#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u97 s THR 2 N 0.00 4.21 -0.23 3.17 -1.32 -1.26 -5.11 115.64 115.10 1u97 s THR 2 Ca 0.00 -1.05 -0.04 0.00 -1.21 0.00 0.00 61.69 59.39 1u97 s THR 2 Cb 0.00 -3.07 0.12 0.00 -1.51 0.00 0.00 72.50 68.04 1u97 s THR 2 CO 0.00 0.01 0.37 -0.70 -2.21 0.00 0.00 174.62 172.09 1u97 s GLU 3 N -2.67 0.32 0.41 7.08 2.12 -1.26 -5.16 118.70 119.53 1u97 s GLU 3 Ca 0.28 0.60 0.07 0.00 0.36 0.00 0.00 54.97 56.28 1u97 s GLU 3 Cb -0.11 -0.38 0.01 0.00 0.26 0.00 0.00 34.13 33.90 1u97 s GLU 3 CO 0.21 -0.56 0.56 0.95 -0.54 0.00 0.00 175.26 175.88 1u97 s THR 4 N 2.53 3.32 -0.12 -1.70 -4.23 -1.26 -5.05 115.64 109.14 1u97 s THR 4 Ca 0.09 -0.95 0.23 0.00 -1.18 0.00 0.00 61.69 59.88 1u97 s THR 4 Cb -0.15 -3.14 0.45 0.00 1.34 0.00 0.00 72.50 71.01 1u97 s THR 4 CO -0.15 -0.06 1.16 0.47 -0.54 0.00 0.00 174.62 175.50 1u97 n ASP 5 N -1.84 1.46 -0.13 3.99 9.92 -1.26 -4.79 116.55 123.91 1u97 n ASP 5 Ca 0.05 -2.29 0.03 0.00 -0.53 0.00 0.00 54.79 52.05 1u97 n ASP 5 Cb 0.59 -0.38 0.04 0.00 -0.64 0.00 0.00 41.12 40.73 1u97 n ASP 5 CO 0.00 0.00 0.00 2.29 0.13 0.00 0.00 177.20 179.62 1u97 n LYS 6 N -0.06 1.24 0.05 -1.24 2.85 -1.26 -4.60 118.16 115.14 1u97 n LYS 6 Ca 0.10 -1.55 -0.02 0.00 -1.05 0.00 0.00 58.31 55.79 1u97 n LYS 6 Cb 0.99 -0.96 -0.01 0.00 -0.65 0.00 0.00 35.03 34.40 1u97 n LYS 6 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 177.40 178.22 1u97 h LYS 7 N 0.00 -0.12 0.00 -1.58 1.57 -2.04 -3.38 116.57 111.02 1u97 h LYS 7 Ca 0.00 0.01 -0.25 0.00 -1.87 0.00 0.00 60.65 58.54 1u97 h LYS 7 Cb 0.95 0.03 -0.04 0.00 0.08 0.00 0.00 32.23 33.24 1u97 h LYS 7 CO 0.00 -0.08 -1.39 0.37 -0.57 0.00 0.00 179.45 177.78 1u97 h GLN 8 N -0.22 0.00 -6.55 3.15 -0.00 -1.98 -3.45 115.11 106.06 1u97 h GLN 8 Ca -0.01 0.00 -0.52 0.00 -0.00 0.00 0.00 58.65 58.11 1u97 h GLN 8 Cb 0.10 0.00 -0.01 0.00 0.00 0.00 0.00 27.48 27.57 1u97 h GLN 8 CO 0.02 0.67 0.45 -1.21 0.00 0.00 0.00 178.83 178.77 1u97 s GLU 9 N -2.67 4.57 0.00 1.69 0.41 -1.26 -4.86 118.70 116.59 1u97 s GLU 9 Ca -0.02 1.62 0.00 0.00 -0.41 0.00 0.00 54.97 56.16 1u97 s GLU 9 Cb 0.09 -3.35 0.00 0.00 -1.78 0.00 0.00 34.13 29.09 1u97 s GLU 9 CO 0.82 0.00 0.00 0.00 -0.49 0.00 0.00 175.26 175.59 1u97 n GLN 10 N 3.10 0.00 -4.70 1.61 -0.00 -1.26 -4.61 117.38 111.52 1u97 n GLN 10 Ca 0.05 0.00 -0.26 0.00 -0.00 0.00 0.00 57.00 