#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sbo n ASN 2 N 0.00 -1.34 -3.30 6.12 0.23 -1.26 -5.05 115.26 110.66 1sbo n ASN 2 Ca 0.00 -2.86 -0.25 0.00 -0.53 0.00 0.00 54.58 50.94 1sbo n ASN 2 Cb 0.00 2.50 -0.07 0.00 -2.08 0.00 0.00 39.78 40.12 1sbo n ASN 2 CO 0.00 0.00 0.00 -3.20 -0.93 0.00 0.00 177.26 173.13 1sbo n ASN 3 N -1.63 2.22 -4.68 0.53 2.85 -1.26 -5.02 115.26 108.26 1sbo n ASN 3 Ca 0.01 -3.13 -0.45 0.00 -0.11 0.00 0.00 54.58 50.90 1sbo n ASN 3 Cb 0.58 -0.65 -0.03 0.00 1.24 0.00 0.00 39.78 40.91 1sbo n ASN 3 CO 0.00 0.00 0.00 -0.11 -2.11 0.00 0.00 177.26 175.04 1sbo n LEU 4 N 1.01 3.34 0.00 1.20 -0.00 -1.26 -4.07 117.00 117.22 1sbo n LEU 4 Ca 0.26 1.12 0.00 0.00 -0.00 0.00 0.00 56.01 57.39 1sbo n LEU 4 Cb 0.47 -1.46 0.00 0.00 -0.00 0.00 0.00 43.42 42.43 1sbo n LEU 4 CO 0.31 -0.29 0.00 1.17 -0.00 0.00 0.00 177.39 178.57 1sbo n LYS 5 N 2.60 -2.95 -4.14 1.96 4.81 -1.23 -4.92 118.16 114.29 1sbo n LYS 5 Ca 0.13 0.00 -0.15 0.00 -0.87 0.00 0.00 58.31 57.42 1sbo n LYS 5 Cb 0.32 0.00 -0.11 0.00 0.02 0.00 0.00 35.03 35.25 1sbo n LYS 5 CO 0.00 0.00 0.00 -0.48 1.17 0.00 0.00 177.40 178.09 1sbo s LEU 6 N 0.00 2.31 -0.20 3.14 2.34 -1.26 -0.51 118.68 124.50 1sbo s LEU 6 Ca 0.00 -0.66 -0.01 0.00 0.06 0.00 0.00 54.13 53.53 1sbo s LEU 6 Cb 0.00 -0.33 -0.12 0.00 -0.56 0.00 0.00 46.19 45.18 1sbo s LEU 6 CO 0.00 -0.18 -0.19 -0.67 -1.06 0.00 0.00 176.35 174.25 1sbo n ASP 7 N 1.11 2.29 -2.11 1.48 -0.08 0.07 -4.95 116.55 114.36 1sbo n ASP 7 Ca -0.20 -0.04 0.00 0.00 -1.51 0.00 0.00 54.79 53.04 1sbo n ASP 7 Cb 0.55 -0.37 0.00 0.00 2.34 0.00 0.00 41.12 43.65 1sbo n ASP 7 CO 0.00 0.00 0.00 -0.38 0.12 0.00 0.00 177.20 176.94 1sbo n ILE 8 N -3.23-13.02 -3.49 5.18 5.41 -1.25 -4.94 119.36 104.02 1sbo n ILE 8 Ca -0.36 3.18 -0.28 0.00 1.00 0.00 0.00 62.75 66.29 1sbo n ILE 8 Cb 0.86 -5.62 -0.13 0.00 -0.71 0.00 0.00 39.64 34.03 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 -0.52 -0.01 -0.04 1.39 1.01 0.52 -4.97 120.40 117.78 1sbo s VAL 9 Ca 0.00 -1.16 -0.30 0.00 0.00 0.00 0.00 61.98 60.52 1sbo s VAL 9 Cb 0.00 -1.02 -0.06 0.00 0.00 0.00 0.00 36.38 35.30 1sbo s VAL 9 CO 0.00 -0.82 1.60 -1.61 0.00 0.00 0.00 175.10 174.27 1sbo s GLU 10 N 1.65 4.20 0.00 2.72 2.02 -1.26 -0.41 118.70 127.61 1sbo s GLU 10 Ca 0.13 2.15 0.00 0.00 0.02 0.00 0.00 54.97 57.27 1sbo s GLU 10 Cb -0.19 -3.89 0.00 0.00 0.10 0.00 0.00 34.13 30.16 1sbo s GLU 10 CO -0.19 -0.80 0.00 0.94 0.02 0.00 0.00 175.26 175.23 1sbo n GLN 11 N 6.75 3.48 0.52 1.61 0.00 0.62 -4.90 117.38 125.46 1sbo n GLN 11 Ca 0.16 0.00 -0.20 0.00 -0.00 0.00 0.00 57.00 56.96 1sbo n GLN 11 Cb 0.43 0.00 -0.10 0.00 0.00 0.00 0.00 30.24 30.57 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 -1.15 0.00 1.69 1.82 -2.03 -3.41 116.42 113.34 1sbo h ASP 12 Ca 0.00 0.04 0.00 0.00 -0.39 0.00 0.00 57.03 56.68 1sbo h ASP 12 Cb 0.00 0.30 0.00 0.00 0.68 0.00 0.00 39.33 40.31 1sbo h ASP 12 CO 0.00 -0.80 0.00 -0.67 -1.61 0.00 0.00 179.24 176.16 1sbo n ASP 13 N -5.60 0.00 -4.31 2.28 2.03 -1.26 -5.05 116.55 104.65 1sbo n ASP 13 Ca -0.16 -1.00 -0.29 0.00 0.52 0.00 0.00 54.79 53.86 1sbo n ASP 13 Cb 0.52 0.00 -0.15 0.00 -0.72 0.00 0.00 41.12 40.78 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 0.00 1.73 -0.43 -0.67 -2.85 -1.26 -2.92 119.74 113.34 1sbo s LYS 14 Ca 0.00 -1.02 -0.16 0.00 -1.00 0.00 0.00 55.97 53.79 1sbo s LYS 14 Cb 0.00 -1.85 0.03 0.00 -2.06 0.00 0.00 37.83 33.95 1sbo s LYS 14 CO 0.00 0.48 0.37 0.00 0.10 0.00 0.00 175.35 176.30 1sbo s ALA 15 N -0.76 3.47 -1.06 0.59 0.00 0.20 -0.27 121.76 123.93 1sbo s ALA 15 Ca 0.10 -1.73 -0.20 0.00 0.00 0.00 0.00 51.96 50.13 1sbo s ALA 15 Cb -0.10 -2.98 0.09 0.00 0.00 0.00 0.00 23.12 20.13 1sbo s ALA 15 CO 0.01 -1.56 1.41 0.42 0.00 0.00 0.00 175.76 176.04 1sbo s ILE 16 N 1.84 4.30 -1.12 0.00 1.01 0.45 -0.53 121.20 127.14 1sbo s ILE 16 Ca 0.07 -1.40 -0.20 0.00 0.00 0.00 0.00 60.65 59.12 1sbo s ILE 16 Cb -0.19 -4.99 0.07 0.00 0.01 0.00 0.00 42.46 37.36 1sbo s ILE 16 CO 0.11 -1.80 1.52 -0.69 0.00 0.00 0.00 174.94 174.07 1sbo s VAL 17 N 3.84 4.14 0.14 2.92 1.01 0.54 -0.35 120.40 132.64 1sbo s VAL 17 Ca 0.43 -1.36 -0.31 0.00 0.00 0.00 0.00 61.98 60.74 1sbo s VAL 17 Cb -0.01 -5.07 -0.10 0.00 0.00 0.00 0.00 36.38 31.20 1sbo s VAL 17 CO -0.06 -1.91 1.71 -0.13 0.00 0.00 0.00 175.10 174.71 1sbo s ARG 18 N 4.29 4.16 -0.06 2.72 3.00 -1.26 -2.16 118.95 129.64 1sbo s ARG 18 Ca 0.47 2.49 -0.04 0.00 0.00 0.00 0.00 55.73 58.66 1sbo s ARG 18 Cb 0.01 -3.37 -0.04 0.00 0.00 0.00 0.00 34.95 31.55 1sbo s ARG 18 CO -0.03 -0.75 0.14 0.08 0.00 0.00 0.00 175.30 174.74 1sbo s VAL 19 N 1.99 5.28 0.34 3.52 1.01 -0.20 -0.76 120.40 131.57 1sbo s VAL 19 Ca 0.76 -0.07 0.08 0.00 0.00 0.00 0.00 61.98 62.75 1sbo s VAL 19 Cb -0.45 -3.38 -0.04 0.00 0.00 0.00 0.00 36.38 32.50 1sbo s VAL 19 CO 0.33 0.46 0.10 -1.10 