#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sbo s ASN 2 N 0.00 4.93 -1.42 3.17 0.01 -1.26 -3.53 114.94 116.84 1sbo s ASN 2 Ca 0.00 0.71 -0.03 0.00 -0.71 0.00 0.00 52.86 52.83 1sbo s ASN 2 Cb 0.00 -2.52 0.00 0.00 0.41 0.00 0.00 41.25 39.14 1sbo s ASN 2 CO 0.00 -2.57 0.35 -3.20 -1.51 0.00 0.00 177.10 170.17 1sbo n ASN 3 N 14.01 -0.43 -4.52 -1.22 4.05 -1.26 -1.81 115.26 124.07 1sbo n ASN 3 Ca 0.28 -1.09 -0.39 0.00 0.45 0.00 0.00 54.58 53.83 1sbo n ASN 3 Cb 0.53 -2.65 -0.08 0.00 1.23 0.00 0.00 39.78 38.80 1sbo n ASN 3 CO 0.00 0.00 0.00 -0.11 -3.05 0.00 0.00 177.26 174.10 1sbo n LEU 4 N -4.46 1.47 0.00 1.20 7.94 -1.23 -4.36 117.00 117.55 1sbo n LEU 4 Ca -0.30 -0.18 0.03 0.00 -1.11 0.00 0.00 56.01 54.45 1sbo n LEU 4 Cb 0.68 -1.30 0.01 0.00 0.53 0.00 0.00 43.42 43.35 1sbo n LEU 4 CO 0.77 -1.18 1.06 0.29 -1.11 0.00 0.00 177.39 177.22 1sbo n LYS 5 N 8.76 0.15 -4.34 1.96 5.02 -0.59 -4.97 118.16 124.14 1sbo n LYS 5 Ca 0.49 -0.71 -0.25 0.00 -2.02 0.00 0.00 58.31 55.82 1sbo n LYS 5 Cb 0.32 1.20 -0.09 0.00 -0.02 0.00 0.00 35.03 36.43 1sbo n LYS 5 CO 0.00 0.00 0.00 -0.48 -0.52 0.00 0.00 177.40 176.40 1sbo s LEU 6 N 0.00 2.90 -0.15 -0.35 -0.00 -1.26 -0.10 118.68 119.72 1sbo s LEU 6 Ca 0.29 -0.72 -0.09 0.00 -0.00 0.00 0.00 54.13 53.62 1sbo s LEU 6 Cb -0.01 -1.51 -0.07 0.00 -0.00 0.00 0.00 46.19 44.60 1sbo s LEU 6 CO -0.01 0.06 -0.22 -0.67 -0.00 0.00 0.00 176.35 175.52 1sbo n ASP 7 N -0.34 1.24 -1.33 1.48 2.03 0.11 -4.94 116.55 114.80 1sbo n ASP 7 Ca -0.09 0.21 0.00 0.00 0.52 0.00 0.00 54.79 55.44 1sbo n ASP 7 Cb 0.57 -0.50 0.00 0.00 -0.72 0.00 0.00 41.12 40.47 1sbo n ASP 7 CO 0.00 0.00 0.00 -0.38 -1.92 0.00 0.00 177.20 174.90 1sbo n ILE 8 N -3.80 -6.63 -3.50 5.18 5.41 -1.26 -4.94 119.36 109.82 1sbo n ILE 8 Ca -0.30 1.92 -0.25 0.00 1.00 0.00 0.00 62.75 65.12 1sbo n ILE 8 Cb 0.68 -3.38 -0.13 0.00 -0.71 0.00 0.00 39.64 36.09 1sbo n ILE 8 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 1sbo s VAL 9 N -0.99 -0.18 -0.45 1.39 1.01 0.61 -4.95 120.40 116.83 1sbo s VAL 9 Ca 0.00 -0.61 -0.28 0.00 0.00 0.00 0.00 61.98 61.09 1sbo s VAL 9 Cb 0.00 -0.94 -0.01 0.00 0.00 0.00 0.00 36.38 35.43 1sbo s VAL 9 CO 0.00 -0.60 1.66 -1.61 0.00 0.00 0.00 175.10 174.55 1sbo s GLU 10 N 2.19 3.22 0.00 2.72 2.02 -1.26 -0.09 118.70 127.50 1sbo s GLU 10 Ca 0.09 0.96 0.00 0.00 0.02 0.00 0.00 54.97 56.04 1sbo s GLU 10 Cb -0.15 -4.19 0.00 0.00 0.10 0.00 0.00 34.13 29.89 1sbo s GLU 10 CO -0.33 -2.01 0.00 0.94 0.02 0.00 0.00 175.26 173.88 1sbo n GLN 11 N 8.57 1.26 -0.04 1.61 7.27 0.40 -4.94 117.38 131.50 1sbo n GLN 11 Ca 0.19 0.00 -0.12 0.00 0.07 0.00 0.00 57.00 57.14 1sbo n GLN 11 Cb 0.49 0.00 -0.06 0.00 2.41 0.00 0.00 30.24 33.08 1sbo n GLN 11 CO 0.00 0.00 0.00 -0.44 0.07 0.00 0.00 177.06 176.69 1sbo h ASP 12 N 0.00 0.23 0.00 1.69 3.32 -2.02 -3.38 116.42 116.27 1sbo h ASP 12 Ca 0.00 -0.28 0.00 0.00 0.02 0.00 0.00 57.03 56.77 1sbo h ASP 12 Cb 0.00 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.49 1sbo h ASP 12 CO 0.00 0.46 0.00 -0.90 -1.72 0.00 0.00 179.24 177.08 1sbo n ASP 13 N -4.79 0.02 -4.12 6.45 5.68 -1.26 -5.01 116.55 113.52 1sbo n ASP 13 Ca -0.05 -0.18 -0.30 0.00 -0.50 0.00 0.00 54.79 53.76 1sbo n ASP 13 Cb 0.19 0.19 -0.17 0.00 -1.14 0.00 0.00 41.12 40.19 1sbo n ASP 13 CO 0.00 0.00 0.00 -1.59 -1.33 0.00 0.00 177.20 174.28 1sbo s LYS 14 N -0.19 2.53 -0.53 0.11 -2.85 -1.26 -2.58 119.74 114.98 1sbo s LYS 14 Ca 0.00 -0.69 -0.25 0.00 -1.00 0.00 0.00 55.97 54.04 1sbo s LYS 14 Cb 0.00 -2.03 0.04 0.00 -2.06 0.00 0.00 37.83 33.78 1sbo s LYS 14 CO 0.00 0.04 0.95 0.00 0.10 0.00 0.00 175.35 176.44 1sbo s ALA 15 N 0.69 3.17 -0.47 0.59 0.00 0.13 -0.46 121.76 125.41 1sbo s ALA 15 Ca -0.12 -1.09 -0.29 0.00 