#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 -0.43 -0.58 6.12 4.22 -1.26 -5.09 114.94 117.92 1sbo s ASN 2 Ca 0.00 -0.14 0.06 0.00 -2.14 0.00 0.00 52.86 50.64 1sbo s ASN 2 Cb 0.00 0.55 0.21 0.00 1.28 0.00 0.00 41.25 43.29 1sbo s ASN 2 CO 0.00 -0.93 0.57 -3.20 -2.04 0.00 0.00 177.10 171.50 1sbo n ASN 3 N -0.32 2.19 -4.67 3.54 5.15 -1.26 -5.05 115.26 114.84 1sbo n ASN 3 Ca -0.16 -3.06 -0.42 0.00 -0.60 0.00 0.00 54.58 50.33 1sbo n ASN 3 Cb 0.64 -0.67 -0.03 0.00 -0.53 0.00 0.00 39.78 39.19 1sbo n ASN 3 CO 0.00 0.00 0.00 -0.22 1.40 0.00 0.00 177.26 178.44 1sbo s LEU 4 N -1.53 4.41 0.00 1.20 2.96 -1.26 -3.90 118.68 120.56 1sbo s LEU 4 Ca 0.33 2.63 0.00 0.00 -0.22 0.00 0.00 54.13 56.88 1sbo s LEU 4 Cb 0.08 -3.54 0.00 0.00 0.50 0.00 0.00 46.19 43.23 1sbo s LEU 4 CO -0.11 -1.03 0.00 0.29 -1.32 0.00 0.00 176.35 174.19 1sbo n LYS 5 N 7.12 -2.22 -4.25 1.98 5.02 -1.15 -4.95 118.16 119.72 1sbo n LYS 5 Ca 0.19 0.00 -0.28 0.00 -2.02 0.00 0.00 58.31 56.20 1sbo n LYS 5 Cb 0.41 0.00 -0.09 0.00 -0.02 0.00 0.00 35.03 35.33 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 3.07 -0.19 -0.35 -0.00 -1.26 -0.29 118.68 119.65 1sbo s LEU 6 Ca 0.00 -0.47 -0.07 0.00 -0.00 0.00 0.00 54.13 53.60 1sbo s LEU 6 Cb 0.00 -1.79 -0.09 0.00 -0.00 0.00 0.00 46.19 44.31 1sbo s LEU 6 CO 0.00 0.13 -0.23 -0.67 -0.00 0.00 0.00 176.35 175.58 1sbo n ASP 7 N 0.28 1.70 -1.28 1.48 2.03 0.52 -4.95 116.55 116.32 1sbo n ASP 7 Ca -0.12 0.15 0.00 0.00 0.52 0.00 0.00 54.79 55.34 1sbo n ASP 7 Cb 0.54 -0.49 0.00 0.00 -0.72 0.00 0.00 41.12 40.45 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 -3.65 -6.32 -3.15 5.18 5.41 -1.25 -4.94 119.36 110.64 1sbo n ILE 8 Ca -0.37 1.83 -0.19 0.00 1.00 0.00 0.00 62.75 65.03 1sbo n ILE 8 Cb 0.79 -3.28 -0.06 0.00 -0.71 0.00 0.00 39.64 36.39 1sbo n ILE 8 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 176.55 177.07 1sbo n VAL 9 N 0.61 -0.76 -1.91 1.39 0.31 0.87 -4.93 118.33 113.91 1sbo n VAL 9 Ca 0.00 -2.60 -0.42 0.00 -0.01 0.00 0.00 64.34 61.31 1sbo n VAL 9 Cb 0.00 -0.70 -0.03 0.00 -0.91 0.00 0.00 33.84 32.21 1sbo n VAL 9 CO 0.00 0.00 0.00 -1.61 -1.32 0.00 0.00 176.83 173.90 1sbo s GLU 10 N 0.28 4.17 0.00 5.55 2.02 -1.26 -0.61 118.70 128.85 1sbo s GLU 10 Ca 0.32 2.32 0.00 0.00 0.02 0.00 0.00 54.97 57.63 1sbo s GLU 10 Cb 0.04 -3.97 0.00 0.00 0.10 0.00 0.00 34.13 30.30 1sbo s GLU 10 CO -0.15 -0.85 0.00 0.94 0.02 0.00 0.00 175.26 175.22 1sbo n GLN 11 N 6.98 3.53 0.00 1.61 -0.06 0.68 -4.88 117.38 125.25 1sbo n GLN 11 Ca 0.18 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 55.18 1sbo n GLN 11 Cb 0.42 0.00 0.00 0.00 -4.06 0.00 0.00 30.24 26.60 1sbo n GLN 11 CO 0.00 0.00 0.00 -0.25 -0.20 0.00 0.00 177.06 176.61 1sbo n ASP 12 N 0.00 0.00 -0.00 1.69 9.92 -1.26 -4.62 116.55 122.27 1sbo n ASP 12 Ca 0.00 0.76 0.05 0.00 -0.53 0.00 0.00 54.79 55.08 1sbo n ASP 12 Cb 0.00 -0.31 -0.07 0.00 -0.64 0.00 0.00 41.12 40.10 1sbo n ASP 12 CO 0.00 0.00 0.00 -0.90 0.13 0.00 0.00 177.20 176.43 1sbo n ASP 13 N -1.42 1.84 -4.37 -2.24 5.75 -1.26 -4.94 116.55 109.92 1sbo n ASP 13 Ca 0.00 -0.26 -0.34 0.00 -0.01 0.00 0.00 54.79 54.18 1sbo n ASP 13 Cb 0.00 1.31 -0.14 0.00 -1.03 0.00 0.00 41.12 41.26 1sbo n ASP 13 CO 0.00 0.00 0.00 -1.59 -0.11 0.00 0.00 177.20 175.50 1sbo s LYS 14 N -2.46 3.42 -0.77 0.11 -2.85 -1.26 -2.07 119.74 113.87 1sbo s LYS 14 Ca -0.01 -0.65 -0.26 0.00 -1.00 0.00 0.00 55.97 54.05 1sbo s LYS 14 Cb 0.07 -2.78 0.03 0.00 -2.06 0.00 0.00 37.83 33.10 1sbo s LYS 14 CO 0.43 0.09 1.28 0.00 0.10 0.00 0.00 175.35 177.26 1sbo s ALA 15 N 0.68 2.77 -0.10 0.59 0.00 0.16 -0.23 121.76 125.64 1sbo s ALA 15 Ca -0.05 -1.49 -0.30 