56.79 1u97 n GLN 10 Cb 0.48 -0.20 -0.17 0.00 -0.00 0.00 0.00 30.24 30.35 1u97 n GLN 10 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.06 175.06 1u97 s GLU 11 N 0.00 1.88 0.32 2.61 2.56 -1.26 -5.13 118.70 119.67 1u97 s GLU 11 Ca 0.00 -0.50 -0.27 0.00 0.00 0.00 0.00 54.97 54.20 1u97 s GLU 11 Cb 0.00 -1.53 -0.09 0.00 2.00 0.00 0.00 34.13 34.50 1u97 s GLU 11 CO 0.00 0.08 1.00 1.21 -0.56 0.00 0.00 175.26 176.99 1u97 s ASN 12 N 0.53 7.25 0.69 -1.70 3.04 -1.26 -5.06 114.94 118.44 1u97 s ASN 12 Ca -0.14 1.99 -0.06 0.00 0.04 0.00 0.00 52.86 54.70 1u97 s ASN 12 Cb -0.15 -2.60 0.07 0.00 -1.54 0.00 0.00 41.25 37.03 1u97 s ASN 12 CO 0.04 -0.14 0.99 -1.00 -3.04 0.00 0.00 177.10 173.96 1u97 s HIS 13 N -1.45 2.79 0.72 0.43 3.76 -1.26 -5.06 115.29 115.22 1u97 s HIS 13 Ca 0.49 0.34 -0.13 0.00 -0.15 0.00 0.00 55.06 55.61 1u97 s HIS 13 Cb -0.23 -3.16 0.03 0.00 1.11 0.00 0.00 32.58 30.32 1u97 s HIS 13 CO 0.30 -1.40 1.12 0.00 -0.85 0.00 0.00 174.74 173.90 1u97 s ALA 14 N -3.20 2.30 0.69 -1.40 0.00 -1.26 -5.05 121.76 113.84 1u97 s ALA 14 Ca 0.61 0.49 -0.02 0.00 0.00 0.00 0.00 51.96 53.04 1u97 s ALA 14 Cb -0.10 -3.33 0.09 0.00 0.00 0.00 0.00 23.12 19.78 1u97 s ALA 14 CO 0.44 -1.59 0.96 -1.21 0.00 0.00 0.00 175.76 174.36 1u97 s GLU 15 N -4.37 1.95 0.46 0.00 0.41 -1.26 -4.98 118.70 110.91 1u97 s GLU 15 Ca 0.66 -0.80 0.00 0.00 -0.41 0.00 0.00 54.97 54.42 1u97 s GLU 15 Cb -0.20 -2.31 0.00 0.00 -1.78 0.00 0.00 34.13 29.84 1u97 s GLU 15 CO 0.48 -1.26 0.00 0.00 -0.49 0.00 0.00 175.26 173.98 1u97 s GLU 17 N -3.22 0.08 -0.02 0.00 2.56 -1.26 -5.08 118.70 111.76 1u97 s GLU 17 Ca 0.00 0.14 -0.08 0.00 0.00 0.00 0.00 54.97 55.04 1u97 s GLU 17 Cb 0.00 0.00 -0.04 0.00 2.00 0.00 0.00 34.13 36.09 1u97 s GLU 17 CO 0.00 -0.04 0.51 -0.44 -0.56 0.00 0.00 175.26 174.74 1u97 h ASP 18 N 6.23 -0.23 -3.86 -1.70 5.19 -2.03 -3.41 116.42 116.60 1u97 h ASP 18 Ca -0.28 0.01 -0.64 0.00 -0.62 0.00 0.00 57.03 55.50 1u97 h ASP 18 Cb 1.19 0.06 -0.41 0.00 0.18 0.00 0.00 39.33 40.35 1u97 h ASP 18 CO 0.46 -0.01 -0.59 -1.59 -3.12 0.00 0.00 179.24 174.38 1u97 s LYS 19 N -2.57 2.21 0.04 3.56 -2.85 -1.26 -5.09 119.74 113.78 1u97 s LYS 19 Ca -0.04 -2.92 -0.30 0.00 -1.00 0.00 0.00 55.97 51.70 1u97 s LYS 19 Cb 0.00 -3.39 -0.06 0.00 -2.06 0.00 0.00 37.83 32.32 1u97 s LYS 19 CO 0.12 -1.18 1.43 -1.25 0.10 0.00 0.00 175.35 174.57 1u97 s