0.00 0.00 0.00 51.96 50.46 1sbo s ALA 15 Cb -0.16 -3.72 0.02 0.00 0.00 0.00 0.00 23.12 19.26 1sbo s ALA 15 CO 0.03 -2.30 1.28 0.42 0.00 0.00 0.00 175.76 175.19 1sbo s ILE 16 N 3.94 4.03 -0.63 0.00 1.01 0.87 -0.77 121.20 129.64 1sbo s ILE 16 Ca 0.33 1.02 -0.17 0.00 0.00 0.00 0.00 60.65 61.83 1sbo s ILE 16 Cb -0.12 -4.45 0.14 0.00 0.01 0.00 0.00 42.46 38.05 1sbo s ILE 16 CO 0.22 -0.96 0.66 -0.69 0.00 0.00 0.00 174.94 174.16 1sbo s VAL 17 N 5.06 5.12 0.14 2.92 1.01 0.17 -0.28 120.40 134.53 1sbo s VAL 17 Ca 0.53 -1.51 -0.30 0.00 0.00 0.00 0.00 61.98 60.70 1sbo s VAL 17 Cb -0.10 -4.44 -0.07 0.00 0.00 0.00 0.00 36.38 31.77 1sbo s VAL 17 CO 0.31 -1.03 1.14 -0.13 0.00 0.00 0.00 175.10 175.40 1sbo s ARG 18 N 1.77 4.52 0.01 2.72 0.52 -1.26 -1.70 118.95 125.53 1sbo s ARG 18 Ca 0.10 1.75 0.02 0.00 -0.52 0.00 0.00 55.73 57.08 1sbo s ARG 18 Cb -0.23 -3.30 -0.04 0.00 0.52 0.00 0.00 34.95 31.91 1sbo s ARG 18 CO 0.01 -0.06 0.00 0.08 0.02 0.00 0.00 175.30 175.36 1sbo s VAL 19 N 0.23 4.15 -0.00 3.52 1.01 -0.70 -0.71 120.40 127.90 1sbo s VAL 19 Ca 0.53 -0.64 0.07 0.00 0.00 0.00 0.00 61.98 61.94 1sbo s VAL 19 Cb -0.30 -2.87 -0.02 0.00 0.00 0.00 0.00 36.38 33.19 1sbo s VAL 19 CO 0.33 0.34 -0.22 -1.10 0.00 0.00 0.00 175.10 174.45 1sbo s GLN 20 N -1.66 1.72 0.00 2.72 -0.21 0.86 -4.34 119.66 118.76 1sbo s GLN 20 Ca 0.20 -0.84 0.00 0.00 0.02 0.00 0.00 55.36 54.74 1sbo s GLN 20 Cb -0.12 -1.72 0.00 0.00 1.00 0.00 0.00 33.01 32.18 1sbo s GLN 20 CO 0.11 0.46 0.00 0.41 -2.12 0.00 0.00 175.29 174.16 1sbo n GLY 21 N 2.35 0.82 3.78 3.09 0.00 -0.75 -1.55 105.19 112.92 1sbo n GLY 21 Ca -0.16 -1.57 -0.37 0.00 0.00 0.00 0.00 46.02 43.92 1sbo n GLY 21 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1sbo s ASP 22 N -0.72 7.20 -0.19 1.61 1.11 -1.26 -4.48 116.67 119.94 1sbo s ASP 22 Ca 0.00 1.95 -0.04 0.00 0.18 0.00 0.00 52.55 54.64 1sbo s ASP 22 Cb 0.00 -2.59 -0.02 0.00 1.07 0.00 0.00 42.92 41.38 1sbo s ASP 22 CO 0.00 -0.17 -0.03 -0.51 1.18 0.00 0.00 175.17 175.64 1sbo s ILE 23 N -1.54 3.70 0.04 0.77 2.07 -0.38 -4.60 121.20 121.26 1sbo s ILE 23 Ca 0.51 -0.40 -0.02 0.00 -1.41 0.00 0.00 60.65 59.33 1sbo s ILE 23 Cb -0.22 -2.66 0.01 0.00 0.13 0.00 0.00 42.46 39.72 1sbo s ILE 23 CO 0.27 0.45 0.09 -0.90 -1.91 0.00 0.00 174.94 172.94 1sbo n ASP 24 N 4.16 -0.23 0.32 4.50 5.68 -1.26 -1.65 116.55 128.06 1sbo n ASP 24 Ca -0.18 -1.16 0.20 0.00 -0.50 0.00 0.00 54.79 53.16 1sbo n ASP 24 Cb 0.52 0.38 1.08 0.00 -1.14 0.00 0.00 41.12 41.96 1sbo n ASP 24 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1sbo h ALA 25 N 2.00 1.25 0.00 2.12 0.00 -1.95 0.17 119.26 122.84 1sbo h ALA 25 Ca -0.03 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1sbo h ALA 25 Cb 0.13 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.92 1sbo h ALA 25 CO 0.04 -0.04 0.00 1.88 0.00 0.00 0.00 179.25 181.14 1sbo h TYR 26 N 0.00 0.00 0.00 0.00 -1.99 -1.96 -3.28 116.97 109.74 1sbo h TYR 26 Ca 0.01 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.74 1sbo h TYR 26 Cb 0.07 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.80 1sbo h TYR 26 CO 0.00 0.00 -0.69 -1.71 -0.00 0.00 0.00 178.16 175.76 1sbo n ASN 27 N -2.71 0.83 0.00 3.88 5.15 -0.20 -4.20 115.26 118.00 1sbo n ASN 27 Ca 0.04 -0.64 0.05 0.00 -0.60 0.00 0.00 54.58 53.44 1sbo n ASN 27 Cb 0.44 1.09 0.26 0.00 -0.53 0.00 0.00 39.78 41.04 1sbo n ASN 27 CO 0.00 0.00 0.00 -0.24 1.40 0.00 0.00 177.26 178.42 1sbo n SER 28 N -1.37 0.00 0.00 1.20 2.88 0.43 -1.72 113.62 115.04 1sbo n SER 28 Ca 0.01 0.18 0.00 0.00 -1.33 0.00 0.00 58.87 57.73 1sbo n SER 28 Cb 0.19 -0.31 0.00 0.00 -0.75 0.00 0.00 64.21 63.34 1sbo n SER 28 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 1sbo n SER 29 N -1.31 