0.00 0.00 0.00 0.00 51.96 50.12 1sbo s ALA 15 Cb -0.15 -4.27 -0.03 0.00 0.00 0.00 0.00 23.12 18.68 1sbo s ALA 15 CO 0.02 -3.30 1.29 0.42 0.00 0.00 0.00 175.76 174.19 1sbo s ILE 16 N 5.56 4.15 -0.57 0.00 1.01 0.22 -1.26 121.20 130.32 1sbo s ILE 16 Ca 0.35 1.44 -0.07 0.00 0.00 0.00 0.00 60.65 62.38 1sbo s ILE 16 Cb -0.08 -3.93 0.15 0.00 0.01 0.00 0.00 42.46 38.61 1sbo s ILE 16 CO 0.12 -0.07 0.42 -0.69 0.00 0.00 0.00 174.94 174.72 1sbo s VAL 17 N 3.02 4.10 0.03 2.92 1.01 0.93 -0.09 120.40 132.32 1sbo s VAL 17 Ca 0.57 -2.34 -0.30 0.00 0.00 0.00 0.00 61.98 59.91 1sbo s VAL 17 Cb -0.25 -3.68 -0.09 0.00 0.00 0.00 0.00 36.38 32.37 1sbo s VAL 17 CO 0.19 -0.84 1.98 0.54 0.00 0.00 0.00 175.10 176.98 1sbo n ARG 18 N 4.23 2.86 -3.71 2.72 1.74 -1.26 -1.24 116.66 121.99 1sbo n ARG 18 Ca 0.02 1.05 -0.33 0.00 -0.77 0.00 0.00 57.85 57.81 1sbo n ARG 18 Cb 0.41 -3.02 -0.05 0.00 -1.02 0.00 0.00 32.46 28.78 1sbo n ARG 18 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1sbo s VAL 19 N 4.55 5.22 0.16 1.55 1.01 -0.77 -0.35 120.40 131.76 1sbo s VAL 19 Ca 0.89 0.12 0.08 0.00 0.00 0.00 0.00 61.98 63.07 1sbo s VAL 19 Cb -0.43 -3.61 -0.04 0.00 0.00 0.00 0.00 36.38 32.30 1sbo s VAL 19 CO 0.42 0.22 -0.17 -1.10 0.00 0.00 0.00 175.10 174.47 1sbo s GLN 20 N -2.17 1.23 0.00 2.72 -0.21 0.60 -4.35 119.66 117.48 1sbo s GLN 20 Ca 0.34 -1.39 0.00 0.00 0.02 0.00 0.00 55.36 54.33 1sbo s GLN 20 Cb -0.13 -1.22 0.00 0.00 1.00 0.00 0.00 33.01 32.66 1sbo s GLN 20 CO 0.21 0.24 0.00 0.41 -2.12 0.00 0.00 175.29 174.03 1sbo n GLY 21 N 0.28 -2.13 3.78 3.09 0.00 -1.25 -2.94 105.19 106.03 1sbo n GLY 21 Ca -0.13 -1.50 -0.33 0.00 0.00 0.00 0.00 46.02 44.06 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 -3.87 5.53 -0.54 1.61 1.01 -1.26 -4.16 116.67 114.99 1sbo s ASP 22 Ca 0.00 1.97 -0.02 0.00 0.71 0.00 0.00 52.55 55.21 1sbo s ASP 22 Cb 0.00 -2.55 0.14 0.00 1.01 0.00 0.00 42.92 41.52 1sbo s ASP 22 CO 0.00 -1.34 0.33 -0.51 0.21 0.00 0.00 175.17 173.86 1sbo s ILE 23 N -2.24 3.41 0.00 0.77 2.07 -0.70 -4.82 121.20 119.70 1sbo s ILE 23 Ca 0.67 -2.70 0.00 0.00 -1.41 0.00 0.00 60.65 57.21 1sbo s ILE 23 Cb -0.19 -3.28 0.00 0.00 0.13 0.00 0.00 42.46 39.12 1sbo s ILE 23 CO 0.36 -0.80 0.00 -0.90 -1.91 0.00 0.00 174.94 171.68 1sbo n ASP 24 N 3.81 0.00 0.17 4.50 5.68 -1.26 -1.70 116.55 127.75 1sbo n ASP 24 Ca 0.04 -0.68 0.15 0.00 -0.50 0.00 0.00 54.79 53.80 1sbo n ASP 24 Cb 0.38 0.00 0.51 0.00 -1.14 0.00 0.00 41.12 40.87 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 1.21 2.02 -0.08 2.12 0.00 -1.94 0.12 119.26 122.71 1sbo h ALA 25 Ca 0.00 -0.01 -0.23 0.00 0.00 0.00 0.00 54.91 54.67 1sbo h ALA 25 Cb 0.00 0.02 0.01 0.00 0.00 0.00 0.00 17.79 17.82 1sbo h ALA 25 CO 0.00 -0.87 -0.85 1.88 0.00 0.00 0.00 179.25 179.40 1sbo h TYR 26 N 0.00 0.87 0.00 0.00 -1.99 -1.95 -3.19 116.97 110.71 1sbo h TYR 26 Ca 0.14 -0.42 0.00 0.00 2.00 0.00 0.00 58.73 60.45 1sbo h TYR 26 Cb 1.57 -0.12 0.00 0.00 2.00 0.00 0.00 36.73 40.18 1sbo h TYR 26 CO 0.00 1.24 -0.70 0.27 -0.00 0.00 0.00 178.16 178.96 1sbo n ASN 27 N -3.86 0.61 0.09 3.88 2.04 0.20 -3.88 115.26 114.34 1sbo n ASN 27 Ca -0.07 -0.20 0.06 0.00 -0.44 0.00 0.00 54.58 53.92 1sbo n ASN 27 Cb 0.78 0.43 0.30 0.00 -2.53 0.00 0.00 39.78 38.76 1sbo n ASN 27 CO 0.00 0.00 0.00 -0.24 -0.44 0.00 0.00 177.26 176.58 1sbo n SER 28 N -1.77 0.28 -0.04 0.53 2.88 -0.01 -1.31 113.62 114.18 1sbo n SER 28 Ca 0.04 0.59 -0.05 0.00 -1.33 0.00 0.00 58.87 58.11 1sbo n SER 28 Cb 0.39 -0.60 -0.04 0.00 -0.75 0.00 0.00 64.21 63.20 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 -1.87 3.35 0.00 -3.46 3.41 -1.26 -4.64 113.62 109.14 1sbo n SER 