PRO 20 N -0.77 4.28 -0.39 1.78 0.04 -1.26 -4.01 135.00 134.67 1u97 s PRO 20 Ca 0.20 2.04 -0.08 0.00 0.04 0.00 0.00 61.00 63.20 1u97 s PRO 20 Cb -0.17 -3.50 0.01 0.00 0.04 0.00 0.00 34.50 30.87 1u97 s PRO 20 CO -0.07 -0.56 0.47 1.17 0.04 0.00 0.00 177.00 178.04 1u97 n LYS 21 N 5.08 -1.50 0.00 4.56 4.81 -1.26 -4.89 118.16 124.96 1u97 n LYS 21 Ca 0.13 1.55 0.11 0.00 -0.87 0.00 0.00 58.31 59.23 1u97 n LYS 21 Cb 0.43 -4.60 0.63 0.00 0.02 0.00 0.00 35.03 31.51 1u97 n LYS 21 CO 0.00 0.00 0.00 -0.35 1.17 0.00 0.00 177.40 178.22 1u97 n PRO 22 N -0.75 0.71 0.24 1.64 -0.04 -1.26 -3.02 135.00 132.52 1u97 n PRO 22 Ca 0.06 0.00 0.13 0.00 -0.04 0.00 0.00 63.50 63.65 1u97 n PRO 22 Cb 0.39 -1.47 0.36 0.00 -0.04 0.00 0.00 33.50 32.74 1u97 n PRO 22 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1u97 s VAL 25 N -0.39 0.03 0.00 0.00 -7.23 -1.26 -4.94 120.40 106.61 1u97 s VAL 25 Ca 0.07 -0.03 0.00 0.00 -1.81 0.00 0.00 61.98 60.21 1u97 s VAL 25 Cb -0.12 -0.04 0.00 0.00 0.56 0.00 0.00 36.38 36.78 1u97 s VAL 25 CO 0.02 -0.00 0.30 0.00 -0.31 0.00 0.00 175.10 175.10 1u97 h LYS 27 N 0.00 0.09 -0.67 0.00 1.57 -2.01 -1.72 116.57 113.83 1u97 h LYS 27 Ca -0.03 -0.01 -0.04 0.00 -1.87 0.00 0.00 60.65 58.71 1u97 h LYS 27 Cb 0.58 -0.02 -0.03 0.00 0.08 0.00 0.00 32.23 32.84 1u97 h LYS 27 CO -0.02 0.06 0.27 -1.35 -0.57 0.00 0.00 179.45 177.84 1u97 h PRO 28 N 0.09 0.99 -0.55 3.15 0.11 -2.01 -2.56 132.00 131.21 1u97 h PRO 28 Ca 0.21 -0.16 -0.01 0.00 0.11 0.00 0.00 66.00 66.15 1u97 h PRO 28 Cb 0.31 -0.17 -0.03 0.00 0.11 0.00 0.00 31.00 31.22 1u97 h PRO 28 CO -0.37 0.80 0.32 0.93 -0.21 0.00 0.00 178.00 179.47 1u97 h GLU 29 N 0.97 0.75 -0.24 1.05 3.07 -1.74 -1.94 114.58 116.49 1u97 h GLU 29 Ca 0.23 -0.07 -0.01 0.00 -0.50 0.00 0.00 59.36 59.01 1u97 h GLU 29 Cb 0.19 -0.16 -0.01 0.00 -0.84 0.00 0.00 28.75 27.93 1u97 h GLU 29 CO -0.02 0.55 0.10 0.87 -1.40 0.00 0.00 179.01 179.11 1u97 h LYS 30 N 0.77 0.36 -0.54 2.33 1.57 -0.93 -1.59 116.57 118.54 1u97 h LYS 30 Ca 0.20 -0.06 -0.02 0.00 -1.87 0.00 0.00 60.65 58.90 1u97 h LYS 30 Cb 0.00 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.22 1u97 h LYS 30 CO -0.03 0.39 0.28 1.49 -0.57 0.00 0.00 179.45 181.00 1u97 h GLU 31 N 0.25 0.76 -0.17 3.15 4.81 -1.38 -1.87 114.58 120.13 1u97 h GLU 31 Ca 0.08 -0.10 0.00 0.00 -0.13 0.00 0.00 59.36 59.21 1u97 h GLU 31 Cb 0.16 