4.87 0.00 -3.46 3.41 -1.26 -4.63 113.62 111.25 1sbo n SER 29 Ca 0.05 0.00 -0.00 0.00 -0.26 0.00 0.00 58.87 58.65 1sbo n SER 29 Cb 0.09 0.44 -0.00 0.00 -0.26 0.00 0.00 64.21 64.48 1sbo n SER 29 CO 0.00 0.00 0.00 -0.08 -0.16 0.00 0.00 175.04 174.80 1sbo h GLU 30 N 0.00 -0.01 -0.93 4.33 4.57 -1.60 0.57 114.58 121.51 1sbo h GLU 30 Ca 0.00 0.00 0.20 0.00 -1.18 0.00 0.00 59.36 58.38 1sbo h GLU 30 Cb 1.00 0.00 -0.11 0.00 -0.16 0.00 0.00 28.75 29.48 1sbo h GLU 30 CO 0.00 -0.01 0.49 1.25 -1.18 0.00 0.00 179.01 179.56 1sbo h LEU 31 N -0.02 0.55 0.08 1.64 5.85 -1.67 0.98 115.31 122.73 1sbo h LEU 31 Ca -0.00 0.12 0.02 0.00 0.84 0.00 0.00 57.88 58.86 1sbo h LEU 31 Cb 0.01 0.04 -0.05 0.00 0.37 0.00 0.00 40.66 41.03 1sbo h LEU 31 CO 0.00 0.14 -0.41 0.50 -0.34 0.00 0.00 178.44 178.33 1sbo h LYS 32 N 0.58 -0.59 -0.05 1.25 3.64 -1.62 -0.62 116.57 119.16 1sbo h LYS 32 Ca 0.55 0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.97 1sbo h LYS 32 Cb 0.94 0.13 -0.00 0.00 -0.41 0.00 0.00 32.23 32.89 1sbo h LYS 32 CO -0.44 -0.39 0.02 0.93 -2.27 0.00 0.00 179.45 177.29 1sbo h GLU 33 N -0.61 0.08 0.00 1.90 5.08 0.00 -0.58 114.58 120.45 1sbo h GLU 33 Ca 0.03 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1sbo h GLU 33 Cb 0.66 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.90 1sbo h GLU 33 CO -0.27 0.26 0.00 1.04 -1.00 0.00 0.00 179.01 179.05 1sbo n GLN 34 N -4.94 0.07 -0.09 2.33 1.13 0.26 -0.73 117.38 115.41 1sbo n GLN 34 Ca -0.07 0.27 -0.18 0.00 -1.94 0.00 0.00 57.00 55.08 1sbo n GLN 34 Cb 0.13 -1.50 -0.06 0.00 0.11 0.00 0.00 30.24 28.92 1sbo n GLN 34 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 1sbo n LEU 35 N -1.37 1.58 -0.04 1.08 4.77 -0.26 -4.04 117.00 118.73 1sbo n LEU 35 Ca 0.03 0.27 0.01 0.00 -0.03 0.00 0.00 56.01 56.29 1sbo n LEU 35 Cb 0.07 -0.63 0.32 0.00 -2.33 0.00 0.00 43.42 40.85 1sbo n LEU 35 CO 0.07 0.18 1.04 0.08 -1.33 0.00 0.00 177.39 177.42 1sbo h ARG 36 N -0.77 0.61 0.00 3.23 0.11 -0.54 0.62 114.38 117.64 1sbo h ARG 36 Ca -0.37 -0.09 0.00 0.00 0.10 0.00 0.00 59.98 59.62 1sbo h ARG 36 Cb 1.25 -0.11 0.00 0.00 1.11 0.00 0.00 29.97 32.22 1sbo h ARG 36 CO -0.23 0.53 0.00 -0.97 0.10 0.00 0.00 179.97 179.40 1sbo h ASN 37 N 0.60 0.00 0.00 0.08 -1.24 -1.17 -2.86 115.58 111.00 1sbo h ASN 37 Ca 0.14 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.15 1sbo h ASN 37 Cb 0.17 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.22 1sbo h ASN 37 CO -0.01 0.00 -0.19 0.15 -1.29 0.00 0.00 177.43 176.09 1sbo h PHE 38 N 0.00 0.00 -1.19 0.67 3.57 -1.34 -3.38 116.94 115.27 1sbo h PHE 38 Ca 0.00 0.00 0.39 0.00 3.53 0.00 0.00 57.97 61.89 1sbo h PHE 38 Cb 0.94 0.00 -0.13 0.00 2.79 0.00 0.00 35.95 39.55 1sbo h PHE 38 CO 0.00 0.00 0.74 0.82 -2.23 0.00 0.00 178.31 177.64 1sbo h ILE 39 N -0.77 0.20 -0.44 1.41 2.04 0.10 0.59 117.51 120.63 1sbo h ILE 39 Ca 0.00 -0.06 0.08 0.00 1.00 0.00 0.00 64.86 65.88 1sbo h ILE 39 Cb 0.19 0.02 -0.02 0.00 -0.74 0.00 0.00 36.82 36.27 1sbo h ILE 39 CO 0.00 0.03 0.30 -1.28 0.00 0.00 0.00 178.15 177.20 1sbo h SER 40 N 0.17 0.22 0.03 1.72 0.87 -1.68 -3.08 113.55 111.79 1sbo h SER 40 Ca 0.77 0.00 -0.38 0.00 -1.23 0.00 0.00 61.79 60.95 1sbo h SER 40 Cb 2.22 -0.04 -0.05 0.00 -0.44 0.00 0.00 62.40 64.08 1sbo h SER 40 CO -0.46 0.14 -2.26 0.41 -0.53 0.00 0.00 176.83 174.12 1sbo n THR 41 N -4.46 1.57 -1.45 2.23 -1.04 0.19 -5.00 114.28 106.33 1sbo n THR 41 Ca 0.07 -0.50 -0.57 0.00 -2.04 0.00 0.00 64.05 61.00 1sbo n THR 41 Cb 0.34 -1.65 -0.09 0.00 -1.82 0.00 0.00 70.33 67.11 1sbo n THR 41 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 1sbo n THR 42 N -3.62 0.12 0.56 12.58 -1.04 -0.24 -4.85 114.28 117.79 1sbo n THR 42 Ca -0.43 -0.10 0.06 0.00 -2.04 