#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 -0.08 -0.39 3.17 4.22 -1.26 -5.10 114.94 115.50 1sbo s ASN 2 Ca 0.00 -0.76 0.04 0.00 -2.14 0.00 0.00 52.86 50.00 1sbo s ASN 2 Cb 0.00 0.65 0.16 0.00 1.28 0.00 0.00 41.25 43.35 1sbo s ASN 2 CO 0.00 -1.26 0.44 0.21 -2.04 0.00 0.00 177.10 174.45 1sbo s ASN 3 N -3.11 0.54 -0.26 3.54 2.47 -1.26 -5.13 114.94 111.73 1sbo s ASN 3 Ca 0.16 -1.60 -0.03 0.00 0.42 0.00 0.00 52.86 51.81 1sbo s ASN 3 Cb -0.04 0.82 0.15 0.00 -1.45 0.00 0.00 41.25 40.72 1sbo s ASN 3 CO 0.07 -0.22 0.48 -0.22 -3.72 0.00 0.00 177.10 173.49 1sbo s LEU 4 N 1.33 -0.93 -0.09 3.21 2.96 -1.26 -3.36 118.68 120.53 1sbo s LEU 4 Ca 0.19 0.68 -0.32 0.00 -0.22 0.00 0.00 54.13 54.47 1sbo s LEU 4 Cb -0.11 1.61 0.12 0.00 0.50 0.00 0.00 46.19 48.31 1sbo s LEU 4 CO -0.04 -0.27 1.04 -0.54 -1.32 0.00 0.00 176.35 175.21 1sbo s LYS 5 N 2.69 0.58 0.16 1.98 1.02 -1.06 -4.99 119.74 120.12 1sbo s LYS 5 Ca 0.12 -0.21 -0.01 0.00 0.02 0.00 0.00 55.97 55.88 1sbo s LYS 5 Cb -0.14 0.27 -0.04 0.00 -0.52 0.00 0.00 37.83 37.39 1sbo s LYS 5 CO -0.17 -0.25 0.35 -0.48 -0.92 0.00 0.00 175.35 173.87 1sbo s LEU 6 N -2.34 4.27 -0.01 3.17 -0.00 -1.26 -0.14 118.68 122.36 1sbo s LEU 6 Ca 0.07 0.41 0.03 0.00 -0.00 0.00 0.00 54.13 54.64 1sbo s LEU 6 Cb -0.01 -3.15 -0.04 0.00 -0.00 0.00 0.00 46.19 42.99 1sbo s LEU 6 CO -0.07 0.03 0.05 0.47 -0.00 0.00 0.00 176.35 176.82 1sbo n ASP 7 N -0.29 4.33 -2.04 1.48 9.92 0.43 -4.94 116.55 125.44 1sbo n ASP 7 Ca -0.04 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.22 1sbo n ASP 7 Cb 0.53 0.94 0.00 0.00 -0.64 0.00 0.00 41.12 41.95 1sbo n ASP 7 CO 0.00 0.00 0.00 -0.38 0.13 0.00 0.00 177.20 176.95 1sbo n ILE 8 N -1.77 -1.52 -3.61 0.53 5.41 -1.25 -4.88 119.36 112.27 1sbo n ILE 8 Ca -0.02 0.36 -0.29 0.00 1.00 0.00 0.00 62.75 63.80 1sbo n ILE 8 Cb 0.25 -2.01 -0.14 0.00 -0.71 0.00 0.00 39.64 37.03 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 -0.07 0.53 -0.22 1.39 1.01 0.66 -4.96 120.40 118.74 1sbo s VAL 9 Ca 0.00 -1.49 -0.29 0.00 0.00 0.00 0.00 61.98 60.20 1sbo s VAL 9 Cb 0.00 -1.40 -0.02 0.00 0.00 0.00 0.00 36.38 34.96 1sbo s VAL 9 CO 0.00 -0.80 1.42 -1.61 0.00 0.00 0.00 175.10 174.11 1sbo s GLU 10 N 1.41 3.99 0.00 2.72 2.02 -1.26 -0.17 118.70 127.41 1sbo s GLU 10 Ca 0.13 1.58 0.00 0.00 0.02 0.00 0.00 54.97 56.70 1sbo s GLU 10 Cb -0.19 -3.91 0.00 0.00 0.10 0.00 0.00 34.13 30.13 1sbo s GLU 10 CO -0.18 -1.04 0.00 0.94 0.02 0.00 0.00 175.26 175.00 1sbo n GLN 11 N 7.22 3.18 0.27 1.61 0.00 0.35 -4.91 117.38 125.10 1sbo n GLN 11 Ca 0.16 0.00 -0.14 0.00 -0.00 0.00 0.00 57.00 57.02 1sbo n GLN 11 Cb 0.45 0.00 -0.07 0.00 0.00 0.00 0.00 30.24 30.62 1sbo n GLN 11 CO 0.00 0.00 0.00 0.22 0.00 0.00 0.00 177.06 177.28 1sbo h ASP 12 N 0.00 -0.59 0.00 1.69 3.58 -2.02 -3.40 116.42 115.67 1sbo h ASP 12 Ca 0.00 -0.06 0.00 0.00 0.42 0.00 0.00 57.03 57.39 1sbo h ASP 12 Cb 0.00 0.15 0.00 0.00 1.72 0.00 0.00 39.33 41.20 1sbo h ASP 12 CO 0.00 -0.24 -0.01 -0.67 -2.88 0.00 0.00 179.24 175.45 1sbo n ASP 13 N -5.29 0.09 -4.26 2.28 2.03 -1.26 -5.04 116.55 105.10 1sbo n ASP 13 Ca -0.11 -1.06 -0.31 0.00 0.52 0.00 0.00 54.79 53.83 1sbo n ASP 13 Cb 0.32 -0.00 -0.16 0.00 -0.72 0.00 0.00 41.12 40.56 1sbo n ASP 13 CO 0.00 0.00 0.00 -1.59 -1.92 0.00 0.00 177.20 173.69 1sbo s LYS 14 N -0.05 2.34 -0.34 -0.67 -2.85 -1.26 -2.99 119.74 113.92 1sbo s LYS 14 Ca 0.00 -0.87 -0.19 0.00 -1.00 0.00 0.00 55.97 53.91 1sbo s LYS 14 Cb 0.00 -2.05 -0.00 0.00 -2.06 0.00 0.00 37.83 33.72 1sbo s LYS 14 CO 0.00 0.41 0.57 0.00 0.10 0.00 0.00 175.35 176.43 1sbo s ALA 15 N -0.26 3.49 -0.91 0.59 0.00 0.10 -0.49 121.76 124.27 1sbo s ALA 15 Ca -0.00 -0.88 -0.23 0.00 