29 Ca -0.01 -0.04 -0.00 0.00 -0.26 0.00 0.00 58.87 58.56 1sbo n SER 29 Cb 0.10 0.01 -0.00 0.00 -0.26 0.00 0.00 64.21 64.06 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 -0.00 -0.60 4.33 4.81 -1.31 0.17 114.58 121.97 1sbo h GLU 30 Ca -0.19 0.00 0.12 0.00 -0.13 0.00 0.00 59.36 59.16 1sbo h GLU 30 Cb 1.31 0.00 -0.09 0.00 0.63 0.00 0.00 28.75 30.60 1sbo h GLU 30 CO -0.02 -0.00 0.11 1.25 -0.73 0.00 0.00 179.01 179.62 1sbo h LEU 31 N -0.00 -0.04 -0.51 1.64 5.85 -1.62 0.22 115.31 120.85 1sbo h LEU 31 Ca -0.00 0.12 0.10 0.00 0.84 0.00 0.00 57.88 58.94 1sbo h LEU 31 Cb 0.00 0.17 -0.10 0.00 0.37 0.00 0.00 40.66 41.11 1sbo h LEU 31 CO -0.00 -0.01 -0.13 0.50 -0.34 0.00 0.00 178.44 178.45 1sbo h LYS 32 N 0.23 -0.01 -0.06 1.25 3.64 -1.46 -0.70 116.57 119.46 1sbo h LYS 32 Ca 0.32 0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.69 1sbo h LYS 32 Cb 0.49 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.31 1sbo h LYS 32 CO -0.43 -0.00 -0.02 0.93 -2.27 0.00 0.00 179.45 177.66 1sbo h GLU 33 N -0.01 0.12 0.00 1.90 5.08 0.01 -2.38 114.58 119.30 1sbo h GLU 33 Ca 0.25 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.56 1sbo h GLU 33 Cb 0.38 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.63 1sbo h GLU 33 CO -0.53 0.46 0.00 1.04 -1.00 0.00 0.00 179.01 178.98 1sbo n GLN 34 N -4.82 0.14 -0.03 2.33 1.13 0.00 -1.63 117.38 114.49 1sbo n GLN 34 Ca -0.07 0.16 -0.05 0.00 -1.94 0.00 0.00 57.00 55.10 1sbo n GLN 34 Cb 0.23 -1.50 -0.03 0.00 0.11 0.00 0.00 30.24 29.05 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 -1.22 2.31 -0.11 1.08 4.77 -0.34 -3.99 117.00 119.50 1sbo n LEU 35 Ca 0.04 -0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.88 1sbo n LEU 35 Cb 0.05 -0.23 -0.03 0.00 -2.33 0.00 0.00 43.42 40.88 1sbo n LEU 35 CO 0.05 0.48 0.54 0.08 -1.33 0.00 0.00 177.39 177.22 1sbo h ARG 36 N -0.07 0.86 -0.44 3.23 0.11 -1.29 0.41 114.38 117.19 1sbo h ARG 36 Ca -0.16 -0.46 -0.12 0.00 0.10 0.00 0.00 59.98 59.34 1sbo h ARG 36 Cb 1.21 0.02 -0.01 0.00 1.11 0.00 0.00 29.97 32.30 1sbo h ARG 36 CO -0.05 1.10 -0.19 -0.97 0.10 0.00 0.00 179.97 179.96 1sbo h ASN 37 N 0.65 0.87 -0.07 0.08 -0.73 -1.57 -2.13 115.58 112.69 1sbo h ASN 37 Ca 0.05 -0.31 -0.17 0.00 1.87 0.00 0.00 56.30 57.75 1sbo h ASN 37 Cb 0.96 -0.24 -0.00 0.00 0.27 0.00 0.00 38.32 39.31 1sbo h ASN 37 CO 0.09 1.05 -0.53 0.15 -0.37 0.00 0.00 177.43 177.81 1sbo h PHE 38 N 0.76 0.82 -0.28 0.67 3.57 -1.66 -2.66 116.94 118.15 1sbo h PHE 38 Ca 0.11 -0.29 -0.02 0.00 3.53 0.00 0.00 57.97 61.30 1sbo h PHE 38 Cb 0.73 -0.16 -0.01 0.00 2.79 0.00 0.00 35.95 39.29 1sbo h PHE 38 CO 0.04 1.05 0.09 0.82 -2.23 0.00 0.00 178.31 178.08 1sbo h ILE 39 N 0.51 1.13 -0.01 1.41 2.04 0.09 0.36 117.51 123.04 1sbo h ILE 39 Ca 0.01 -0.42 0.00 0.00 1.00 0.00 0.00 64.86 65.46 1sbo h ILE 39 Cb 1.09 0.82 -0.00 0.00 -0.74 0.00 0.00 36.82 37.99 1sbo h ILE 39 CO 0.11 0.15 0.00 -1.28 0.00 0.00 0.00 178.15 177.13 1sbo h SER 40 N 0.39 0.00 -0.30 1.72 0.87 -1.19 -3.25 113.55 111.79 1sbo h SER 40 Ca 0.10 0.00 -0.18 0.00 -1.23 0.00 0.00 61.79 60.47 1sbo h SER 40 Cb 0.12 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.08 1sbo h SER 40 CO -0.01 0.00 -0.53 0.74 -0.53 0.00 0.00 176.83 176.50 1sbo h THR 41 N 0.01 1.27 -3.37 2.23 2.02 -0.98 -3.48 112.91 110.61 1sbo h THR 41 Ca 0.00 -1.71 -0.54 0.00 0.77 0.00 0.00 66.41 64.93 1sbo h THR 41 Cb 0.00 1.60 0.09 0.00 -1.74 0.00 0.00 68.15 68.11 1sbo h THR 41 CO -0.01 0.56 0.82 1.07 0.37 0.00 0.00 175.52 178.34 1sbo n THR 42 N -4.02 1.26 1.02 3.16 5.66 0.12 -4.91 114.28 116.57 1sbo n THR 42 Ca -0.04 -0.32 0.13 0.00 -3.05 0.00 0.00 64.05 60.77 1sbo n