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 29.39 1u97 h GLU 31 CO -0.01 0.61 0.11 0.93 -0.73 0.00 0.00 179.01 179.92 1u97 h GLU 32 N 0.72 0.21 0.15 1.92 4.39 -1.23 -0.89 114.58 119.87 1u97 h GLU 32 Ca 0.19 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.88 1u97 h GLU 32 Cb 0.08 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.67 1u97 h GLU 32 CO -0.03 0.14 -0.14 -0.09 -1.16 0.00 0.00 179.01 177.73 1u97 h ARG 33 N 0.22 -0.30 -0.99 2.33 2.43 -1.12 -1.67 114.38 115.27 1u97 h ARG 33 Ca 0.06 0.02 0.06 0.00 -0.81 0.00 0.00 59.98 59.31 1u97 h ARG 33 Cb -0.02 0.07 -0.06 0.00 -0.42 0.00 0.00 29.97 29.54 1u97 h ARG 33 CO -0.02 -0.20 0.64 -0.44 -1.51 0.00 0.00 179.97 178.44 1u97 h ASP 34 N -0.31 1.04 -0.84 -3.80 3.32 -1.25 -1.51 116.42 113.07 1u97 h ASP 34 Ca 0.00 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.04 1u97 h ASP 34 Cb 0.29 -0.22 -0.04 0.00 0.22 0.00 0.00 39.33 39.58 1u97 h ASP 34 CO -0.03 0.68 0.47 0.74 -1.72 0.00 0.00 179.24 179.38 1u97 h THR 35 N 1.19 1.24 -0.52 0.35 2.02 -0.78 -1.21 112.91 115.21 1u97 h THR 35 Ca 0.42 -0.59 -0.10 0.00 0.77 0.00 0.00 66.41 66.91 1u97 h THR 35 Cb 0.11 0.11 -0.02 0.00 -1.74 0.00 0.00 68.15 66.61 1u97 h THR 35 CO -0.16 0.27 -0.06 0.00 0.37 0.00 0.00 175.52 175.95 1u97 h ILE 37 N 0.82 1.21 0.01 0.00 2.04 -0.93 -0.57 117.51 120.09 1u97 h ILE 37 Ca 0.14 -0.88 -0.22 0.00 1.00 0.00 0.00 64.86 64.90 1u97 h ILE 37 Cb 0.60 1.11 -0.03 0.00 -0.74 0.00 0.00 36.82 37.76 1u97 h ILE 37 CO 0.04 0.29 -1.09 0.25 0.00 0.00 0.00 178.15 177.64 1u97 h LEU 38 N 0.40 0.04 0.06 1.44 5.85 -1.01 -2.71 115.31 119.38 1u97 h LEU 38 Ca 0.08 -0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.75 1u97 h LEU 38 Cb 0.41 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 41.43 1u97 h LEU 38 CO 0.02 1.04 -0.03 0.15 -0.34 0.00 0.00 178.44 179.28 1u97 h PHE 39 N 0.01 -0.08 0.00 1.25 3.04 -0.63 -3.43 116.94 117.10 1u97 h PHE 39 Ca -0.05 -0.00 -0.02 0.00 3.98 0.00 0.00 57.97 61.88 1u97 h PHE 39 Cb 1.81 0.03 -0.00 0.00 2.56 0.00 0.00 35.95 40.34 1u97 h PHE 39 CO 0.01 -0.05 -0.50 -0.91 -2.02 0.00 0.00 178.31 174.84 1u97 h ASN 40 N -0.35 0.00 -1.78 0.41 2.35 -1.30 -3.51 115.58 111.39 1u97 h ASN 40 Ca -0.01 -0.05 0.00 0.00 -0.55 0.00 0.00 56.30 55.69 1u97 h ASN 40 Cb 0.06 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.43 1u97 h ASN 40 CO 0.01 