0.00 0.00 0.00 51.96 50.85 1sbo s ALA 15 Cb -0.12 -3.07 0.07 0.00 0.00 0.00 0.00 23.12 19.99 1sbo s ALA 15 CO 0.02 -1.20 1.30 0.42 0.00 0.00 0.00 175.76 176.30 1sbo s ILE 16 N 2.52 4.10 -1.03 0.00 1.01 0.76 -1.12 121.20 127.44 1sbo s ILE 16 Ca 0.22 -0.68 -0.23 0.00 0.00 0.00 0.00 60.65 59.96 1sbo s ILE 16 Cb -0.15 -4.94 0.04 0.00 0.01 0.00 0.00 42.46 37.43 1sbo s ILE 16 CO 0.13 -1.78 1.50 -0.69 0.00 0.00 0.00 174.94 174.10 1sbo s VAL 17 N 4.54 3.89 0.19 2.92 1.01 0.05 -0.25 120.40 132.76 1sbo s VAL 17 Ca 0.39 -0.79 -0.30 0.00 0.00 0.00 0.00 61.98 61.27 1sbo s VAL 17 Cb -0.04 -4.99 -0.09 0.00 0.00 0.00 0.00 36.38 31.26 1sbo s VAL 17 CO -0.03 -1.87 1.39 -0.13 0.00 0.00 0.00 175.10 174.46 1sbo s ARG 18 N 5.09 4.32 0.26 2.72 0.52 -1.26 -1.26 118.95 129.34 1sbo s ARG 18 Ca 0.48 2.17 0.03 0.00 -0.52 0.00 0.00 55.73 57.89 1sbo s ARG 18 Cb -0.00 -3.18 -0.03 0.00 0.52 0.00 0.00 34.95 32.26 1sbo s ARG 18 CO -0.08 -0.38 0.41 0.54 0.02 0.00 0.00 175.30 175.81 1sbo s VAL 19 N 0.40 5.21 0.03 3.52 0.11 -0.83 -0.43 120.40 128.41 1sbo s VAL 19 Ca 0.61 -0.76 0.03 0.00 -2.93 0.00 0.00 61.98 58.93 1sbo s VAL 19 Cb -0.39 -3.84 -0.02 0.00 -1.53 0.00 0.00 36.38 30.60 1sbo s VAL 19 CO 0.37 -0.37 -0.11 -1.10 -3.33 0.00 0.00 175.10 170.56 1sbo s GLN 20 N -3.98 0.74 0.00 1.54 -0.21 0.80 -4.50 119.66 114.04 1sbo s GLN 20 Ca 0.36 -0.61 0.00 0.00 0.02 0.00 0.00 55.36 55.13 1sbo s GLN 20 Cb -0.09 -0.68 0.00 0.00 1.00 0.00 0.00 33.01 33.24 1sbo s GLN 20 CO 0.31 0.17 0.00 0.41 -2.12 0.00 0.00 175.29 174.06 1sbo n GLY 21 N 2.09 0.91 3.27 3.09 0.00 -1.21 -2.56 105.19 110.77 1sbo n GLY 21 Ca -0.18 -1.62 -0.34 0.00 0.00 0.00 0.00 46.02 43.88 1sbo n GLY 21 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1sbo n ASP 22 N -0.38 -3.43 -4.04 1.61 5.75 -1.23 -3.82 116.55 111.01 1sbo n ASP 22 Ca 0.00 0.30 -0.31 0.00 -0.01 0.00 0.00 54.79 54.77 1sbo n ASP 22 Cb 0.00 -1.05 -0.16 0.00 -1.03 0.00 0.00 41.12 38.88 1sbo n ASP 22 CO 0.00 0.00 0.00 -0.51 -0.11 0.00 0.00 177.20 176.58 1sbo s ILE 23 N -2.22 1.76 0.22 2.12 2.07 -0.71 -4.93 121.20 119.52 1sbo s ILE 23 Ca 0.52 -0.87 0.04 0.00 -1.41 0.00 0.00 60.65 58.92 1sbo s ILE 23 Cb -0.22 -1.69 -0.01 0.00 0.13 0.00 0.00 42.46 40.67 1sbo s ILE 23 CO 0.72 0.38 0.14 -0.90 -1.91 0.00 0.00 174.94 173.37 1sbo n ASP 24 N 4.69 0.18 0.16 4.50 5.68 -1.26 -3.22 116.55 127.27 1sbo n ASP 24 Ca -0.17 -2.36 0.08 0.00 -0.50 0.00 0.00 54.79 51.84 1sbo n ASP 24 Cb 0.49 0.88 0.59 0.00 -1.14 0.00 0.00 41.12 41.94 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 1.57 1.98 0.01 2.12 0.00 -1.96 0.21 119.26 123.20 1sbo h ALA 25 Ca -0.17 -0.01 -0.22 0.00 0.00 0.00 0.00 54.91 54.52 1sbo h ALA 25 Cb 0.75 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.50 1sbo h ALA 25 CO 0.25 -0.01 -0.95 1.88 0.00 0.00 0.00 179.25 180.43 1sbo h TYR 26 N 0.14 0.47 0.00 0.00 0.05 -2.02 -3.16 116.97 112.45 1sbo h TYR 26 Ca 0.07 -0.26 0.00 0.00 0.05 0.00 0.00 58.73 58.59 1sbo h TYR 26 Cb 0.11 -0.05 0.00 0.00 1.01 0.00 0.00 36.73 37.80 1sbo h TYR 26 CO -0.00 1.09 -0.04 0.09 -1.05 0.00 0.00 178.16 178.25 1sbo n ASN 27 N -3.68 0.05 0.00 3.88 5.03 -0.44 -3.56 115.26 116.54 1sbo n ASN 27 Ca -0.06 0.44 0.06 0.00 0.87 0.00 0.00 54.58 55.90 1sbo n ASN 27 Cb 0.84 -0.45 0.30 0.00 -1.02 0.00 0.00 39.78 39.46 1sbo n ASN 27 CO 0.00 0.00 0.00 -0.24 -1.83 0.00 0.00 177.26 175.19 1sbo n SER 28 N -1.52 0.00 -0.02 6.41 2.88 0.61 -1.36 113.62 120.62 1sbo n SER 28 Ca 0.07 0.15 0.00 0.00 -1.33 0.00 0.00 58.87 57.76 1sbo n SER 28 Cb 0.34 -0.31 -0.07 0.00 -0.75 0.00 0.00 64.21 63.43 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 2.88 0.04 -3.46 3.41 -1.23 -4.54 113.62 