THR 42 Cb 0.62 -1.91 0.48 0.00 -1.55 0.00 0.00 70.33 67.97 1sbo n THR 42 CO 0.00 0.00 0.00 -0.24 -3.05 0.00 0.00 175.07 171.78 1sbo n SER 43 N 1.75 0.21 -4.55 1.09 2.88 -1.26 -4.88 113.62 108.84 1sbo n SER 43 Ca 0.07 0.17 -0.26 0.00 -1.33 0.00 0.00 58.87 57.52 1sbo n SER 43 Cb 0.37 -0.20 -0.11 0.00 -0.75 0.00 0.00 64.21 63.52 1sbo n SER 43 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 1sbo s LYS 44 N -2.98 1.83 -0.26 -1.46 3.01 -1.26 -5.06 119.74 113.56 1sbo s LYS 44 Ca 0.13 -1.98 -0.01 0.00 -1.01 0.00 0.00 55.97 53.11 1sbo s LYS 44 Cb 0.18 -1.60 -0.16 0.00 -1.01 0.00 0.00 37.83 35.25 1sbo s LYS 44 CO 0.59 0.06 -0.25 1.63 0.51 0.00 0.00 175.35 177.89 1sbo n LYS 45 N -0.82 0.64 -2.54 1.68 5.02 -0.94 -4.77 118.16 116.42 1sbo n LYS 45 Ca -0.05 0.17 -0.41 0.00 -2.02 0.00 0.00 58.31 56.00 1sbo n LYS 45 Cb 0.65 -1.51 -0.03 0.00 -0.02 0.00 0.00 35.03 34.11 1sbo n LYS 45 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 1sbo s LYS 46 N -2.52 3.30 -0.56 1.97 2.20 -0.88 -0.73 119.74 122.53 1sbo s LYS 46 Ca -0.36 -0.50 -0.22 0.00 -0.36 0.00 0.00 55.97 54.53 1sbo s LYS 46 Cb 0.10 -4.55 0.05 0.00 -1.51 0.00 0.00 37.83 31.92 1sbo s LYS 46 CO 0.58 -2.18 0.86 0.42 -0.36 0.00 0.00 175.35 174.66 1sbo s ILE 47 N 5.58 4.52 -0.43 5.43 -1.09 -1.23 0.41 121.20 134.38 1sbo s ILE 47 Ca 0.39 -0.04 -0.04 0.00 -2.23 0.00 0.00 60.65 58.73 1sbo s ILE 47 Cb -0.06 -4.50 0.11 0.00 -1.58 0.00 0.00 42.46 36.44 1sbo s ILE 47 CO 0.07 -1.08 0.25 -0.69 -1.23 0.00 0.00 174.94 172.26 1sbo s VAL 48 N 3.59 3.51 -0.42 2.92 1.01 -0.39 -1.58 120.40 129.04 1sbo s VAL 48 Ca 0.25 -2.04 -0.21 0.00 0.00 0.00 0.00 61.98 59.98 1sbo s VAL 48 Cb -0.15 -3.38 0.02 0.00 0.00 0.00 0.00 36.38 32.87 1sbo s VAL 48 CO 0.16 -0.72 0.66 -0.76 0.00 0.00 0.00 175.10 174.44 1sbo s LEU 49 N 1.14 4.41 0.01 3.92 2.01 -0.27 -0.05 118.68 129.85 1sbo s LEU 49 Ca 0.08 -0.20 -0.17 0.00 0.01 0.00 0.00 54.13 53.85 1sbo s LEU 49 Cb -0.23 -2.77 -0.06 0.00 0.01 0.00 0.00 46.19 43.13 1sbo s LEU 49 CO -0.03 -0.76 0.48 -0.62 1.01 0.00 0.00 176.35 176.43 1sbo s ASP 50 N 1.97 6.90 -0.11 2.29 2.15 -0.38 0.61 116.67 130.10 1sbo s ASP 50 Ca 0.24 1.07 0.16 0.00 0.43 0.00 0.00 52.55 54.45 1sbo s ASP 50 Cb -0.14 -2.30 0.25 0.00 -0.30 0.00 0.00 42.92 40.43 1sbo s ASP 50 CO 0.19 0.26 1.13 0.18 -0.17 0.00 0.00 175.17 176.75 1sbo n LEU 51 N 2.02 1.97 0.28 -1.34 7.99 0.22 -1.85 117.00 126.29 1sbo n LEU 51 Ca -0.12 -2.76 0.17 0.00 -0.01 0.00 0.00 56.01 53.30 1sbo n LEU 51 Cb 0.52 -0.36 0.95 0.00 -0.11 0.00 0.00 43.42 44.42 1sbo n LEU 51 CO 0.40 0.65 1.14 0.28 -1.51 0.00 0.00 177.39 178.35 1sbo h SER 52 N 0.02 0.00 -0.11 -1.43 0.02 -1.69 -0.01 113.55 110.35 1sbo h SER 52 Ca -0.00 0.00 -0.12 0.00 -0.84 0.00 0.00 61.79 60.83 1sbo h SER 52 Cb 1.07 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.61 1sbo h SER 52 CO 0.00 0.00 -0.40 0.28 -1.14 0.00 0.00 176.83 175.57 1sbo h SER 53 N 0.00 0.54 -3.19 3.07 0.02 -1.86 -3.47 113.55 108.67 1sbo h SER 53 Ca 0.02 -0.62 -0.58 0.00 -0.84 0.00 0.00 61.79 59.77 1sbo h SER 53 Cb 0.16 -0.16 -0.07 0.00 0.14 0.00 0.00 62.40 62.48 1sbo h SER 53 CO -0.00 1.07 0.63 -0.69 -1.14 0.00 0.00 176.83 176.70 1sbo s VAL 54 N -3.75 4.76 0.00 2.27 1.01 -0.02 -4.69 120.40 119.98 1sbo s VAL 54 Ca -0.13 1.83 0.00 0.00 0.00 0.00 0.00 61.98 63.68 1sbo s VAL 54 Cb 0.05 -4.23 0.00 0.00 0.00 0.00 0.00 36.38 32.21 1sbo s VAL 54 CO 0.80 -0.11 0.00 -1.20 0.00 0.00 0.00 175.10 174.60 1sbo n SER 55 N 6.01 0.16 -4.18 3.32 7.64 -1.26 -4.71 113.62 120.60 1sbo n SER 55 Ca 0.09 -0.35 -0.18 0.00 1.01 0.00 0.00 58.87 59.43 1sbo n SER 55 Cb 0.47 0.74 -0.12 0.00 -1.01 0.00 0.00 64.21 64.29 