0.78 0.00 0.61 -1.65 0.00 0.00 177.43 177.19 1u97 n GLY 41 N 1.62 3.05 0.22 2.83 0.00 -1.02 -4.94 105.19 106.95 1u97 n GLY 41 Ca -0.08 -1.29 0.05 0.00 0.00 0.00 0.00 46.02 44.70 1u97 n GLY 41 CO 0.00 0.00 0.00 0.06 0.00 0.00 0.00 173.32 173.38 1u97 h GLN 42 N 0.00 0.00 -2.99 1.61 3.07 -1.87 -3.38 115.11 111.54 1u97 h GLN 42 Ca 0.00 0.00 -0.56 0.00 0.09 0.00 0.00 58.65 58.18 1u97 h GLN 42 Cb 0.00 0.00 -0.40 0.00 0.08 0.00 0.00 27.48 27.16 1u97 h GLN 42 CO 0.00 0.24 -0.78 -0.51 0.09 0.00 0.00 178.83 177.87 1u97 s ASP 43 N -6.85 3.59 0.00 0.06 1.01 -1.26 -4.87 116.67 108.34 1u97 s ASP 43 Ca -0.03 -1.67 0.00 0.00 0.71 0.00 0.00 52.55 51.55 1u97 s ASP 43 Cb 0.15 -0.57 0.00 0.00 1.01 0.00 0.00 42.92 43.51 1u97 s ASP 43 CO 0.69 -0.39 0.64 -0.24 0.21 0.00 0.00 175.17 176.07 1u97 n SER 44 N 4.76 0.00 -0.48 0.27 2.88 -1.26 -4.98 113.62 114.81 1u97 n SER 44 Ca -0.00 -1.28 -0.06 0.00 -1.33 0.00 0.00 58.87 56.19 1u97 n SER 44 Cb 0.40 -0.06 -0.03 0.00 -0.75 0.00 0.00 64.21 63.78 1u97 n SER 44 CO 0.00 0.00 0.00 1.21 -1.23 0.00 0.00 175.04 175.02 1u97 n GLU 45 N 0.00 -1.60 0.00 -1.46 2.13 -1.26 -4.67 120.64 113.78 1u97 n GLU 45 Ca 0.00 0.68 0.00 0.00 0.66 0.00 0.00 57.16 58.50 1u97 n GLU 45 Cb 0.56 -4.99 0.00 0.00 0.27 0.00 0.00 31.44 27.28 1u97 n GLU 45 CO 0.00 0.00 0.00 1.63 -0.41 0.00 0.00 177.13 178.35 1u97 n LYS 46 N -0.48 -0.10 -0.00 5.31 5.02 -1.26 -4.76 118.16 121.89 1u97 n LYS 46 Ca -0.06 -0.19 0.11 0.00 -2.02 0.00 0.00 58.31 56.15 1u97 n LYS 46 Cb 0.50 -0.61 -0.14 0.00 -0.02 0.00 0.00 35.03 34.76 1u97 n LYS 46 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1u97 h LYS 48 N 0.00 0.00 -0.09 0.00 1.57 -1.90 -2.80 116.57 113.35 1u97 h LYS 48 Ca 0.00 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.77 1u97 h LYS 48 Cb 0.78 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.09 1u97 h LYS 48 CO 0.00 0.00 0.01 0.93 -0.57 0.00 0.00 179.45 179.82 1u97 h GLU 49 N 0.00 0.15 -0.31 3.15 4.39 -1.93 -1.11 114.58 118.92 1u97 h GLU 49 Ca 0.00 -0.04 -0.10 0.00 0.34 0.00 0.00 59.36 59.56 1u97 h GLU 49 Cb 0.25 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.87 1u97 h GLU 49 CO 0.00 0.37 -0.24 0.74 -1.16 0.00 0.00 179.01 178.72 1u97 h PHE 50 N -0.09 0.68 0.52 4.33 -1.00 -1.78 -1.54 116.94 118.06 1u97 h PHE 50 Ca 0.03 -0.15 -0.03 0.00 2.81 0.00 0.00 57.97 60.63 1u97 h PHE 50 Cb 