0.00 0.00 64.05 61.55 1sbo n THR 42 Cb 0.95 -1.02 0.31 0.00 -1.82 0.00 0.00 70.33 68.76 1sbo n THR 42 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 1sbo n SER 43 N 7.57 0.00 -4.04 8.00 7.64 -1.26 -4.62 113.62 126.91 1sbo n SER 43 Ca 0.43 0.24 -0.32 0.00 1.01 0.00 0.00 58.87 60.24 1sbo n SER 43 Cb 0.08 -0.36 -0.15 0.00 -1.01 0.00 0.00 64.21 62.76 1sbo n SER 43 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 1sbo s LYS 44 N -2.73 2.01 0.31 1.43 -0.14 -1.26 -4.98 119.74 114.38 1sbo s LYS 44 Ca 0.10 -1.35 0.01 0.00 -1.36 0.00 0.00 55.97 53.37 1sbo s LYS 44 Cb 0.09 -2.86 0.50 0.00 -1.68 0.00 0.00 37.83 33.87 1sbo s LYS 44 CO 0.21 -0.63 1.90 0.87 -0.76 0.00 0.00 175.35 176.94 1sbo h LYS 45 N 7.79 0.80 -6.02 1.68 1.57 -1.75 -3.35 116.57 117.28 1sbo h LYS 45 Ca -0.17 -0.12 -0.52 0.00 -1.87 0.00 0.00 60.65 57.98 1sbo h LYS 45 Cb 1.04 -0.14 -0.08 0.00 0.08 0.00 0.00 32.23 33.12 1sbo h LYS 45 CO 0.46 0.66 1.27 0.21 -0.57 0.00 0.00 179.45 181.48 1sbo s LYS 46 N -5.38 3.28 -0.86 3.15 2.20 -1.22 -0.13 119.74 120.78 1sbo s LYS 46 Ca -0.10 -0.81 -0.25 0.00 -0.36 0.00 0.00 55.97 54.45 1sbo s LYS 46 Cb 0.16 -5.19 0.04 0.00 -1.51 0.00 0.00 37.83 31.33 1sbo s LYS 46 CO 0.78 -2.52 1.38 0.42 -0.36 0.00 0.00 175.35 175.06 1sbo s ILE 47 N 6.43 3.79 0.32 5.43 -1.09 -1.19 0.17 121.20 135.06 1sbo s ILE 47 Ca 0.52 -0.11 -0.25 0.00 -2.23 0.00 0.00 60.65 58.58 1sbo s ILE 47 Cb -0.02 -4.93 -0.10 0.00 -1.58 0.00 0.00 42.46 35.82 1sbo s ILE 47 CO -0.05 -1.85 0.92 -0.69 -1.23 0.00 0.00 174.94 172.03 1sbo s VAL 48 N 5.60 4.27 0.13 2.92 1.01 0.05 -1.01 120.40 133.37 1sbo s VAL 48 Ca 0.41 1.73 0.08 0.00 0.00 0.00 0.00 61.98 64.21 1sbo s VAL 48 Cb -0.05 -3.96 -0.04 0.00 0.00 0.00 0.00 36.38 32.33 1sbo s VAL 48 CO 0.04 0.12 -0.12 -0.76 0.00 0.00 0.00 175.10 174.38 1sbo s LEU 49 N -2.12 2.93 -0.11 3.92 2.01 0.24 -0.66 118.68 124.90 1sbo s LEU 49 Ca 0.50 -0.49 -0.00 0.00 0.01 0.00 0.00 54.13 54.15 1sbo s LEU 49 Cb -0.18 -1.71 0.02 0.00 0.01 0.00 0.00 46.19 44.34 1sbo s LEU 49 CO 0.23 0.16 -0.08 -0.62 1.01 0.00 0.00 176.35 177.05 1sbo s ASP 50 N -2.38 2.10 -0.12 2.29 2.15 -0.69 -0.20 116.67 119.83 1sbo s ASP 50 Ca 0.21 -0.29 0.15 0.00 0.43 0.00 0.00 52.55 53.06 1sbo s ASP 50 Cb -0.10 -0.82 0.31 0.00 -0.30 0.00 0.00 42.92 42.01 1sbo s ASP 50 CO 0.13 -0.11 1.20 0.18 -0.17 0.00 0.00 175.17 176.41 1sbo n LEU 51 N 4.84 2.71 -0.33 -1.34 7.99 -0.10 -1.72 117.00 129.05 1sbo n LEU 51 Ca -0.13 -2.86 0.27 0.00 -0.01 0.00 0.00 56.01 53.28 1sbo n LEU 51 Cb 0.50 -0.39 0.59 0.00 -0.11 0.00 0.00 43.42 44.02 1sbo n LEU 51 CO 0.17 0.67 1.25 -1.28 -1.51 0.00 0.00 177.39 176.69 1sbo h SER 52 N 0.56 0.30 0.09 -1.43 0.87 -1.75 -1.23 113.55 110.95 1sbo h SER 52 Ca 0.00 0.06 0.00 0.00 -1.23 0.00 0.00 61.79 60.62 1sbo h SER 52 Cb 1.02 0.02 0.00 0.00 -0.44 0.00 0.00 62.40 63.00 1sbo h SER 52 CO 0.05 0.04 -0.15 -1.20 -0.53 0.00 0.00 176.83 175.05 1sbo n SER 53 N -4.50 1.49 -4.29 6.23 7.64 -1.26 -4.81 113.62 114.12 1sbo n SER 53 Ca 0.26 -1.30 -0.44 0.00 1.01 0.00 0.00 58.87 58.40 1sbo n SER 53 Cb 1.02 0.10 -0.02 0.00 -1.01 0.00 0.00 64.21 64.30 1sbo n SER 53 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1sbo s VAL 54 N -2.25 5.51 -0.37 0.44 1.01 -0.46 -3.78 120.40 120.49 1sbo s VAL 54 Ca 0.30 -3.09 0.26 0.00 0.00 0.00 0.00 61.98 59.45 1sbo s VAL 54 Cb 0.20 -4.36 0.34 0.00 0.00 0.00 0.00 36.38 32.55 1sbo s VAL 54 CO 0.43 -1.09 1.73 0.28 0.00 0.00 0.00 175.10 176.44 1sbo h SER 55 N 7.03 0.00 -4.92 3.32 0.02 -1.87 -3.46 113.55 113.69 1sbo h SER 55 Ca 0.14 0.00 -0.20 0.00 -0.84 0.00 0.00 61.79 60.89 1sbo h SER 55 Cb 0.94 0.00 -0.20 0.00 0.14 0.00 0.00 62.40 63.28 1sbo h SER 55 CO 0.87 0.00 -0.71 -0.47 -1.14 0.00 0.00 