109.41 1sbo n SER 29 Ca 0.05 0.00 -0.02 0.00 -0.26 0.00 0.00 58.87 58.65 1sbo n SER 29 Cb 0.10 1.07 -0.01 0.00 -0.26 0.00 0.00 64.21 65.11 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 -0.12 -0.77 4.33 4.81 -1.36 0.17 114.58 121.64 1sbo h GLU 30 Ca -0.12 0.01 0.16 0.00 -0.13 0.00 0.00 59.36 59.28 1sbo h GLU 30 Cb 0.98 0.03 -0.11 0.00 0.63 0.00 0.00 28.75 30.28 1sbo h GLU 30 CO 0.01 -0.08 0.25 1.25 -0.73 0.00 0.00 179.01 179.70 1sbo h LEU 31 N -0.28 0.14 -0.14 1.64 6.46 -1.73 0.29 115.31 121.68 1sbo h LEU 31 Ca -0.01 0.14 0.05 0.00 -0.12 0.00 0.00 57.88 57.93 1sbo h LEU 31 Cb 0.10 0.15 -0.07 0.00 -0.73 0.00 0.00 40.66 40.11 1sbo h LEU 31 CO 0.02 0.01 -0.36 0.50 -0.62 0.00 0.00 178.44 178.00 1sbo h LYS 32 N 0.34 -0.41 -0.53 1.25 3.64 -1.71 0.08 116.57 119.23 1sbo h LYS 32 Ca 0.44 0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.81 1sbo h LYS 32 Cb 0.74 0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.63 1sbo h LYS 32 CO -0.48 -0.27 0.20 1.05 -2.27 0.00 0.00 179.45 177.68 1sbo h GLU 33 N -0.43 0.80 0.00 1.90 4.11 0.17 -1.64 114.58 119.49 1sbo h GLU 33 Ca 0.09 -0.15 -0.02 0.00 0.07 0.00 0.00 59.36 59.35 1sbo h GLU 33 Cb 0.58 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 29.70 1sbo h GLU 33 CO -0.38 0.71 -0.10 1.96 0.07 0.00 0.00 179.01 181.27 1sbo h GLN 34 N 0.73 0.00 0.09 1.06 1.08 -0.33 0.10 115.11 117.84 1sbo h GLN 34 Ca 0.18 0.00 -0.28 0.00 -1.45 0.00 0.00 58.65 57.10 1sbo h GLN 34 Cb 0.21 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.63 1sbo h GLN 34 CO -0.01 0.10 -1.47 -0.07 -0.95 0.00 0.00 178.83 176.43 1sbo h LEU 35 N 0.00 0.30 -1.33 1.46 3.38 -0.73 -1.93 115.31 116.45 1sbo h LEU 35 Ca -0.00 -0.80 0.03 0.00 0.09 0.00 0.00 57.88 57.19 1sbo h LEU 35 Cb 0.31 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 40.92 1sbo h LEU 35 CO 0.01 1.63 0.47 0.08 0.09 0.00 0.00 178.44 180.72 1sbo h ARG 36 N -0.39 0.85 -0.35 1.13 0.11 -0.83 0.59 114.38 115.49 1sbo h ARG 36 Ca -0.33 -0.05 -0.08 0.00 0.10 0.00 0.00 59.98 59.62 1sbo h ARG 36 Cb 1.70 -0.19 -0.01 0.00 1.11 0.00 0.00 29.97 32.58 1sbo h ARG 36 CO 0.01 0.56 -0.08 -0.91 0.10 0.00 0.00 179.97 179.65 1sbo h ASN 37 N 0.87 0.68 0.03 0.08 2.35 -0.95 -1.80 115.58 116.84 1sbo h ASN 37 Ca 0.28 -0.36 -0.17 0.00 -0.55 0.00 0.00 56.30 55.50 1sbo h ASN 37 Cb 0.03 -0.19 0.01 0.00 0.05 0.00 0.00 38.32 38.23 1sbo h ASN 37 CO -0.08 0.88 -0.67 0.15 -1.65 0.00 0.00 177.43 176.06 1sbo h PHE 38 N 0.47 0.62 -1.01 1.19 3.57 -0.67 -2.47 116.94 118.63 1sbo h PHE 38 Ca 0.09 -0.36 0.24 0.00 3.53 0.00 0.00 57.97 61.48 1sbo h PHE 38 Cb 0.58 -0.06 -0.10 0.00 2.79 0.00 0.00 35.95 39.16 1sbo h PHE 38 CO 0.05 1.20 0.64 0.82 -2.23 0.00 0.00 178.31 178.79 1sbo h ILE 39 N -0.14 0.57 0.00 1.41 5.03 0.13 0.49 117.51 125.00 1sbo h ILE 39 Ca -0.09 -0.16 0.00 0.00 -0.12 0.00 0.00 64.86 64.48 1sbo h ILE 39 Cb 1.40 0.05 0.00 0.00 -3.03 0.00 0.00 36.82 35.24 1sbo h ILE 39 CO 0.13 0.09 0.00 -0.24 -0.68 0.00 0.00 178.15 177.45 1sbo n SER 40 N -4.67 0.67 -0.08 1.72 2.88 -0.68 -3.30 113.62 110.16 1sbo n SER 40 Ca 0.25 0.59 -0.12 0.00 -1.33 0.00 0.00 58.87 58.26 1sbo n SER 40 Cb 0.79 -0.76 -0.08 0.00 -0.75 0.00 0.00 64.21 63.41 1sbo n SER 40 CO 0.00 0.00 0.00 0.74 -1.23 0.00 0.00 175.04 174.55 1sbo h THR 41 N 0.00 0.85 -1.33 2.46 2.02 -0.35 -3.50 112.91 113.06 1sbo h THR 41 Ca 0.00 -1.78 -0.67 0.00 0.77 0.00 0.00 66.41 64.72 1sbo h THR 41 Cb 0.58 1.75 -0.01 0.00 -1.74 0.00 0.00 68.15 68.73 1sbo h THR 41 CO 0.00 0.29 1.28 1.07 0.37 0.00 0.00 175.52 178.52 1sbo n THR 42 N -4.59 0.28 -0.07 3.16 5.66 0.15 -4.86 114.28 114.00 1sbo n THR 42 Ca -0.14 -0.20 0.00 0.00 -3.05 0.00 0.00 64.05 60.66 