0.29 -0.16 0.01 0.00 3.61 0.00 0.00 35.95 39.69 1u97 h PHE 50 CO 0.02 0.79 -0.25 0.82 -1.61 0.00 0.00 178.31 178.08 1u97 h ILE 51 N 0.53 0.44 -0.96 -0.55 2.04 -1.42 -0.21 117.51 117.37 1u97 h ILE 51 Ca 0.08 -0.26 0.08 0.00 1.00 0.00 0.00 64.86 65.75 1u97 h ILE 51 Cb 0.70 0.54 -0.07 0.00 -0.74 0.00 0.00 36.82 37.25 1u97 h ILE 51 CO 0.05 0.04 0.62 -0.33 0.00 0.00 0.00 178.15 178.53 1u97 h GLU 52 N -0.87 1.04 -0.45 2.37 5.08 -1.20 0.56 114.58 121.11 1u97 h GLU 52 Ca -0.07 -0.06 -0.03 0.00 -1.00 0.00 0.00 59.36 58.20 1u97 h GLU 52 Cb 0.60 -0.23 -0.02 0.00 0.50 0.00 0.00 28.75 29.59 1u97 h GLU 52 CO 0.12 0.69 0.15 -0.22 -1.00 0.00 0.00 179.01 178.75 1u97 h LYS 53 N 1.07 0.65 -0.10 2.33 1.63 -1.11 -1.43 116.57 119.62 1u97 h LYS 53 Ca 0.43 -0.10 -0.12 0.00 -0.85 0.00 0.00 60.65 60.01 1u97 h LYS 53 Cb 0.26 -0.12 -0.01 0.00 -0.60 0.00 0.00 32.23 31.76 1u97 h LYS 53 CO -0.18 0.56 -0.46 -0.92 -3.45 0.00 0.00 179.45 175.00 1u97 h TYR 54 N 0.64 0.29 0.04 1.91 3.20 0.94 -1.82 116.97 122.17 1u97 h TYR 54 Ca 0.15 -0.09 -0.00 0.00 3.14 0.00 0.00 58.73 61.93 1u97 h TYR 54 Cb 0.17 -0.06 0.00 0.00 1.54 0.00 0.00 36.73 38.38 1u97 h TYR 54 CO 0.01 0.67 -0.02 0.87 -1.64 0.00 0.00 178.16 178.05 1u97 h LYS 55 N 0.20 -0.05 -0.64 1.82 1.57 -0.18 -1.81 116.57 117.48 1u97 h LYS 55 Ca 0.01 0.00 -0.06 0.00 -1.87 0.00 0.00 60.65 58.74 1u97 h LYS 55 Cb 0.90 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 33.19 1u97 h LYS 55 CO 0.07 0.27 0.17 1.05 -0.57 0.00 0.00 179.45 180.44 1u97 h GLU 56 N -0.37 1.01 0.72 3.15 4.11 -1.35 -0.92 114.58 120.94 1u97 h GLU 56 Ca -0.01 -0.24 -0.03 0.00 0.07 0.00 0.00 59.36 59.15 1u97 h GLU 56 Cb 0.34 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.46 1u97 h GLU 56 CO 0.01 0.91 -0.36 0.00 0.07 0.00 0.00 179.01 179.64 1u97 h MET 58 N -0.99 1.06 0.00 0.00 1.85 -1.31 -1.04 114.93 114.49 1u97 h MET 58 Ca -0.10 -0.06 -0.07 0.00 -0.61 0.00 0.00 59.70 58.86 1u97 h MET 58 Cb 0.77 -0.24 -0.01 0.00 0.43 0.00 0.00 31.60 32.55 1u97 h MET 58 CO 0.15 0.70 -0.33 -0.22 -0.40 0.00 0.00 176.91 176.80 1u97 h LYS 59 N 1.09 0.00 0.00 0.39 3.64 -0.93 0.13 116.57 120.89 1u97 h LYS 59 Ca 0.39 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.77 1u97 h LYS 59 Cb 0.13 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.95 1u97 h LYS 59 CO -0.14 0.33 0.00 0.41 -2.27 0.00 0.00 179.45 