176.83 175.39 1sbo s TYR 56 N -3.30 0.47 -0.13 3.45 5.04 -1.26 -4.95 117.35 116.67 1sbo s TYR 56 Ca 0.06 -0.62 -0.05 0.00 -2.44 0.00 0.00 57.07 54.01 1sbo s TYR 56 Cb 0.07 -0.31 0.06 0.00 0.35 0.00 0.00 41.96 42.13 1sbo s TYR 56 CO 0.61 -0.18 0.28 1.41 -1.34 0.00 0.00 175.55 176.34 1sbo s MET 57 N -2.02 0.20 0.64 4.97 -2.45 -1.26 -1.24 119.30 118.15 1sbo s MET 57 Ca -0.09 0.70 -0.03 0.00 -1.25 0.00 0.00 55.69 55.03 1sbo s MET 57 Cb -0.06 -0.03 0.06 0.00 1.25 0.00 0.00 34.83 36.04 1sbo s MET 57 CO -0.02 -0.23 0.91 0.34 1.05 0.00 0.00 175.02 177.07 1sbo s ASP 58 N 1.97 4.92 0.53 1.11 -1.08 -0.66 -4.96 116.67 118.50 1sbo s ASP 58 Ca -0.03 0.13 0.09 0.00 -0.52 0.00 0.00 52.55 52.22 1sbo s ASP 58 Cb -0.11 -0.84 0.49 0.00 -1.46 0.00 0.00 42.92 41.00 1sbo s ASP 58 CO -0.09 -1.46 1.20 0.28 0.52 0.00 0.00 175.17 175.62 1sbo h SER 59 N -0.31 0.00 -0.05 -0.34 0.02 -2.01 -0.88 113.55 109.98 1sbo h SER 59 Ca -0.42 0.00 -0.03 0.00 -0.84 0.00 0.00 61.79 60.50 1sbo h SER 59 Cb 1.30 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.84 1sbo h SER 59 CO 0.53 0.00 -0.08 0.00 -1.14 0.00 0.00 176.83 176.14 1sbo h ALA 60 N 0.50 0.08 -0.27 3.77 0.00 -1.92 -3.35 119.26 118.06 1sbo h ALA 60 Ca 0.00 -0.31 0.02 0.00 0.00 0.00 0.00 54.91 54.61 1sbo h ALA 60 Cb 1.36 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 19.11 1sbo h ALA 60 CO 0.00 -0.08 0.14 0.78 0.00 0.00 0.00 179.25 180.09 1sbo h GLY 61 N -0.36 0.37 1.01 0.00 0.00 -1.39 -1.05 103.07 101.64 1sbo h GLY 61 Ca 0.00 -0.10 -0.07 0.00 0.00 0.00 0.00 47.33 47.16 1sbo h GLY 61 CO 0.02 0.08 0.06 0.17 0.00 0.00 0.00 176.54 176.87 1sbo h LEU 62 N 0.29 0.86 -1.77 3.11 -0.00 -1.74 0.11 115.31 116.17 1sbo h LEU 62 Ca 0.11 -0.28 -0.01 0.00 -0.00 0.00 0.00 57.88 57.71 1sbo h LEU 62 Cb 0.03 -0.23 -0.00 0.00 -0.00 0.00 0.00 40.66 40.46 1sbo h LEU 62 CO -0.07 0.92 -0.04 1.23 -0.00 0.00 0.00 178.44 180.47 1sbo h GLY 63 N 0.76 0.00 1.15 0.17 0.00 -1.61 -0.31 103.07 103.24 1sbo h GLY 63 Ca 0.16 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 47.43 1sbo h GLY 63 CO 0.02 0.00 -1.01 -0.84 0.00 0.00 0.00 176.54 174.71 1sbo h THR 64 N 0.00 0.21 0.04 4.70 2.02 0.13 -3.26 112.91 116.75 1sbo h THR 64 Ca -0.00 -1.39 -0.23 0.00 0.77 0.00 0.00 66.41 65.56 1sbo h THR 64 Cb 0.42 1.77 -0.02 0.00 -1.74 0.00 0.00 68.15 68.58 1sbo h THR 64 CO 0.01 0.12 -1.23 -0.07 0.37 0.00 0.00 175.52 174.72 1sbo h LEU 65 N 0.00 0.14 -1.91 2.58 3.38 -0.56 -3.38 115.31 115.56 1sbo h LEU 65 Ca -0.05 -0.70 -0.03 0.00 0.09 0.00 0.00 57.88 57.19 1sbo h LEU 65 Cb 1.21 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.91 1sbo h LEU 65 CO 0.02 1.51 -0.12 1.62 0.09 0.00 0.00 178.44 181.55 1sbo h VAL 66 N -0.70 0.76 -0.13 1.22 3.04 -1.22 0.14 116.25 119.35 1sbo h VAL 66 Ca -0.30 -0.47 -0.04 0.00 -1.01 0.00 0.00 66.70 64.87 1sbo h VAL 66 Cb 1.46 1.28 -0.01 0.00 -2.01 0.00 0.00 31.29 32.02 1sbo h VAL 66 CO -0.08 0.12 -0.12 1.62 -1.01 0.00 0.00 177.57 178.10 1sbo h VAL 67 N 0.00 1.16 0.00 1.51 3.04 -1.75 -2.35 116.25 117.86 1sbo h VAL 67 Ca -0.00 -0.69 -0.20 0.00 -1.01 0.00 0.00 66.70 64.79 1sbo h VAL 67 Cb 0.27 1.19 -0.03 0.00 -2.01 0.00 0.00 31.29 30.72 1sbo h VAL 67 CO 0.02 0.21 -1.03 0.40 -1.01 0.00 0.00 177.57 176.16 1sbo h ILE 68 N 0.19 1.47 -0.61 3.17 1.08 -0.96 -2.91 117.51 118.93 1sbo h ILE 68 Ca 0.04 -3.14 0.14 0.00 -0.39 0.00 0.00 64.86 61.50 1sbo h ILE 68 Cb 0.33 2.72 -0.03 0.00 -3.07 0.00 0.00 36.82 36.76 1sbo h ILE 68 CO 0.02 0.84 0.42 0.25 -0.69 0.00 0.00 178.15 178.99 1sbo h LEU 69 N 0.00 0.22 0.41 1.44 6.46 -0.67 0.46 115.31 123.63 1sbo h LEU 69 Ca -0.05 0.01 -0.02 0.00 -0.12 0.00 0.00 57.88 57.70 1sbo h LEU 69 Cb 1.74 -0.03 0.00 0.00 -0.73 0.00 0.00 40.66 41.64 1sbo