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 -0.77 1.22 -0.05 1.43 5.04 -1.26 -4.90 117.35 118.06 1sbo s TYR 56 Ca 0.00 -0.49 -0.02 0.00 -2.44 0.00 0.00 57.07 54.12 1sbo s TYR 56 Cb 0.00 -0.68 0.03 0.00 0.35 0.00 0.00 41.96 41.66 1sbo s TYR 56 CO 0.00 0.06 0.11 1.41 -1.34 0.00 0.00 175.55 175.80 1sbo s MET 57 N -1.93 0.06 0.42 4.97 -2.45 -1.26 -1.72 119.30 117.39 1sbo s MET 57 Ca -0.00 0.31 0.08 0.00 -1.25 0.00 0.00 55.69 54.83 1sbo s MET 57 Cb -0.09 -0.18 0.00 0.00 1.25 0.00 0.00 34.83 35.81 1sbo s MET 57 CO 0.02 -0.16 0.54 0.34 1.05 0.00 0.00 175.02 176.81 1sbo s ASP 58 N 1.08 5.54 0.00 1.11 -1.08 -0.69 -5.00 116.67 117.64 1sbo s ASP 58 Ca -0.09 -0.48 0.02 0.00 -0.52 0.00 0.00 52.55 51.48 1sbo s ASP 58 Cb -0.11 -0.64 0.08 0.00 -1.46 0.00 0.00 42.92 40.79 1sbo s ASP 58 CO -0.05 -0.74 1.01 -1.20 0.52 0.00 0.00 175.17 174.71 1sbo n SER 59 N -1.80 0.00 -0.06 -0.34 7.64 -1.26 -0.75 113.62 117.06 1sbo n SER 59 Ca 0.07 0.44 -0.10 0.00 1.01 0.00 0.00 58.87 60.30 1sbo n SER 59 Cb 0.60 -0.45 0.05 0.00 -1.01 0.00 0.00 64.21 63.40 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 2.07 0.73 0.13 -0.43 0.00 -1.91 -1.34 119.26 118.52 1sbo h ALA 60 Ca 0.00 -0.45 0.02 0.00 0.00 0.00 0.00 54.91 54.48 1sbo h ALA 60 Cb 0.03 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 1sbo h ALA 60 CO 0.00 0.66 -0.28 0.78 0.00 0.00 0.00 179.25 180.41 1sbo h GLY 61 N 0.94 -0.53 1.29 0.00 0.00 -1.01 0.42 103.07 104.17 1sbo h GLY 61 Ca 0.05 0.33 -0.19 0.00 0.00 0.00 0.00 47.33 47.52 1sbo h GLY 61 CO 0.09 -0.23 -0.63 0.17 0.00 0.00 0.00 176.54 175.93 1sbo h LEU 62 N -0.50 0.83 0.00 3.11 -0.00 -1.67 -1.81 115.31 115.26 1sbo h LEU 62 Ca 0.03 -0.48 0.00 0.00 -0.00 0.00 0.00 57.88 57.43 1sbo h LEU 62 Cb 0.52 -0.24 0.00 0.00 -0.00 0.00 0.00 40.66 40.94 1sbo h LEU 62 CO -0.15 1.25 0.00 0.61 -0.00 0.00 0.00 178.44 180.15 1sbo n GLY 63 N 0.45 -0.46 0.03 0.17 0.00 -0.50 -1.31 105.19 103.56 1sbo n GLY 63 Ca -0.05 -0.02 -0.01 0.00 0.00 0.00 0.00 46.02 45.94 1sbo n GLY 63 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1sbo h THR 64 N 0.00 0.00 -0.73 2.61 2.02 -0.07 -3.41 112.91 113.32 1sbo h THR 64 Ca 0.00 -0.45 -0.01 0.00 0.77 0.00 0.00 66.41 66.71 1sbo h THR 64 Cb 0.05 0.00 -0.03 0.00 -1.74 0.00 0.00 68.15 66.42 1sbo h THR 64 CO 0.00 0.00 0.41 -0.07 0.37 0.00 0.00 175.52 176.23 1sbo h LEU 65 N -0.45 0.91 -1.99 2.58 -0.00 -0.88 -1.41 115.31 114.06 1sbo h LEU 65 Ca 0.00 -0.09 0.19 0.00 -0.00 0.00 0.00 57.88 57.99 1sbo h LEU 65 Cb 0.16 -0.23 -0.03 0.00 -0.00 0.00 0.00 40.66 40.56 1sbo h LEU 65 CO 0.00 0.73 0.52 1.62 -0.00 0.00 0.00 178.44 181.31 1sbo h VAL 66 N 1.01 0.57 -0.17 1.22 3.04 -1.47 0.19 116.25 120.64 1sbo h VAL 66 Ca 0.26 0.00 -0.22 0.00 -1.01 0.00 0.00 66.70 65.73 1sbo h VAL 66 Cb 0.02 0.63 0.01 0.00 -2.01 0.00 0.00 31.29 29.93 1sbo h VAL 66 CO -0.04 0.00 -0.74 1.62 -1.01 0.00 0.00 177.57 177.39 1sbo h VAL 67 N 0.00 1.28 0.00 1.51 3.04 -1.48 -3.22 116.25 117.38 1sbo h VAL 67 Ca 0.32 -1.94 -0.07 0.00 -1.01 0.00 0.00 66.70 63.99 1sbo h VAL 67 Cb 1.34 1.93 -0.01 0.00 -2.01 0.00 0.00 31.29 32.55 1sbo h VAL 67 CO -0.00 0.62 -0.34 0.40 -1.01 0.00 0.00 177.57 177.24 1sbo h ILE 68 N 0.55 1.00 -0.55 3.17 1.08 -0.67 -2.65 117.51 119.44 1sbo h ILE 68 Ca -0.04 -1.27 0.11 0.00 -0.39 0.00 0.00 64.86 63.27 1sbo h ILE 68 Cb 1.37 1.73 -0.09 0.00 -3.07 0.00 0.00 36.82 36.76 1sbo h ILE 68 CO 0.15 0.33 0.06 0.25 -0.69 0.00 0.00 178.15 178.25 1sbo h LEU 69 N 0.00 -0.12 0.82 1.44 6.46 -1.28 0.17 115.31 122.80 1sbo h LEU 69 Ca -0.00 0.12 -0.04 0.00 -0.12 0.00 0.00 57.88 57.84 1sbo h LEU 69 Cb 0.70 0.19 0.00 0.00 -0.73 0.00 0.00 40.66 