177.78 1u97 n GLY 60 N -0.55 -0.82 0.21 5.01 0.00 0.02 -4.38 105.19 104.67 1u97 n GLY 60 Ca -0.02 -0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.94 1u97 n GLY 60 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1u97 n TYR 61 N -1.34 0.00 -0.06 1.61 4.01 -0.92 -5.02 117.16 115.43 1u97 n TYR 61 Ca 0.06 0.00 -0.08 0.00 -0.16 0.00 0.00 57.90 57.72 1u97 n TYR 61 Cb 0.13 0.02 -0.06 0.00 -0.31 0.00 0.00 39.34 39.11 1u97 n TYR 61 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1u97 n GLY 62 N 3.43 -0.22 1.88 2.72 0.00 -0.94 -4.78 105.19 107.28 1u97 n GLY 62 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.93 1u97 n GLY 62 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1u97 n PHE 63 N -2.79 -3.30 -0.89 1.61 7.35 0.42 -4.94 117.46 114.92 1u97 n PHE 63 Ca -0.21 1.97 0.00 0.00 -0.76 0.00 0.00 57.45 58.45 1u97 n PHE 63 Cb 0.75 -3.25 0.00 0.00 0.35 0.00 0.00 39.48 37.33 1u97 n PHE 63 CO 0.00 0.00 0.00 0.39 -0.76 0.00 0.00 176.76 176.39 1u97 n GLU 64 N 1.25 0.00 -2.21 -4.13 -0.58 -1.26 -4.99 120.64 108.72 1u97 n GLU 64 Ca 0.00 0.00 -0.42 0.00 -0.42 0.00 0.00 57.16 56.32 1u97 n GLU 64 Cb 0.00 -0.43 -0.03 0.00 -0.57 0.00 0.00 31.44 30.41 1u97 n GLU 64 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 1u97 s VAL 65 N 0.00 3.33 0.52 2.62 1.01 -1.26 -4.97 120.40 121.65 1u97 s VAL 65 Ca 0.00 1.01 -0.22 0.00 0.00 0.00 0.00 61.98 62.77 1u97 s VAL 65 Cb 0.00 -3.64 -0.07 0.00 0.00 0.00 0.00 36.38 32.67 1u97 s VAL 65 CO 0.00 0.11 1.12 -2.65 0.00 0.00 0.00 175.10 173.67 1u97 n PRO 66 N 3.42 1.35 0.00 2.72 -0.02 -1.26 -4.94 135.00 136.27 1u97 n PRO 66 Ca 0.09 0.50 0.00 0.00 -2.02 0.00 0.00 63.50 62.07 1u97 n PRO 66 Cb 0.43 -2.27 0.00 0.00 -0.02 0.00 0.00 33.50 31.64 1u97 n PRO 66 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1u97 n SER 67 N -0.38 0.05 -2.70 2.55 3.41 -1.26 -5.13 113.62 110.17 1u97 n SER 67 Ca 0.11 0.00 -0.02 0.00 -0.26 0.00 0.00 58.87 58.69 1u97 n SER 67 Cb 0.44 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.37 1u97 n SER 67 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1u97 n ALA 68 N -2.68 -3.48 1.29 7.33 0.00 -1.26 -5.34 120.51 116.37 1u97 n ALA 68 Ca 0.00 1.30 0.13 0.00 0.00 0.00 0.00 53.44 54.87 1u97 n ALA 68 Cb 0.21 -2.58 0.34 0.00 0.00 0.00 0.00 19.45 17.42 1u97 n ALA 68 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59