1sbo n THR 42 Cb 0.40 -1.62 0.30 0.00 -1.55 0.00 0.00 70.33 67.86 1sbo n THR 42 CO 0.00 0.00 0.00 -1.28 -3.05 0.00 0.00 175.07 170.74 1sbo h SER 43 N 11.00 0.62 -3.22 1.09 0.87 -1.93 -3.42 113.55 118.55 1sbo h SER 43 Ca -0.34 -0.07 -0.57 0.00 -1.23 0.00 0.00 61.79 59.58 1sbo h SER 43 Cb 1.31 -0.16 -0.04 0.00 -0.44 0.00 0.00 62.40 63.07 1sbo h SER 43 CO 1.00 0.56 -0.14 -0.54 -0.53 0.00 0.00 176.83 177.17 1sbo s LYS 44 N -5.33 3.91 0.01 2.24 3.01 -1.26 -5.02 119.74 117.30 1sbo s LYS 44 Ca -0.09 0.39 -0.18 0.00 -1.01 0.00 0.00 55.97 55.08 1sbo s LYS 44 Cb 0.16 -2.99 -0.29 0.00 -1.01 0.00 0.00 37.83 33.70 1sbo s LYS 44 CO 0.77 0.53 1.02 0.87 0.51 0.00 0.00 175.35 179.05 1sbo h LYS 45 N 3.75 0.46 -6.00 1.68 1.57 -1.80 -3.42 116.57 112.81 1sbo h LYS 45 Ca -0.49 -0.65 -0.60 0.00 -1.87 0.00 0.00 60.65 57.04 1sbo h LYS 45 Cb 1.20 0.22 -0.11 0.00 0.08 0.00 0.00 32.23 33.62 1sbo h LYS 45 CO 0.65 1.28 1.27 0.21 -0.57 0.00 0.00 179.45 182.30 1sbo s LYS 46 N -2.81 3.48 -0.61 3.15 2.20 -1.20 -0.81 119.74 123.14 1sbo s LYS 46 Ca -0.12 -0.99 -0.25 0.00 -0.36 0.00 0.00 55.97 54.26 1sbo s LYS 46 Cb 0.03 -4.99 0.05 0.00 -1.51 0.00 0.00 37.83 31.41 1sbo s LYS 46 CO 0.88 -2.12 1.02 0.42 -0.36 0.00 0.00 175.35 175.19 1sbo s ILE 47 N 4.82 4.23 -0.05 5.43 -1.09 -1.21 0.02 121.20 133.35 1sbo s ILE 47 Ca 0.41 0.18 -0.13 0.00 -2.23 0.00 0.00 60.65 58.87 1sbo s ILE 47 Cb -0.03 -4.66 -0.05 0.00 -1.58 0.00 0.00 42.46 36.14 1sbo s ILE 47 CO -0.03 -1.35 0.35 -0.69 -1.23 0.00 0.00 174.94 171.99 1sbo s VAL 48 N 4.35 5.16 -0.28 2.92 1.01 -0.27 -1.19 120.40 132.10 1sbo s VAL 48 Ca 0.30 0.70 -0.00 0.00 0.00 0.00 0.00 61.98 62.98 1sbo s VAL 48 Cb -0.13 -3.65 0.05 0.00 0.00 0.00 0.00 36.38 32.65 1sbo s VAL 48 CO 0.17 0.55 -0.05 -0.76 0.00 0.00 0.00 175.10 175.00 1sbo s LEU 49 N -0.76 3.60 -0.36 3.92 2.01 0.10 -0.77 118.68 126.42 1sbo s LEU 49 Ca 0.21 -1.24 -0.21 0.00 0.01 0.00 0.00 54.13 52.91 1sbo s LEU 49 Cb -0.15 -1.65 0.00 0.00 0.01 0.00 0.00 46.19 44.40 1sbo s LEU 49 CO 0.10 -0.21 0.65 -0.62 1.01 0.00 0.00 176.35 177.28 1sbo s ASP 50 N 1.22 6.43 -0.27 2.29 2.15 -0.39 0.18 116.67 128.28 1sbo s ASP 50 Ca -0.05 0.14 0.12 0.00 0.43 0.00 0.00 52.55 53.18 1sbo s ASP 50 Cb -0.19 -2.33 0.60 0.00 -0.30 0.00 0.00 42.92 40.69 1sbo s ASP 50 CO -0.03 -0.61 1.57 0.18 -0.17 0.00 0.00 175.17 176.11 1sbo n LEU 51 N 6.09 4.76 0.30 -1.34 4.77 0.76 -1.97 117.00 130.37 1sbo n LEU 51 Ca -0.01 -3.32 0.20 0.00 -0.03 0.00 0.00 56.01 52.86 1sbo n LEU 51 Cb 0.48 -0.64 0.97 0.00 -2.33 0.00 0.00 43.42 41.90 1sbo n LEU 51 CO 0.50 0.89 1.09 0.77 -1.33 0.00 0.00 177.39 179.31 1sbo h SER 52 N 1.82 0.00 -0.01 -1.43 4.64 -1.17 -0.52 113.55 116.88 1sbo h SER 52 Ca 0.17 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.49 1sbo h SER 52 Cb 1.84 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.93 1sbo h SER 52 CO 0.47 0.00 -0.40 -1.20 -0.87 0.00 0.00 176.83 174.83 1sbo n SER 53 N -3.04 1.52 -4.53 4.97 7.64 -1.26 -4.89 113.62 114.03 1sbo n SER 53 Ca -0.01 -1.26 -0.42 0.00 1.01 0.00 0.00 58.87 58.19 1sbo n SER 53 Cb 0.17 0.55 -0.03 0.00 -1.01 0.00 0.00 64.21 63.88 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 -2.01 3.94 -0.10 0.44 1.01 -0.20 -3.47 120.40 120.01 1sbo s VAL 54 Ca 0.12 0.29 0.16 0.00 0.00 0.00 0.00 61.98 62.55 1sbo s VAL 54 Cb 0.13 -4.82 -0.21 0.00 0.00 0.00 0.00 36.38 31.49 1sbo s VAL 54 CO 0.45 -1.65 0.58 -1.20 0.00 0.00 0.00 175.10 173.28 1sbo n SER 55 N 8.75 0.64 -4.09 3.32 7.64 -1.26 -4.58 113.62 124.04 1sbo n SER 55 Ca 0.02 0.30 -0.12 0.00 1.01 0.00 0.00 58.87 60.07 1sbo n SER 55 Cb 0.48 0.34 -0.11 0.00 -1.01 0.00 0.00 64.21 63.91 1sbo n SER 55 