h LEU 69 CO 0.11 0.12 -0.20 0.50 -0.62 0.00 0.00 178.44 178.36 1sbo h LYS 70 N 0.24 -0.53 -1.01 1.25 3.64 -1.53 -3.29 116.57 115.33 1sbo h LYS 70 Ca 0.29 0.04 0.24 0.00 -1.27 0.00 0.00 60.65 59.95 1sbo h LYS 70 Cb 0.83 0.12 -0.11 0.00 -0.41 0.00 0.00 32.23 32.66 1sbo h LYS 70 CO -0.06 -0.35 0.63 -0.44 -2.27 0.00 0.00 179.45 176.95 1sbo h ASP 71 N -0.82 0.61 0.76 4.20 3.32 -0.80 0.12 116.42 123.81 1sbo h ASP 71 Ca -0.06 0.11 -0.04 0.00 0.02 0.00 0.00 57.03 57.06 1sbo h ASP 71 Cb 0.42 0.01 0.01 0.00 0.22 0.00 0.00 39.33 39.99 1sbo h ASP 71 CO 0.09 0.13 -0.37 0.00 -1.72 0.00 0.00 179.24 177.38 1sbo h ALA 72 N 1.67 -1.02 -0.88 3.45 0.00 -1.20 -3.03 119.26 118.25 1sbo h ALA 72 Ca 0.61 -0.23 0.21 0.00 0.00 0.00 0.00 54.91 55.50 1sbo h ALA 72 Cb 1.27 0.40 -0.06 0.00 0.00 0.00 0.00 17.79 19.39 1sbo h ALA 72 CO -0.39 -1.05 0.59 -0.22 0.00 0.00 0.00 179.25 178.18 1sbo h LYS 73 N -1.06 0.33 -0.65 0.00 3.11 -0.85 0.22 116.57 117.67 1sbo h LYS 73 Ca -0.10 -0.02 0.06 0.00 -2.81 0.00 0.00 60.65 57.77 1sbo h LYS 73 Cb 0.79 -0.07 -0.05 0.00 -1.00 0.00 0.00 32.23 31.89 1sbo h LYS 73 CO 0.17 0.22 0.35 0.82 -2.81 0.00 0.00 179.45 178.20 1sbo h ILE 74 N 0.34 0.96 -0.52 2.00 2.04 -1.05 -1.10 117.51 120.17 1sbo h ILE 74 Ca 0.45 -0.22 0.00 0.00 1.00 0.00 0.00 64.86 66.09 1sbo h ILE 74 Cb 1.22 0.25 0.00 0.00 -0.74 0.00 0.00 36.82 37.55 1sbo h ILE 74 CO -0.15 0.12 0.00 -3.20 0.00 0.00 0.00 178.15 174.92 1sbo n ASN 75 N -4.80 3.72 -1.45 1.72 2.85 -0.14 -4.93 115.26 112.22 1sbo n ASN 75 Ca 0.08 -2.29 -0.19 0.00 -0.11 0.00 0.00 54.58 52.07 1sbo n ASN 75 Cb 0.17 -0.49 -0.08 0.00 1.24 0.00 0.00 39.78 40.62 1sbo n ASN 75 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1sbo n GLY 76 N 1.04 1.81 3.84 8.20 0.00 -0.30 -4.97 105.19 114.81 1sbo n GLY 76 Ca 0.20 -0.02 -0.32 0.00 0.00 0.00 0.00 46.02 45.88 1sbo n GLY 76 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1sbo s LYS 77 N -3.60 3.98 0.93 1.61 -0.14 0.59 -4.86 119.74 118.25 1sbo s LYS 77 Ca 0.00 0.97 -0.14 0.00 -1.36 0.00 0.00 55.97 55.44 1sbo s LYS 77 Cb 0.00 -2.14 0.19 0.00 -1.68 0.00 0.00 37.83 34.20 1sbo s LYS 77 CO 0.00 -0.25 1.28 -1.21 -0.76 0.00 0.00 175.35 174.42 1sbo s GLU 78 N -3.98 0.74 -0.27 1.68 8.01 0.81 -3.43 118.70 122.26 1sbo s GLU 78 Ca 0.59 -0.52 -0.17 0.00 0.01 0.00 0.00 54.97 54.88 1sbo s GLU 78 Cb -0.10 -1.91 0.08 0.00 -4.31 0.00 0.00 34.13 27.89 1sbo s GLU 78 CO 0.29 -2.31 0.68 0.12 0.01 0.00 0.00 175.26 174.05 1sbo s PHE 79 N -3.80 -1.01 0.01 1.61 5.36 -1.26 -3.16 117.98 115.74 1sbo s PHE 79 Ca 0.73 2.07 -0.03 0.00 -0.96 0.00 0.00 56.93 58.74 1sbo s PHE 79 Cb -0.04 0.57 -0.01 0.00 -0.34 0.00 0.00 43.02 43.20 1sbo s PHE 79 CO 0.52 -0.50 0.05 0.42 -1.46 0.00 0.00 175.22 174.25 1sbo s ILE 80 N 1.44 0.10 -0.06 3.12 1.01 -0.18 -4.65 121.20 121.98 1sbo s ILE 80 Ca -0.08 -0.80 0.03 0.00 0.00 0.00 0.00 60.65 59.79 1sbo s ILE 80 Cb -0.05 -0.34 -0.02 0.00 0.01 0.00 0.00 42.46 42.06 1sbo s ILE 80 CO -0.17 -0.44 -0.13 -0.76 0.00 0.00 0.00 174.94 173.44 1sbo s LEU 81 N -1.41 2.77 0.17 2.97 1.43 -0.81 -0.59 118.68 123.20 1sbo s LEU 81 Ca -0.15 -0.20 -0.01 0.00 -1.03 0.00 0.00 54.13 52.74 1sbo s LEU 81 Cb -0.09 -1.57 -0.04 0.00 0.03 0.00 0.00 46.19 44.52 1sbo s LEU 81 CO 0.00 0.32 0.10 -0.44 0.23 0.00 0.00 176.35 176.57 1sbo s SER 82 N -0.59 0.22 -1.51 2.29 0.01 0.72 -1.19 113.70 113.65 1sbo s SER 82 Ca 0.09 -1.29 -0.14 0.00 1.31 0.00 0.00 55.95 55.92 1sbo s SER 82 Cb -0.11 0.35 0.10 0.00 0.21 0.00 0.00 66.02 66.57 1sbo s SER 82 CO 0.01 -0.79 0.75 -0.24 0.41 0.00 0.00 173.24 173.38 1sbo n SER 83 N -0.19 -4.05 -4.64 2.44 2.88 0.44 -0.92 113.62 109.58 1sbo n SER 83 Ca -0.02 -0.71 -0.43 0.00 -1.33 0.00 0.00 58.87 56.39 1sbo n SER 