4.74 107.32 99.14 1stu s GLY 45 Ca 0.22 2.98 -0.24 0.00 0.00 0.00 0.00 44.72 47.68 1stu s GLY 45 CO 0.15 3.25 1.40 -0.54 0.00 0.00 0.00 173.10 177.36 1stu s GLU 46 N 2.50 3.51 -0.23 2.90 8.01 -1.25 -1.03 118.70 133.11 1stu s GLU 46 Ca -0.02 -0.97 -0.28 0.00 0.01 0.00 0.00 54.97 53.71 1stu s GLU 46 Cb -0.07 -5.11 0.01 0.00 -4.31 0.00 0.00 34.13 24.65 1stu s GLU 46 CO -0.17 -2.18 0.99 0.20 0.01 0.00 0.00 175.26 174.10 1stu s GLY 47 N 4.69 1.75 -0.47 -1.39 0.00 0.27 -4.69 107.32 107.48 1stu s GLY 47 Ca 0.43 0.12 -0.26 0.00 0.00 0.00 0.00 44.72 45.00 1stu s GLY 47 CO -0.05 2.08 2.31 0.21 0.00 0.00 0.00 173.10 177.66 1stu s ASN 48 N 1.23 4.67 0.00 1.64 2.47 -1.26 -1.52 114.94 122.17 1stu s ASN 48 Ca 0.42 1.10 0.00 0.00 0.42 0.00 0.00 52.86 54.80 1stu s ASN 48 Cb -0.15 -2.51 0.00 0.00 -1.45 0.00 0.00 41.25 37.14 1stu s ASN 48 CO 0.07 -2.70 0.00 0.61 -3.72 0.00 0.00 177.10 171.36 1stu n GLY 49 N 5.93 1.57 0.13 1.21 0.00 0.16 -4.71 105.19 109.48 1stu n GLY 49 Ca 0.34 -2.01 -0.24 0.00 0.00 0.00 0.00 46.02 44.11 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 -1.68 0.62 0.00 1.61 2.85 -1.26 -3.68 118.16 116.62 1stu n LYS 50 Ca 0.00 0.36 0.13 0.00 -1.05 0.00 0.00 58.31 57.75 1stu n LYS 50 Cb 0.00 -1.63 0.48 0.00 -0.65 0.00 0.00 35.03 33.22 1stu n LYS 50 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 177.40 178.52 1stu n LYS 51 N -4.01 0.04 0.08 -1.58 4.81 -1.26 -3.69 118.16 112.54 1stu n LYS 51 Ca -0.41 -0.01 -0.22 0.00 -0.87 0.00 0.00 58.31 56.80 1stu n LYS 51 Cb 0.86 -1.50 -0.15 0.00 0.02 0.00 0.00 35.03 34.26 1stu n LYS 51 CO 0.00 0.00 0.00 -0.24 1.17 0.00 0.00 177.40 178.33 1stu h VAL 52 N 0.03 0.99 -1.55 3.15 3.04 -1.84 -3.34 116.25 116.73 1stu h VAL 52 Ca 0.00 -2.57 0.45 0.00 -1.01 0.00 0.00 66.70 63.57 1stu h VAL 52 Cb 0.49 2.79 -0.06 0.00 -2.01 0.00 0.00 31.29 32.50 1stu h VAL 52 CO 0.00 0.85 1.12 -0.24 -1.01 0.00 0.00 177.57 178.29 1stu n SER 53 N -3.58 0.00 -0.05 3.17 2.88 -1.24 0.12 113.62 114.92 1stu n SER 53 Ca -0.23 0.78 -0.14 0.00 -1.33 0.00 0.00 58.87 57.95 1stu n SER 53 Cb 1.08 -0.39 -0.12 0.00 -0.75 0.00 0.00 64.21 64.03 1stu n SER 53 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 1stu h LYS 54 N 0.00 0.02 -0.44 -1.46 1.57 -1.81 -0.88 116.57 113.57 1stu h LYS 54 Ca 0.74 -0.03 -0.05 0.00 -1.87 0.00 0.00 60.65 59.44 1stu h LYS 54 Cb 2.97 0.01 -0.02 0.00 0.08 0.00 0.00 32.23 35.27 1stu h LYS 54 CO -0.01 0.83 0.07 -0.22 -0.57 0.00 0.00 179.45 179.56 1stu h LYS 55 N -0.78 0.68 0.06 3.15 3.64 0.72 -1.50 116.57 122.54 1stu h LYS 55 Ca -0.00 -0.14 -0.28 0.00 -1.27 0.00 0.00 60.65 58.96 1stu h LYS 55 Cb 0.84 -0.10 0.03 0.00 -0.41 0.00 0.00 32.23 32.59 1stu h LYS 55 CO 0.01 0.64 -1.11 -0.09 -2.27 0.00 0.00 179.45 176.63 1stu h ARG 56 N 0.65 0.65 0.15 1.90 9.65 -1.25 -1.29 114.38 124.84 1stu h ARG 56 Ca 0.14 -0.78 -0.01 0.00 -1.10 0.00 0.00 59.98 58.24 1stu h ARG 56 Cb 0.30 0.24 0.00 0.00 -1.39 0.00 0.00 29.97 29.12 1stu h ARG 56 CO 0.00 1.34 -0.07 0.00 2.80 