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 1sbo s TYR 56 N -2.73 0.73 -0.12 1.43 5.04 -1.26 -4.83 117.35 115.61 1sbo s TYR 56 Ca -0.05 -0.62 -0.07 0.00 -2.44 0.00 0.00 57.07 53.89 1sbo s TYR 56 Cb 0.08 -0.43 0.04 0.00 0.35 0.00 0.00 41.96 42.00 1sbo s TYR 56 CO 0.83 -0.10 0.29 1.41 -1.34 0.00 0.00 175.55 176.63 1sbo s MET 57 N -2.22 0.27 0.59 4.97 -2.45 -1.25 -1.74 119.30 117.47 1sbo s MET 57 Ca -0.04 0.55 0.07 0.00 -1.25 0.00 0.00 55.69 55.02 1sbo s MET 57 Cb -0.06 -0.03 0.10 0.00 1.25 0.00 0.00 34.83 36.10 1sbo s MET 57 CO -0.01 -0.13 0.81 -3.47 1.05 0.00 0.00 175.02 173.27 1sbo n ASP 58 N 3.90 1.86 0.00 1.11 2.03 -1.20 -4.97 116.55 119.28 1sbo n ASP 58 Ca -0.22 -2.39 0.05 0.00 0.52 0.00 0.00 54.79 52.75 1sbo n ASP 58 Cb 0.55 -0.46 0.23 0.00 -0.72 0.00 0.00 41.12 40.71 1sbo n ASP 58 CO 0.00 0.00 0.00 -1.20 -1.92 0.00 0.00 177.20 174.08 1sbo n SER 59 N -2.48 0.00 -0.14 1.67 7.64 -1.26 -1.70 113.62 117.34 1sbo n SER 59 Ca 0.16 0.25 -0.11 0.00 1.01 0.00 0.00 58.87 60.17 1sbo n SER 59 Cb 0.57 -0.34 -0.01 0.00 -1.01 0.00 0.00 64.21 63.42 1sbo n SER 59 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1sbo h ALA 60 N 2.41 0.59 -0.60 -0.43 0.00 -1.93 -3.32 119.26 115.97 1sbo h ALA 60 Ca 0.00 -0.35 0.05 0.00 0.00 0.00 0.00 54.91 54.61 1sbo h ALA 60 Cb 0.11 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.72 1sbo h ALA 60 CO 0.00 0.51 0.40 0.78 0.00 0.00 0.00 179.25 180.94 1sbo h GLY 61 N 0.67 0.77 1.02 0.00 0.00 -1.62 -1.00 103.07 102.91 1sbo h GLY 61 Ca 0.10 -0.26 -0.04 0.00 0.00 0.00 0.00 47.33 47.13 1sbo h GLY 61 CO 0.05 0.21 -0.43 1.41 0.00 0.00 0.00 176.54 177.78 1sbo h LEU 62 N 0.65 -1.01 0.00 3.11 3.38 -1.71 -1.99 115.31 117.73 1sbo h LEU 62 Ca 0.25 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.26 1sbo h LEU 62 Cb 0.18 0.26 0.00 0.00 0.09 0.00 0.00 40.66 41.19 1sbo h LEU 62 CO -0.07 -0.72 0.00 0.61 0.09 0.00 0.00 178.44 178.34 1sbo n GLY 63 N -1.60 -0.46 0.03 0.83 0.00 -0.61 -0.35 105.19 103.03 1sbo n GLY 63 Ca -0.16 -0.03 0.11 0.00 0.00 0.00 0.00 46.02 45.95 1sbo n GLY 63 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1sbo n THR 64 N -1.27 0.14 -0.01 2.61 -1.04 -0.48 -4.26 114.28 109.97 1sbo n THR 64 Ca 0.03 -0.34 -0.02 0.00 -2.04 0.00 0.00 64.05 61.68 1sbo n THR 64 Cb 0.04 0.18 -0.01 0.00 -1.82 0.00 0.00 70.33 68.72 1sbo n THR 64 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1sbo n LEU 65 N -2.09 2.07 0.23 -4.42 4.77 -0.11 -4.45 117.00 112.99 1sbo n LEU 65 Ca -0.00 0.00 0.08 0.00 -0.03 0.00 0.00 56.01 56.06 1sbo n LEU 65 Cb 0.48 -0.08 0.57 0.00 -2.33 0.00 0.00 43.42 42.06 1sbo n LEU 65 CO 0.43 0.38 0.91 1.62 -1.33 0.00 0.00 177.39 179.40 1sbo h VAL 66 N -0.03 0.92 -0.72 4.08 3.04 -0.95 -1.03 116.25 121.56 1sbo h VAL 66 Ca -0.06 -0.67 0.04 0.00 -1.01 0.00 0.00 66.70 65.00 1sbo h VAL 66 Cb 1.08 1.38 -0.05 0.00 -2.01 0.00 0.00 31.29 31.69 1sbo h VAL 66 CO -0.02 0.18 0.44 1.62 -1.01 0.00 0.00 177.57 178.78 1sbo h VAL 67 N 0.00 1.07 0.00 1.51 3.04 -1.76 -2.75 116.25 117.37 1sbo h VAL 67 Ca -0.00 -0.29 -0.02 0.00 -1.01 0.00 0.00 66.70 65.38 1sbo h VAL 67 Cb 0.37 0.15 -0.00 0.00 -2.01 0.00 0.00 31.29 29.79 1sbo h VAL 67 CO 0.02 0.16 -0.08 0.40 -1.01 0.00 0.00 177.57 177.06 1sbo h ILE 68 N 0.85 0.28 -0.99 3.17 1.08 -1.40 -1.73 117.51 118.78 1sbo h ILE 68 Ca 0.29 -0.57 0.11 0.00 -0.39 0.00 0.00 64.86 64.30 1sbo h ILE 68 Cb 0.06 1.44 -0.08 0.00 -3.07 0.00 0.00 36.82 35.17 1sbo h ILE 68 CO -0.13 0.08 0.63 0.25 -0.69 0.00 0.00 178.15 178.29 1sbo h LEU 69 N 0.00 0.93 0.27 1.44 5.85 -1.41 0.42 115.31 122.81 1sbo h LEU 69 Ca -0.00 0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.74 1sbo h LEU 69 Cb 