83 Cb 0.65 -3.29 -0.03 0.00 -0.75 0.00 0.00 64.21 60.80 1sbo n SER 83 CO 0.00 0.00 0.00 -0.76 -1.23 0.00 0.00 175.04 173.05 1sbo s LEU 84 N -7.00 4.05 0.47 2.46 1.43 -1.26 -2.92 118.68 115.92 1sbo s LEU 84 Ca 0.60 1.85 -0.24 0.00 -1.03 0.00 0.00 54.13 55.31 1sbo s LEU 84 Cb -0.31 -3.53 -0.07 0.00 0.03 0.00 0.00 46.19 42.30 1sbo s LEU 84 CO 0.74 -1.13 1.37 -0.54 0.23 0.00 0.00 176.35 177.02 1sbo s LYS 85 N 4.42 3.56 0.53 1.70 1.02 -1.26 -4.75 119.74 124.97 1sbo s LYS 85 Ca 0.72 2.29 0.26 0.00 0.02 0.00 0.00 55.97 59.26 1sbo s LYS 85 Cb -0.28 -2.53 1.50 0.00 -0.52 0.00 0.00 37.83 36.00 1sbo s LYS 85 CO 0.29 -0.87 2.13 1.49 -0.92 0.00 0.00 175.35 177.46 1sbo h GLU 86 N 2.09 0.00 -0.00 1.68 4.57 -1.98 0.15 114.58 121.09 1sbo h GLU 86 Ca -0.51 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.67 1sbo h GLU 86 Cb 1.27 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.86 1sbo h GLU 86 CO 0.60 0.08 -0.39 0.43 -1.18 0.00 0.00 179.01 178.55 1sbo n SER 87 N -3.85 0.86 -0.08 1.04 7.64 -1.26 -3.28 113.62 114.69 1sbo n SER 87 Ca -0.02 -0.67 -0.09 0.00 1.01 0.00 0.00 58.87 59.09 1sbo n SER 87 Cb 0.18 0.23 -0.12 0.00 -1.01 0.00 0.00 64.21 63.49 1sbo n SER 87 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 1sbo n ILE 88 N -0.99 1.12 -0.01 0.44 2.08 -0.01 -4.11 119.36 117.88 1sbo n ILE 88 Ca 0.09 -0.64 -0.11 0.00 0.56 0.00 0.00 62.75 62.65 1sbo n ILE 88 Cb 0.35 -0.71 -0.06 0.00 -0.75 0.00 0.00 39.64 38.47 1sbo n ILE 88 CO 0.00 0.00 0.00 0.28 0.56 0.00 0.00 176.55 177.39 1sbo h SER 89 N 0.00 0.13 -0.76 4.38 0.02 -0.90 0.30 113.55 116.73 1sbo h SER 89 Ca -0.44 -0.08 0.14 0.00 -0.84 0.00 0.00 61.79 60.57 1sbo h SER 89 Cb 1.94 -0.03 -0.09 0.00 0.14 0.00 0.00 62.40 64.35 1sbo h SER 89 CO 0.00 0.17 0.31 0.08 -1.14 0.00 0.00 176.83 176.26 1sbo h ARG 90 N 0.08 0.45 -0.22 3.45 0.11 -1.78 -2.44 114.38 114.03 1sbo h ARG 90 Ca 0.04 -0.03 -0.01 0.00 0.10 0.00 0.00 59.98 60.08 1sbo h ARG 90 Cb 0.07 -0.10 -0.01 0.00 1.11 0.00 0.00 29.97 31.04 1sbo h ARG 90 CO -0.01 0.30 0.11 0.82 0.10 0.00 0.00 179.97 181.29 1sbo h ILE 91 N 0.46 1.13 -0.07 0.08 2.04 -1.13 0.33 117.51 120.35 1sbo h ILE 91 Ca 0.41 -0.37 0.03 0.00 1.00 0.00 0.00 64.86 65.93 1sbo h ILE 91 Cb 0.61 0.98 -0.04 0.00 -0.74 0.00 0.00 36.82 37.64 1sbo h ILE 91 CO -0.39 0.13 -0.13 -0.07 0.00 0.00 0.00 178.15 177.69 1sbo h LEU 92 N 0.22 -0.38 -0.88 1.44 3.38 -1.09 -1.52 115.31 116.49 1sbo h LEU 92 Ca 0.07 0.07 0.09 0.00 0.09 0.00 0.00 57.88 58.20 1sbo h LEU 92 Cb 0.11 0.18 -0.07 0.00 0.09 0.00 0.00 40.66 40.96 1sbo h LEU 92 CO -0.01 -0.17 0.53 0.50 0.09 0.00 0.00 178.44 179.38 1sbo h LYS 93 N -0.18 0.87 0.61 1.13 3.11 -0.85 0.62 116.57 121.88 1sbo h LYS 93 Ca 0.07 -0.05 -0.03 0.00 -2.81 0.00 0.00 60.65 57.83 1sbo h LYS 93 Cb 0.28 -0.20 0.01 0.00 -1.00 0.00 0.00 32.23 31.31 1sbo h LYS 93 CO -0.18 0.58 -0.29 -0.07 -2.81 0.00 0.00 179.45 176.67 1sbo h LEU 94 N 0.90 -0.70 0.00 5.20 3.38 0.58 -2.14 115.31 122.54 1sbo h LEU 94 Ca 0.41 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.36 1sbo h LEU 94 Cb 0.33 0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.26 1sbo h LEU 94 CO -0.23 -0.38 0.00 0.41 0.09 0.00 0.00 178.44 178.33 1sbo n THR 95 N -5.38 0.72 -0.24 0.22 -1.04 -0.71 -4.87 114.28 102.99 1sbo n THR 95 Ca -0.12 0.18 0.00 0.00 -2.04 0.00 0.00 64.05 62.07 1sbo n THR 95 Cb 0.35 -0.90 0.00 0.00 -1.82 0.00 0.00 70.33 67.97 1sbo n THR 95 CO 0.00 0.00 0.00 1.41 -0.64 0.00 0.00 175.07 175.84 1sbo n HIS 96 N -1.42 0.00 0.05 -1.42 8.25 -0.04 -4.99 115.22 115.65 1sbo n HIS 96 Ca 0.06 0.00 0.06 0.00 -0.26 0.00 0.00 57.72 57.58 1sbo n HIS 96 Cb 0.17 0.00 0.49 0.00 1.12 0.00 0.00 29.99 31.77 1sbo n HIS 96 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 