40.83 1sbo h LEU 69 CO 0.04 -0.04 -0.47 0.50 -0.62 0.00 0.00 178.44 177.85 1sbo h LYS 70 N 0.18 -1.15 -1.01 1.25 3.64 -1.61 -2.59 116.57 115.27 1sbo h LYS 70 Ca 0.29 0.08 0.24 0.00 -1.27 0.00 0.00 60.65 59.99 1sbo h LYS 70 Cb 0.43 0.26 -0.11 0.00 -0.41 0.00 0.00 32.23 32.40 1sbo h LYS 70 CO -0.42 -0.77 0.62 -0.44 -2.27 0.00 0.00 179.45 176.17 1sbo h ASP 71 N -1.19 0.64 0.98 4.20 3.32 -0.98 0.13 116.42 123.51 1sbo h ASP 71 Ca -0.11 0.12 -0.05 0.00 0.02 0.00 0.00 57.03 57.01 1sbo h ASP 71 Cb 0.94 0.01 0.01 0.00 0.22 0.00 0.00 39.33 40.52 1sbo h ASP 71 CO 0.13 0.13 -0.47 0.00 -1.72 0.00 0.00 179.24 177.31 1sbo h ALA 72 N 1.69 -1.32 -0.94 3.45 0.00 -0.77 -2.76 119.26 118.62 1sbo h ALA 72 Ca 0.62 -0.29 0.23 0.00 0.00 0.00 0.00 54.91 55.48 1sbo h ALA 72 Cb 1.24 0.51 -0.13 0.00 0.00 0.00 0.00 17.79 19.42 1sbo h ALA 72 CO -0.42 -1.22 0.48 -0.22 0.00 0.00 0.00 179.25 177.87 1sbo h LYS 73 N -1.35 0.46 -0.91 0.00 3.11 -0.45 0.19 116.57 117.61 1sbo h LYS 73 Ca -0.13 -0.03 -0.01 0.00 -2.81 0.00 0.00 60.65 57.67 1sbo h LYS 73 Cb 1.01 -0.10 -0.04 0.00 -1.00 0.00 0.00 32.23 32.09 1sbo h LYS 73 CO 0.22 0.30 0.54 0.82 -2.81 0.00 0.00 179.45 178.52 1sbo h ILE 74 N 0.47 1.25 -0.63 2.00 2.04 -0.76 -2.08 117.51 119.80 1sbo h ILE 74 Ca 0.60 -0.56 0.00 0.00 1.00 0.00 0.00 64.86 65.90 1sbo h ILE 74 Cb 1.14 -0.03 0.00 0.00 -0.74 0.00 0.00 36.82 37.20 1sbo h ILE 74 CO -0.51 0.27 0.00 -3.20 0.00 0.00 0.00 178.15 174.71 1sbo n ASN 75 N -4.35 4.97 -2.09 1.72 5.15 -0.36 -4.95 115.26 115.34 1sbo n ASN 75 Ca 0.10 -2.55 -0.17 0.00 -0.60 0.00 0.00 54.58 51.36 1sbo n ASN 75 Cb 0.06 -0.61 0.00 0.00 -0.53 0.00 0.00 39.78 38.71 1sbo n ASN 75 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1sbo n GLY 76 N 1.04 -0.31 3.97 8.20 0.00 -0.12 -5.00 105.19 112.98 1sbo n GLY 76 Ca 0.26 -0.14 -0.21 0.00 0.00 0.00 0.00 46.02 45.94 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 -5.04 3.24 0.73 1.61 -0.14 0.47 -4.95 119.74 115.67 1sbo s LYS 77 Ca 0.08 -0.80 -0.01 0.00 -1.36 0.00 0.00 55.97 53.88 1sbo s LYS 77 Cb -0.03 -2.79 0.13 0.00 -1.68 0.00 0.00 37.83 33.46 1sbo s LYS 77 CO 0.09 0.14 1.01 -1.21 -0.76 0.00 0.00 175.35 174.62 1sbo s GLU 78 N -4.18 1.62 -0.29 1.68 8.01 0.09 -3.99 118.70 121.64 1sbo s GLU 78 Ca 0.42 -1.12 -0.13 0.00 0.01 0.00 0.00 54.97 54.14 1sbo s GLU 78 Cb -0.09 -2.32 0.10 0.00 -4.31 0.00 0.00 34.13 27.51 1sbo s GLU 78 CO 0.32 -1.50 0.67 0.12 0.01 0.00 0.00 175.26 174.88 1sbo s PHE 79 N -3.17 -1.20 0.02 1.61 5.36 -1.26 -3.56 117.98 115.78 1sbo s PHE 79 Ca 0.67 2.22 -0.00 0.00 -0.96 0.00 0.00 56.93 58.86 1sbo s PHE 79 Cb -0.05 0.72 -0.02 0.00 -0.34 0.00 0.00 43.02 43.33 1sbo s PHE 79 CO 0.45 -0.59 -0.02 0.42 -1.46 0.00 0.00 175.22 174.02 1sbo s ILE 80 N 2.23 0.10 0.06 3.12 1.01 -0.61 -4.77 121.20 122.33 1sbo s ILE 80 Ca -0.08 -0.81 0.02 0.00 0.00 0.00 0.00 60.65 59.78 1sbo s ILE 80 Cb -0.08 -0.25 -0.04 0.00 0.01 0.00 0.00 42.46 42.10 1sbo s ILE 80 CO -0.19 -0.45 0.12 -0.76 0.00 0.00 0.00 174.94 173.66 1sbo s LEU 81 N -1.32 3.97 0.20 2.97 2.01 -1.16 -1.12 118.68 124.23 1sbo s LEU 81 Ca -0.14 0.09 -0.02 0.00 0.01 0.00 0.00 54.13 54.07 1sbo s LEU 81 Cb -0.09 -2.59 -0.04 0.00 0.01 0.00 0.00 46.19 43.48 1sbo s LEU 81 CO -0.01 0.18 0.14 -0.55 1.01 0.00 0.00 176.35 177.13 1sbo s SER 82 N -2.34 0.15 -1.15 2.29 0.15 0.20 -0.89 113.70 112.11 1sbo s SER 82 Ca 0.30 -1.34 -0.00 0.00 0.70 0.00 0.00 55.95 55.60 1sbo s SER 82 Cb -0.12 0.38 0.00 0.00 -1.71 0.00 0.00 66.02 64.57 1sbo s SER 82 CO 0.23 -0.85 0.02 -1.20 1.20 0.00 0.00 173.24 172.64 1sbo n SER 83 N -0.26 -4.16 -4.70 5.45 7.64 -1.17 -0.61 113.62 115.81 1sbo n SER 83 Ca 0.01 