0.00 0.00 179.97 184.04 1stu h ALA 57 N 0.34 -0.21 0.55 2.80 0.00 -0.97 -0.89 119.26 120.88 1stu h ALA 57 Ca -0.16 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.64 1stu h ALA 57 Cb 1.78 0.08 0.01 0.00 0.00 0.00 0.00 17.79 19.66 1stu h ALA 57 CO 0.22 -0.57 -0.27 0.00 0.00 0.00 0.00 179.25 178.63 1stu h ALA 58 N 0.54 -0.74 -0.88 0.00 0.00 -1.36 -0.34 119.26 116.48 1stu h ALA 58 Ca -0.02 -0.19 0.23 0.00 0.00 0.00 0.00 54.91 54.93 1stu h ALA 58 Cb 0.23 0.29 -0.13 0.00 0.00 0.00 0.00 17.79 18.18 1stu h ALA 58 CO 0.03 -0.84 0.31 0.93 0.00 0.00 0.00 179.25 179.69 1stu h GLU 59 N -0.89 0.29 -0.69 0.00 5.08 -1.24 1.00 114.58 118.13 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 0.62 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.77 1stu h GLU 59 CO 0.12 0.19 0.46 0.87 -1.00 0.00 0.00 179.01 179.65 1stu h LYS 60 N 0.30 0.90 0.00 2.33 1.79 -0.78 0.11 116.57 121.21 1stu h LYS 60 Ca 0.55 -0.05 0.00 0.00 -2.18 0.00 0.00 60.65 58.97 1stu h LYS 60 Cb 1.09 -0.20 0.00 0.00 -1.58 0.00 0.00 32.23 31.54 1stu h LYS 60 CO -0.59 0.60 0.00 -0.12 -1.08 0.00 0.00 179.45 178.26 1stu n MET 61 N -4.61 0.00 -0.04 3.15 1.56 0.32 -0.24 117.12 117.26 1stu n MET 61 Ca 0.06 0.48 -0.11 0.00 -0.27 0.00 0.00 57.70 57.86 1stu n MET 61 Cb 0.02 -1.35 -0.07 0.00 2.15 0.00 0.00 33.22 33.96 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 -1.32 -1.17 -0.89 3.38 -0.90 0.86 115.31 115.27 1stu h LEU 62 Ca 0.00 0.16 0.35 0.00 0.09 0.00 0.00 57.88 58.48 1stu h LEU 62 Cb 0.00 0.52 -0.14 0.00 0.09 0.00 0.00 40.66 41.14 1stu h LEU 62 CO 0.00 -0.34 0.66 0.58 0.09 0.00 0.00 178.44 179.43 1stu h VAL 63 N -0.39 0.26 0.58 1.22 2.07 -0.88 1.00 116.25 120.10 1stu h VAL 63 Ca 0.03 -0.08 -0.02 0.00 0.82 0.00 0.00 66.70 67.45 1stu h VAL 63 Cb 0.49 -0.01 -0.01 0.00 -1.52 0.00 0.00 31.29 30.24 1stu h VAL 63 CO -0.36 0.05 -0.37 -0.33 0.02 0.00 0.00 177.57 176.57 1stu h GLU 64 N 0.25 -0.87 -0.37 1.57 3.07 0.39 -3.16 114.58 115.45 1stu h GLU 64 Ca 0.75 0.06 -0.10 0.00 -0.50 0.00 0.00 59.36 59.56 1stu h GLU 64 Cb 1.94 0.20 -0.06 0.00 -0.84 0.00 0.00 28.75 29.99 1stu h GLU 64 CO -0.52 -0.58 0.03 1.47 -1.40 0.00 0.00 179.01 178.01 1stu n LEU 65 N -5.51 4.33 -0.01 1.33 -0.00 -0.13 -4.32 117.00 112.70 1stu n LEU 65 Ca -0.12 -3.32 0.04 0.00 -0.00 0.00 0.00 56.01 52.61 1stu n LEU 65 Cb 0.40 -0.61 -0.07 0.00 -0.00 0.00 0.00 43.42 43.14 1stu n LEU 65 CO 0.34 0.90 -0.61 0.00 -0.00 0.00 0.00 177.39 178.01 1stu n GLN 66 N -0.70 0.36 -0.10 1.47 1.13 0.33 -4.63 117.38 115.23 1stu n GLN 66 Ca 0.29 -0.08 -0.13 0.00 -1.94 0.00 0.00 57.00 55.15 1stu n GLN 66 Cb 1.03 -1.20 -0.15 0.00 0.11 0.00 0.00 30.24 30.03 1stu n GLN 66 CO 0.00 0.00 0.00 1.63 -1.44 0.00 0.00 177.06 177.25 1stu n LYS 67 N -1.82 0.68 0.00 -1.09 4.01 -1.20 -4.99 118.16 113.75 1stu n LYS 67 Ca -0.02 0.08 0.16 0.00 -0.51 0.00 0.00 58.31 58.02 1stu n LYS 67 Cb 0.25 -1.56 0.91 0.00 -0.51 0.00 0.00 35.03 34.12 1stu n LYS 67 CO 0.00 0.00 0.00 1.28 -1.11 0.00 0.00 177.40 177.57