0.43 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 41.31 1sbo h LEU 69 CO 0.01 0.52 -0.13 0.50 -0.34 0.00 0.00 178.44 179.00 1sbo h LYS 70 N 1.01 -0.35 -0.87 1.25 3.64 -1.46 -3.14 116.57 116.65 1sbo h LYS 70 Ca 0.47 0.02 0.23 0.00 -1.27 0.00 0.00 60.65 60.10 1sbo h LYS 70 Cb 0.42 0.08 -0.14 0.00 -0.41 0.00 0.00 32.23 32.18 1sbo h LYS 70 CO -0.23 -0.24 0.20 -0.44 -2.27 0.00 0.00 179.45 176.47 1sbo h ASP 71 N -0.70 -0.06 0.44 4.20 3.32 -1.23 0.18 116.42 122.56 1sbo h ASP 71 Ca -0.04 0.20 -0.02 0.00 0.02 0.00 0.00 57.03 57.19 1sbo h ASP 71 Cb 0.28 0.28 0.00 0.00 0.22 0.00 0.00 39.33 40.12 1sbo h ASP 71 CO 0.06 -0.17 -0.21 0.00 -1.72 0.00 0.00 179.24 177.20 1sbo h ALA 72 N 1.78 -0.60 -0.84 3.45 0.00 -1.10 -2.82 119.26 119.13 1sbo h ALA 72 Ca 0.54 -0.14 0.17 0.00 0.00 0.00 0.00 54.91 55.47 1sbo h ALA 72 Cb 1.07 0.23 -0.10 0.00 0.00 0.00 0.00 17.79 18.98 1sbo h ALA 72 CO -0.67 -0.82 0.39 -0.22 0.00 0.00 0.00 179.25 177.93 1sbo h LYS 73 N -0.63 0.50 -0.46 0.00 3.64 -0.69 0.18 116.57 119.11 1sbo h LYS 73 Ca -0.06 -0.03 0.07 0.00 -1.27 0.00 0.00 60.65 59.36 1sbo h LYS 73 Cb 0.48 -0.11 -0.06 0.00 -0.41 0.00 0.00 32.23 32.12 1sbo h LYS 73 CO 0.10 0.33 0.11 0.82 -2.27 0.00 0.00 179.45 178.54 1sbo h ILE 74 N 0.51 0.78 -0.01 2.00 2.04 -0.87 -1.01 117.51 120.96 1sbo h ILE 74 Ca 0.48 -0.09 0.00 0.00 1.00 0.00 0.00 64.86 66.25 1sbo h ILE 74 Cb 0.76 0.50 0.00 0.00 -0.74 0.00 0.00 36.82 37.34 1sbo h ILE 74 CO -0.42 0.05 -0.02 -3.20 0.00 0.00 0.00 178.15 174.55 1sbo n ASN 75 N -5.07 0.86 -2.07 1.72 2.85 -0.36 -4.92 115.26 108.27 1sbo n ASN 75 Ca 0.04 -1.20 -0.12 0.00 -0.11 0.00 0.00 54.58 53.20 1sbo n ASN 75 Cb 0.21 -0.00 0.04 0.00 1.24 0.00 0.00 39.78 41.26 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 1.14 0.19 3.62 8.20 0.00 0.18 -5.06 105.19 113.45 1sbo n GLY 76 Ca 0.20 -0.21 -0.28 0.00 0.00 0.00 0.00 46.02 45.73 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 -5.54 2.26 0.93 1.61 -0.14 0.40 -4.94 119.74 114.32 1sbo s LYS 77 Ca 0.26 -1.10 -0.13 0.00 -1.36 0.00 0.00 55.97 53.64 1sbo s LYS 77 Cb -0.11 -2.31 0.21 0.00 -1.68 0.00 0.00 37.83 33.93 1sbo s LYS 77 CO 0.36 0.47 1.26 -1.91 -0.76 0.00 0.00 175.35 174.78 1sbo n GLU 78 N 0.19 -1.02 -3.65 1.68 4.07 0.01 -3.63 120.64 118.29 1sbo n GLU 78 Ca -0.11 -2.24 -0.07 0.00 -0.06 0.00 0.00 57.16 54.68 1sbo n GLU 78 Cb 0.54 -1.21 -0.08 0.00 -0.06 0.00 0.00 31.44 30.64 1sbo n GLU 78 CO 0.00 0.00 0.00 0.12 -0.06 0.00 0.00 177.13 177.19 1sbo s PHE 79 N -3.73 -0.98 0.05 4.31 5.36 -1.26 -3.30 117.98 118.43 1sbo s PHE 79 Ca 0.74 1.95 -0.08 0.00 -0.96 0.00 0.00 56.93 58.58 1sbo s PHE 79 Cb -0.02 0.56 -0.00 0.00 -0.34 0.00 0.00 43.02 43.21 1sbo s PHE 79 CO 0.51 -0.50 0.15 0.42 -1.46 0.00 0.00 175.22 174.34 1sbo s ILE 80 N 1.75 0.13 0.10 3.12 1.01 -0.33 -4.75 121.20 122.22 1sbo s ILE 80 Ca -0.09 -1.06 0.09 0.00 0.00 0.00 0.00 60.65 59.59 1sbo s ILE 80 Cb -0.07 -1.02 -0.04 0.00 0.01 0.00 0.00 42.46 41.34 1sbo s ILE 80 CO -0.18 -0.58 -0.22 -0.76 0.00 0.00 0.00 174.94 173.20 1sbo s LEU 81 N -2.30 2.51 0.10 2.97 1.43 0.11 -0.72 118.68 122.79 1sbo s LEU 81 Ca -0.02 -0.59 -0.02 0.00 -1.03 0.00 0.00 54.13 52.47 1sbo s LEU 81 Cb 0.01 -1.41 -0.04 0.00 0.03 0.00 0.00 46.19 44.77 1sbo s LEU 81 CO -0.06 0.20 0.04 -0.44 0.23 0.00 0.00 176.35 176.33 1sbo s SER 82 N -1.88 0.35 -0.91 2.29 0.01 0.13 -0.80 113.70 112.88 1sbo s SER 82 Ca 0.15 -1.11 -0.04 0.00 1.31 0.00 0.00 55.95 56.27 1sbo s SER 82 Cb -0.10 0.27 -0.04 0.00 0.21 0.00 0.00 66.02 66.36 1sbo s SER 82 CO 0.07 -0.69 0.82 -0.24 0.41 0.00 0.00 173.24 173.61 1sbo n SER 83 N -0.03 -7.09 -4.88 2.44 2.88 -0.83 -0.17 113.62 105.95 1sbo n SER 83 Ca -0.09 -0.44 -0.32 0.00 -1.33 0.00 0.00 58.87 56.69 1sbo n SER 83 Cb 0.63 -5.22 -0.05 0.00 -0.75 0.00 0.00 64.21 58.81 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 -4.80 4.20 0.52 2.46 2.01 -1.26 -0.76 118.68 121.05 1sbo s LEU 84 Ca 0.27 0.86 -0.17 0.00 0.01 0.00 0.00 54.13 55.11 1sbo s LEU 84 Cb -0.04 -3.57 -0.08 0.00 0.01 0.00 0.00 46.19 42.52 1sbo s LEU 84 CO 0.74 -0.03 0.99 -0.54 1.01 0.00 0.00 176.35 178.52 1sbo s LYS 85 N -2.71 3.92 0.45 1.70 1.02 -1.26 -4.89 119.74 117.97 1sbo s LYS 85 Ca 0.45 0.98 0.12 0.00 0.02 0.00 0.00 55.97 57.54 1sbo s LYS 85 Cb -0.12 -2.13 1.02 0.00 -0.52 0.00 0.00 37.83 36.08 1sbo s LYS 85 CO 0.22 -0.30 2.06 1.49 -0.92 0.00 0.00 175.35 177.90 1sbo h GLU 86 N 0.92 0.21 0.00 1.68 4.81 -1.97 0.15 114.58 120.39 1sbo h GLU 86 Ca -0.47 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.74 1sbo h GLU 86 Cb 1.19 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 30.52 1sbo h GLU 86 CO 0.61 0.20 0.00 0.77 -0.73 0.00 0.00 179.01 179.87 1sbo h SER 87 N 0.22 0.00 0.04 1.04 0.02 -1.93 -2.49 113.55 110.45 1sbo h SER 87 Ca 0.05 0.00 -0.38 0.00 -0.84 0.00 0.00 61.79 60.63 1sbo h SER 87 Cb 0.09 0.00 -0.06 0.00 0.14 0.00 0.00 62.40 62.57 1sbo h SER 87 CO -0.00 0.00 -2.35 -0.38 -1.14 0.00 0.00 176.83 172.96 1sbo n ILE 88 N -2.96 1.54 -0.11 3.27 2.08 -0.06 -3.60 119.36 119.52 1sbo n ILE 88 Ca 0.03 -0.63 -0.09 0.00 0.56 0.00 0.00 62.75 62.62 1sbo n ILE 88 Cb 0.44 -1.34 -0.01 0.00 -0.75 0.00 0.00 39.64 37.98 1sbo n ILE 88 CO 0.00 0.00 0.00 -1.28 0.56 0.00 0.00 176.55 175.83 1sbo h SER 89 N 0.01 0.43 -0.92 4.38 0.87 -0.83 -0.36 113.55 117.13 1sbo h SER 89 Ca -0.53 -0.08 0.08 0.00 -1.23 0.00 0.00 61.79 60.03 1sbo h SER 89 Cb 1.98 -0.11 -0.06 0.00 -0.44 0.00 0.00 62.40 63.76 1sbo h SER 89 CO -0.03 0.38 0.59 0.08 -0.53 0.00 0.00 176.83 177.32 1sbo h ARG 90 N 0.44 0.96 -0.21 2.24 0.11 -1.64 -1.08 114.38 115.20 1sbo h ARG 90 Ca 0.12 -0.06 -0.03 0.00 0.10 0.00 0.00 59.98 60.11 1sbo h ARG 90 Cb 0.04 -0.22 -0.01 0.00 1.11 0.00 0.00 29.97 30.90 1sbo h ARG 90 CO -0.02 0.64 0.02 0.82 0.10 0.00 0.00 179.97 181.52 1sbo h ILE 91 N 0.99 1.24 -0.50 0.08 2.04 -1.19 0.24 117.51 120.42 1sbo h ILE 91 Ca 0.41 -0.82 -0.02 0.00 1.00 0.00 0.00 64.86 65.43 1sbo h ILE 91 Cb 0.28 1.37 -0.02 0.00 -0.74 0.00 0.00 36.82 37.71 1sbo h ILE 91 CO -0.17 0.25 0.24 -0.07 0.00 0.00 0.00 178.15 178.40 1sbo h LEU 92 N 0.14 0.65 0.28 1.44 3.38 -0.92 -0.50 115.31 119.78 1sbo h LEU 92 Ca 0.06 -0.13 -0.01 0.00 0.09 0.00 0.00 57.88 57.90 1sbo h LEU 92 Cb 0.36 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 1sbo h LEU 92 CO 0.01 0.60 -0.19 0.50 0.09 0.00 0.00 178.44 179.45 1sbo h LYS 93 N 0.66 -0.45 -0.20 1.13 3.64 -0.78 0.53 116.57 121.10 1sbo h LYS 93 Ca 0.17 0.03 0.05 0.00 -1.27 0.00 0.00 60.65 59.63 1sbo h LYS 93 Cb 0.12 0.10 -0.07 0.00 -0.41 0.00 0.00 32.23 31.97 1sbo h LYS 93 CO -0.02 -0.30 -0.42 -0.07 -2.27 0.00 0.00 179.45 176.37 1sbo h LEU 94 N -0.46 -1.34 -1.04 5.20 3.38 -0.45 -1.09 115.31 119.51 1sbo h LEU 94 Ca -0.02 0.18 0.00 0.00 0.09 0.00 0.00 57.88 58.13 1sbo h LEU 94 Cb 0.40 0.56 0.00 0.00 0.09 0.00 0.00 40.66 41.70 1sbo h LEU 94 CO 0.01 -0.41 0.00 0.41 0.09 0.00 0.00 178.44 178.54 1sbo n THR 95 N -5.43 0.33 -0.71 0.22 -1.04 -0.20 -4.87 114.28 102.58 1sbo n THR 95 Ca -0.03 -0.20 0.00 0.00 -2.04 0.00 0.00 64.05 61.78 1sbo n THR 95 Cb 0.36 -0.26 0.00 0.00 -1.82 0.00 0.00 70.33 68.61 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 0.00 0.00 -0.16 -1.42 8.25 -0.11 -4.84 115.22 116.94 1sbo n HIS 96 Ca 0.04 0.00 0.07 0.00 -0.26 0.00 0.00 57.72 57.57 1sbo n HIS 96 Cb 0.29 -1.70 0.37 0.00 1.12 0.00 0.00 29.99 30.07 