0.15 -0.31 0.00 1.01 0.00 0.00 58.87 59.73 1sbo n SER 83 Cb 0.66 -3.52 0.15 0.00 -1.01 0.00 0.00 64.21 60.48 1sbo n SER 83 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 1sbo s LEU 84 N -5.70 2.83 0.23 -3.43 1.43 -1.26 -2.34 118.68 110.44 1sbo s LEU 84 Ca 0.01 2.05 0.08 0.00 -1.03 0.00 0.00 54.13 55.24 1sbo s LEU 84 Cb -0.01 -4.51 -0.04 0.00 0.03 0.00 0.00 46.19 41.67 1sbo s LEU 84 CO 0.01 -2.82 0.08 -0.54 0.23 0.00 0.00 176.35 173.31 1sbo s LYS 85 N -4.72 2.59 0.34 1.70 1.02 -1.26 -4.93 119.74 114.47 1sbo s LYS 85 Ca 0.65 -1.17 0.26 0.00 0.02 0.00 0.00 55.97 55.73 1sbo s LYS 85 Cb -0.21 -2.39 1.16 0.00 -0.52 0.00 0.00 37.83 35.87 1sbo s LYS 85 CO 0.58 0.41 1.79 1.49 -0.92 0.00 0.00 175.35 178.69 1sbo h GLU 86 N 2.00 0.00 0.00 1.68 4.81 -1.98 0.27 114.58 121.36 1sbo h GLU 86 Ca -0.47 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.76 1sbo h GLU 86 Cb 1.23 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.61 1sbo h GLU 86 CO 0.60 0.00 -0.28 0.43 -0.73 0.00 0.00 179.01 179.03 1sbo n SER 87 N -2.44 0.32 0.00 1.04 7.64 -1.26 -4.14 113.62 114.78 1sbo n SER 87 Ca 0.01 0.11 0.00 0.00 1.01 0.00 0.00 58.87 60.00 1sbo n SER 87 Cb 0.20 -0.10 0.00 0.00 -1.01 0.00 0.00 64.21 63.30 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 -1.56 0.00 -0.05 0.44 2.08 0.25 -4.36 119.36 116.16 1sbo n ILE 88 Ca 0.06 0.00 -0.08 0.00 0.56 0.00 0.00 62.75 63.29 1sbo n ILE 88 Cb 0.35 -0.57 -0.02 0.00 -0.75 0.00 0.00 39.64 38.64 1sbo n ILE 88 CO 0.00 0.00 0.00 0.77 0.56 0.00 0.00 176.55 177.88 1sbo h SER 89 N 0.00 -0.24 -0.93 4.38 4.64 -0.80 0.08 113.55 120.67 1sbo h SER 89 Ca 0.00 0.07 0.14 0.00 -0.47 0.00 0.00 61.79 61.53 1sbo h SER 89 Cb 0.91 0.15 -0.08 0.00 -0.31 0.00 0.00 62.40 63.08 1sbo h SER 89 CO 0.00 -0.09 0.60 0.08 -0.87 0.00 0.00 176.83 176.55 1sbo h ARG 90 N -0.02 0.77 0.02 4.77 0.11 -1.80 -0.64 114.38 117.59 1sbo h ARG 90 Ca 0.11 -0.05 -0.00 0.00 0.10 0.00 0.00 59.98 60.14 1sbo h ARG 90 Cb 0.19 -0.17 0.00 0.00 1.11 0.00 0.00 29.97 31.09 1sbo h ARG 90 CO -0.24 0.51 -0.01 0.82 0.10 0.00 0.00 179.97 181.15 1sbo h ILE 91 N 0.79 1.36 -0.43 0.08 2.04 -1.23 0.31 117.51 120.43 1sbo h ILE 91 Ca 0.47 -1.17 0.07 0.00 1.00 0.00 0.00 64.86 65.23 1sbo h ILE 91 Cb 0.66 2.15 -0.06 0.00 -0.74 0.00 0.00 36.82 38.83 1sbo h ILE 91 CO -0.23 0.30 0.05 -0.07 0.00 0.00 0.00 178.15 178.20 1sbo h LEU 92 N -0.53 -0.07 -0.16 1.44 3.38 -0.99 -1.36 115.31 117.03 1sbo h LEU 92 Ca -0.00 0.09 -0.00 0.00 0.09 0.00 0.00 57.88 58.05 1sbo h LEU 92 Cb 0.51 0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 1sbo h LEU 92 CO 0.00 -0.00 0.10 0.50 0.09 0.00 0.00 178.44 179.13 1sbo h LYS 93 N 0.17 0.22 -0.71 1.13 3.64 -0.78 0.35 116.57 120.59 1sbo h LYS 93 Ca 0.21 -0.02 0.13 0.00 -1.27 0.00 0.00 60.65 59.70 1sbo h LYS 93 Cb 0.29 -0.05 -0.09 0.00 -0.41 0.00 0.00 32.23 31.97 1sbo h LYS 93 CO -0.31 0.18 0.26 -0.07 -2.27 0.00 0.00 179.45 177.24 1sbo h LEU 94 N 0.19 0.23 -0.88 5.20 3.38 0.09 -1.32 115.31 122.19 1sbo h LEU 94 Ca 0.06 0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.13 1sbo h LEU 94 Cb 0.02 0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.86 1sbo h LEU 94 CO -0.01 0.10 0.00 0.41 0.09 0.00 0.00 178.44 179.03 1sbo n THR 95 N -5.02 0.21 -2.15 0.22 -1.04 -0.56 -4.91 114.28 101.04 1sbo n THR 95 Ca 0.12 -0.29 -0.17 0.00 -2.04 0.00 0.00 64.05 61.67 1sbo n THR 95 Cb 0.37 0.21 -0.02 0.00 -1.82 0.00 0.00 70.33 69.07 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 0.12 -0.64 0.08 -1.42 8.25 -0.50 -4.94 115.22 116.17 1sbo n HIS 96 Ca 0.14 0.00 -0.21 0.00 -0.26 0.00 0.00 57.72 57.39 1sbo n HIS 96 Cb 0.26 -3.32 -0.15 0.00 