1sbo h LEU 97 N 0.00 0.35 -1.24 2.41 4.07 -0.08 -2.99 115.31 117.84 1sbo h LEU 97 Ca 0.00 -0.01 0.00 0.00 0.08 0.00 0.00 57.88 57.95 1sbo h LEU 97 Cb 0.00 -0.08 0.00 0.00 1.08 0.00 0.00 40.66 41.66 1sbo h LEU 97 CO 0.00 0.25 0.00 -2.24 -1.08 0.00 0.00 178.44 175.37 1sbo h ASP 98 N 0.41 0.00 0.81 -0.43 2.03 -1.81 -0.13 116.42 117.29 1sbo h ASP 98 Ca 0.14 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.44 1sbo h ASP 98 Cb 0.04 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.54 1sbo h ASP 98 CO -0.03 0.00 0.00 2.29 -1.03 0.00 0.00 179.24 180.47 1sbo n LYS 99 N -2.83 0.18 0.00 4.15 2.85 -1.13 -4.12 118.16 117.26 1sbo n LYS 99 Ca 0.01 0.01 0.00 0.00 -1.05 0.00 0.00 58.31 57.28 1sbo n LYS 99 Cb 0.28 -1.50 0.00 0.00 -0.65 0.00 0.00 35.03 33.16 1sbo n LYS 99 CO 0.00 0.00 0.00 0.44 -0.05 0.00 0.00 177.40 177.79 1sbo n ILE 100 N -1.41 0.22 -4.52 0.58 -5.35 -0.17 -5.07 119.36 103.65 1sbo n ILE 100 Ca 0.10 -0.24 -0.25 0.00 -0.27 0.00 0.00 62.75 62.09 1sbo n ILE 100 Cb 0.29 0.99 -0.09 0.00 -1.74 0.00 0.00 39.64 39.09 1sbo n ILE 100 CO 0.00 0.00 0.00 -0.36 -1.76 0.00 0.00 176.55 174.43 1sbo s PHE 101 N -0.22 1.82 -0.05 4.28 0.40 -0.56 -5.07 117.98 118.59 1sbo s PHE 101 Ca 0.00 -1.20 0.04 0.00 -0.60 0.00 0.00 56.93 55.17 1sbo s PHE 101 Cb 0.00 -1.21 -0.03 0.00 0.51 0.00 0.00 43.02 42.29 1sbo s PHE 101 CO 0.00 -0.20 -0.14 0.21 0.70 0.00 0.00 175.22 175.78 1sbo s LYS 102 N -3.76 2.49 -0.03 0.44 2.20 -1.26 -4.90 119.74 114.92 1sbo s LYS 102 Ca 0.25 -0.70 0.02 0.00 -0.36 0.00 0.00 55.97 55.18 1sbo s LYS 102 Cb 0.04 -2.37 0.00 0.00 -1.51 0.00 0.00 37.83 33.99 1sbo s LYS 102 CO 0.14 0.62 -0.09 0.42 -0.36 0.00 0.00 175.35 176.08 1sbo s ILE 103 N -0.74 0.82 0.30 5.43 1.09 -1.26 -1.93 121.20 124.91 1sbo s ILE 103 Ca 0.12 -0.37 0.03 0.00 -1.10 0.00 0.00 60.65 59.33 1sbo s ILE 103 Cb -0.11 -0.73 -0.03 0.00 -1.06 0.00 0.00 42.46 40.54 1sbo s ILE 103 CO 0.01 0.26 0.28 0.42 -0.10 0.00 0.00 174.94 175.80 1sbo s THR 104 N 0.26 0.00 -0.17 2.92 -4.23 -0.33 -4.96 115.64 109.13 1sbo s THR 104 Ca -0.04 -1.92 -0.18 0.00 -1.18 0.00 0.00 61.69 58.37 1sbo s THR 104 Cb -0.09 -2.51 -0.15 0.00 1.34 0.00 0.00 72.50 71.09 1sbo s THR 104 CO 0.01 0.00 0.21 -0.78 -0.54 0.00 0.00 174.62 173.51 1sbo h ASP 105 N 2.25 0.00 -3.31 3.99 1.82 -1.94 -3.25 116.42 115.98 1sbo h ASP 105 Ca -0.28 -0.43 -0.59 0.00 -0.39 0.00 0.00 57.03 55.34 1sbo h ASP 105 Cb 1.24 0.00 -0.18 0.00 0.68 0.00 0.00 39.33 41.07 1sbo h ASP 105 CO 0.41 1.12 -0.80 0.42 -1.61 0.00 0.00 179.24 178.77 1sbo s THR 106 N -2.22 2.11 -0.00 2.25 -4.23 -1.26 -0.42 115.64 111.87 1sbo s THR 106 Ca -0.21 -2.00 0.32 0.00 -1.18 0.00 0.00 61.69 58.62 1sbo s THR 106 Cb 0.03 -2.00 0.34 0.00 1.34 0.00 0.00 72.50 72.21 1sbo s THR 106 CO 0.46 -0.22 1.94 -0.37 -0.54 0.00 0.00 174.62 175.89 1sbo h VAL 107 N 3.18 0.00 -0.50 2.29 -1.51 -1.92 -1.88 116.25 115.92 1sbo h VAL 107 Ca -0.44 -0.30 0.01 0.00 -1.23 0.00 0.00 66.70 64.74 1sbo h VAL 107 Cb 1.21 1.18 -0.03 0.00 -2.13 0.00 0.00 31.29 31.52 1sbo h VAL 107 CO 0.50 0.00 0.32 -0.33 -1.23 0.00 0.00 177.57 176.82 1sbo h GLU 108 N 0.00 0.62 0.00 5.19 5.08 -1.99 -3.19 114.58 120.29 1sbo h GLU 108 Ca 0.00 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1sbo h GLU 108 Cb 0.34 -0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.45 1sbo h GLU 108 CO 0.00 0.41 0.00 0.93 -1.00 0.00 0.00 179.01 179.35 1sbo h GLU 109 N 0.64 0.00 0.00 2.33 4.39 -1.73 -3.52 114.58 116.69 1sbo h GLU 109 Ca 0.19 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.89 1sbo h GLU 109 Cb -0.04 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.61 1sbo h GLU 109 CO -0.06 0.00 0.00 0.00 -1.16 0.00 0.00 179.01 177.79