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 0.63 -1.83 2.41 4.07 -0.26 -2.08 115.31 118.26 1sbo h LEU 97 Ca 0.00 0.00 -0.02 0.00 0.08 0.00 0.00 57.88 57.94 1sbo h LEU 97 Cb 0.45 -0.13 -0.00 0.00 1.08 0.00 0.00 40.66 42.05 1sbo h LEU 97 CO 0.00 0.41 -0.08 -0.78 -1.08 0.00 0.00 178.44 176.91 1sbo h ASP 98 N 0.72 0.00 -0.05 -0.43 3.58 -1.74 0.26 116.42 118.75 1sbo h ASP 98 Ca 0.30 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.75 1sbo h ASP 98 Cb 0.26 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.31 1sbo h ASP 98 CO -0.10 0.08 0.00 2.29 -2.88 0.00 0.00 179.24 178.64 1sbo n LYS 99 N -3.35 1.39 0.00 0.28 2.85 -0.78 -4.27 118.16 114.28 1sbo n LYS 99 Ca -0.01 -0.58 0.00 0.00 -1.05 0.00 0.00 58.31 56.67 1sbo n LYS 99 Cb 0.26 -1.42 0.00 0.00 -0.65 0.00 0.00 35.03 33.22 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 -0.25 0.00 -1.67 0.58 -5.35 0.01 -5.07 119.36 107.61 1sbo n ILE 100 Ca 0.18 0.00 -0.15 0.00 -0.27 0.00 0.00 62.75 62.51 1sbo n ILE 100 Cb 0.23 -0.12 0.10 0.00 -1.74 0.00 0.00 39.64 38.11 1sbo n ILE 100 CO 0.00 0.00 0.00 0.49 -1.76 0.00 0.00 176.55 175.28 1sbo n PHE 101 N -0.93 -3.83 -4.64 4.28 3.01 0.71 -5.11 117.46 110.95 1sbo n PHE 101 Ca 0.00 -0.68 -0.27 0.00 1.01 0.00 0.00 57.45 57.51 1sbo n PHE 101 Cb 0.11 -0.51 -0.17 0.00 -0.01 0.00 0.00 39.48 38.91 1sbo n PHE 101 CO 0.00 0.00 0.00 0.21 1.01 0.00 0.00 176.76 177.98 1sbo s LYS 102 N -4.38 2.14 -0.15 -1.08 2.20 -1.26 -4.89 119.74 112.31 1sbo s LYS 102 Ca 0.39 -0.55 -0.01 0.00 -0.36 0.00 0.00 55.97 55.44 1sbo s LYS 102 Cb -0.01 -1.75 0.04 0.00 -1.51 0.00 0.00 37.83 34.60 1sbo s LYS 102 CO 0.27 0.01 -0.03 0.42 -0.36 0.00 0.00 175.35 175.66 1sbo s ILE 103 N 0.75 0.86 0.52 5.43 1.09 -1.25 -0.71 121.20 127.89 1sbo s ILE 103 Ca -0.12 -0.44 0.02 0.00 -1.10 0.00 0.00 60.65 59.01 1sbo s ILE 103 Cb -0.16 -1.08 -0.00 0.00 -1.06 0.00 0.00 42.46 40.17 1sbo s ILE 103 CO 0.02 0.12 0.09 0.42 -0.10 0.00 0.00 174.94 175.49 1sbo s THR 104 N 1.74 1.27 -0.22 2.92 -4.23 0.02 -4.99 115.64 112.16 1sbo s THR 104 Ca 0.02 -1.88 -0.06 0.00 -1.18 0.00 0.00 61.69 58.58 1sbo s THR 104 Cb -0.15 -2.15 -0.19 0.00 1.34 0.00 0.00 72.50 71.35 1sbo s THR 104 CO -0.07 0.00 -0.03 0.47 -0.54 0.00 0.00 174.62 174.45 1sbo n ASP 105 N -1.38 2.01 -4.39 3.99 9.92 -1.26 -1.96 116.55 123.47 1sbo n ASP 105 Ca -0.15 0.11 -0.27 0.00 -0.53 0.00 0.00 54.79 53.95 1sbo n ASP 105 Cb 0.66 -0.68 -0.12 0.00 -0.64 0.00 0.00 41.12 40.34 1sbo n ASP 105 CO 0.00 0.00 0.00 0.42 0.13 0.00 0.00 177.20 177.75 1sbo s THR 106 N -2.51 2.19 -0.20 -3.53 -4.23 -1.26 -3.01 115.64 103.08 1sbo s THR 106 Ca -0.31 -1.86 0.26 0.00 -1.18 0.00 0.00 61.69 58.59 1sbo s THR 106 Cb 0.09 -1.98 0.27 0.00 1.34 0.00 0.00 72.50 72.22 1sbo s THR 106 CO 0.63 -0.05 1.78 -0.37 -0.54 0.00 0.00 174.62 176.07 1sbo h VAL 107 N 3.56 0.00 0.04 2.29 -1.51 -1.92 -2.43 116.25 116.28 1sbo h VAL 107 Ca -0.48 -0.15 -0.23 0.00 -1.23 0.00 0.00 66.70 64.61 1sbo h VAL 107 Cb 1.19 0.83 0.00 0.00 -2.13 0.00 0.00 31.29 31.18 1sbo h VAL 107 CO 0.44 0.00 -1.02 -0.33 -1.23 0.00 0.00 177.57 175.43 1sbo h GLU 108 N 0.00 0.34 0.00 5.19 4.39 -2.01 -3.28 114.58 119.20 1sbo h GLU 108 Ca 0.00 -0.41 -0.09 0.00 0.34 0.00 0.00 59.36 59.19 1sbo h GLU 108 Cb 0.20 0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 28.97 1sbo h GLU 108 CO 0.00 1.11 -0.45 1.49 -1.16 0.00 0.00 179.01 180.01 1sbo h GLU 109 N 0.17 0.00 0.00 2.33 4.81 -1.84 -3.53 114.58 116.52 1sbo h GLU 109 Ca -0.09 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.14 1sbo h GLU 109 Cb 1.68 0.00 0.00 0.00 0.63 0.00 0.00 28.75 31.06 1sbo h GLU 109 CO 0.17 0.45 0.00 0.00 -0.73 0.00 0.00 179.01 178.90