1.12 0.00 0.00 29.99 27.90 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 0.56 -1.84 2.41 -0.00 -0.55 -3.38 115.31 112.51 1sbo h LEU 97 Ca -0.39 -0.79 -0.01 0.00 -0.00 0.00 0.00 57.88 56.68 1sbo h LEU 97 Cb 1.26 -0.18 -0.00 0.00 -0.00 0.00 0.00 40.66 41.73 1sbo h LEU 97 CO 0.48 1.66 -0.06 -2.24 -0.00 0.00 0.00 178.44 178.28 1sbo h ASP 98 N 0.10 0.00 1.45 -0.43 2.03 -1.79 0.11 116.42 117.89 1sbo h ASP 98 Ca -0.30 0.00 -0.00 0.00 -0.73 0.00 0.00 57.03 56.00 1sbo h ASP 98 Cb 2.08 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 40.58 1sbo h ASP 98 CO 0.18 0.06 -0.00 0.07 -1.03 0.00 0.00 179.24 178.53 1sbo h LYS 99 N 0.00 0.00 0.00 4.15 2.10 -1.87 -3.39 116.57 117.56 1sbo h LYS 99 Ca -0.00 0.00 -0.03 0.00 -2.00 0.00 0.00 60.65 58.62 1sbo h LYS 99 Cb 0.39 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.72 1sbo h LYS 99 CO 0.01 0.00 -1.11 0.44 -2.00 0.00 0.00 179.45 176.79 1sbo n ILE 100 N -3.10 0.11 -0.92 0.07 -5.35 -0.13 -4.99 119.36 105.06 1sbo n ILE 100 Ca 0.02 -0.05 -0.15 0.00 -0.27 0.00 0.00 62.75 62.30 1sbo n ILE 100 Cb 0.40 -0.66 0.12 0.00 -1.74 0.00 0.00 39.64 37.77 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 -2.45 -3.56 -4.40 4.28 3.01 0.19 -5.10 117.46 109.43 1sbo n PHE 101 Ca -0.03 -0.52 -0.27 0.00 1.01 0.00 0.00 57.45 57.63 1sbo n PHE 101 Cb 0.54 -0.56 -0.12 0.00 -0.01 0.00 0.00 39.48 39.33 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 -4.30 1.55 -0.02 -1.08 2.36 -1.26 -4.86 119.74 112.13 1sbo s LYS 102 Ca 0.36 -1.46 0.01 0.00 -2.55 0.00 0.00 55.97 52.33 1sbo s LYS 102 Cb -0.03 -1.89 0.01 0.00 -1.05 0.00 0.00 37.83 34.87 1sbo s LYS 102 CO 0.27 0.41 -0.02 0.42 1.55 0.00 0.00 175.35 177.99 1sbo s ILE 103 N -1.55 0.24 0.13 5.43 1.09 -1.25 -2.99 121.20 122.30 1sbo s ILE 103 Ca 0.20 -0.03 0.00 0.00 -1.10 0.00 0.00 60.65 59.72 1sbo s ILE 103 Cb -0.08 -0.28 -0.00 0.00 -1.06 0.00 0.00 42.46 41.04 1sbo s ILE 103 CO 0.10 0.12 0.02 0.35 -0.10 0.00 0.00 174.94 175.42 1sbo n THR 104 N 3.63 0.00 -0.02 2.92 -2.24 -0.06 -4.96 114.28 113.54 1sbo n THR 104 Ca -0.21 -0.67 -0.02 0.00 -2.27 0.00 0.00 64.05 60.88 1sbo n THR 104 Cb 0.54 0.18 -0.03 0.00 -2.10 0.00 0.00 70.33 68.92 1sbo n THR 104 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1sbo n ASP 105 N -1.45 3.89 -4.18 3.42 9.92 -1.26 -3.07 116.55 123.82 1sbo n ASP 105 Ca -0.04 -0.01 -0.22 0.00 -0.53 0.00 0.00 54.79 53.99 1sbo n ASP 105 Cb 0.18 0.39 -0.14 0.00 -0.64 0.00 0.00 41.12 40.91 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 -2.10 1.30 0.64 -3.53 -4.23 -1.26 -3.12 115.64 103.34 1sbo s THR 106 Ca -0.03 -1.03 0.36 0.00 -1.18 0.00 0.00 61.69 59.80 1sbo s THR 106 Cb 0.01 -1.15 0.38 0.00 1.34 0.00 0.00 72.50 73.09 1sbo s THR 106 CO 0.15 0.10 2.18 -0.37 -0.54 0.00 0.00 174.62 176.14 1sbo h VAL 107 N 4.48 0.14 -0.02 2.29 -1.51 -1.93 -0.87 116.25 118.83 1sbo h VAL 107 Ca -0.39 0.00 -0.00 0.00 -1.23 0.00 0.00 66.70 65.08 1sbo h VAL 107 Cb 1.17 0.87 -0.00 0.00 -2.13 0.00 0.00 31.29 31.20 1sbo h VAL 107 CO 0.44 0.00 0.01 -0.33 -1.23 0.00 0.00 177.57 176.46 1sbo h GLU 108 N 0.00 0.03 0.00 5.19 4.39 -2.01 -3.22 114.58 118.96 1sbo h GLU 108 Ca 0.02 -0.00 -0.08 0.00 0.34 0.00 0.00 59.36 59.64 1sbo h GLU 108 Cb 0.30 -0.01 -0.01 0.00 -0.10 0.00 0.00 28.75 28.94 1sbo h GLU 108 CO -0.00 0.05 -0.38 1.49 -1.16 0.00 0.00 179.01 179.02 1sbo h GLU 109 N -0.01 0.00 0.00 2.33 4.81 -1.56 -3.53 114.58 116.63 1sbo h GLU 109 Ca 0.01 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 1sbo h GLU 109 Cb 0.03 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.41 1sbo h GLU 109 CO -0.00 0.38 0.00 0.00 -0.73 0.00 0.00 179.01 178.65