0.00 0.00 0.00 175.10 174.90 1sbo s GLN 20 N -1.50 2.30 0.14 2.72 -0.21 0.34 -4.14 119.66 119.31 1sbo s GLN 20 Ca 0.21 -1.59 0.00 0.00 0.02 0.00 0.00 55.36 54.00 1sbo s GLN 20 Cb -0.12 -2.11 0.00 0.00 1.00 0.00 0.00 33.01 31.77 1sbo s GLN 20 CO 0.11 0.13 0.00 0.41 -2.12 0.00 0.00 175.29 173.82 1sbo n GLY 21 N -1.09 -3.61 3.61 3.09 0.00 -0.28 -3.55 105.19 103.36 1sbo n GLY 21 Ca -0.03 -0.95 -0.63 0.00 0.00 0.00 0.00 46.02 44.41 1sbo n GLY 21 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1sbo n ASP 22 N -0.68 1.42 -4.70 1.61 8.00 -1.25 -4.48 116.55 116.47 1sbo n ASP 22 Ca 0.00 1.00 -0.42 0.00 0.71 0.00 0.00 54.79 56.08 1sbo n ASP 22 Cb 0.00 -0.96 -0.03 0.00 -0.02 0.00 0.00 41.12 40.10 1sbo n ASP 22 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 1sbo s ILE 23 N 4.09 4.88 0.16 0.53 2.07 -1.06 -4.76 121.20 127.11 1sbo s ILE 23 Ca 1.07 1.84 -0.23 0.00 -1.41 0.00 0.00 60.65 61.93 1sbo s ILE 23 Cb -1.37 -4.22 0.08 0.00 0.13 0.00 0.00 42.46 37.07 1sbo s ILE 23 CO 0.73 0.10 1.05 -0.62 -1.91 0.00 0.00 174.94 174.29 1sbo s ASP 24 N 1.02 -0.03 0.64 4.50 -1.08 -1.26 -1.44 116.67 119.02 1sbo s ASP 24 Ca 0.45 -0.58 0.30 0.00 -0.52 0.00 0.00 52.55 52.20 1sbo s ASP 24 Cb -0.19 0.47 1.63 0.00 -1.46 0.00 0.00 42.92 43.37 1sbo s ASP 24 CO 0.20 -0.91 1.96 0.00 0.52 0.00 0.00 175.17 176.93 1sbo h ALA 25 N 2.00 1.58 -0.29 3.66 0.00 -1.93 0.14 119.26 124.42 1sbo h ALA 25 Ca -0.27 -0.00 -0.04 0.00 0.00 0.00 0.00 54.91 54.60 1sbo h ALA 25 Cb 1.22 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 1sbo h ALA 25 CO 0.34 -0.41 0.04 1.88 0.00 0.00 0.00 179.25 181.10 1sbo h TYR 26 N 0.00 0.51 -0.01 0.00 0.05 -1.94 -3.29 116.97 112.29 1sbo h TYR 26 Ca 0.06 -0.08 0.00 0.00 0.05 0.00 0.00 58.73 58.77 1sbo h TYR 26 Cb 0.74 -0.14 0.00 0.00 1.01 0.00 0.00 36.73 38.34 1sbo h TYR 26 CO 0.00 0.59 -0.48 0.27 -1.05 0.00 0.00 178.16 177.49 1sbo n ASN 27 N -4.63 1.73 -0.01 3.88 6.94 -0.19 -4.07 115.26 118.91 1sbo n ASN 27 Ca -0.03 -1.34 0.23 0.00 -0.02 0.00 0.00 54.58 53.43 1sbo n ASN 27 Cb 0.22 0.45 0.71 0.00 -2.36 0.00 0.00 39.78 38.80 1sbo n ASN 27 CO 0.00 0.00 0.00 -1.28 -1.03 0.00 0.00 177.26 174.95 1sbo h SER 28 N 1.97 0.00 0.00 0.53 0.87 -0.87 0.21 113.55 116.26 1sbo h SER 28 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1sbo h SER 28 Cb 0.69 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.65 1sbo h SER 28 CO 0.00 0.00 0.00 -1.54 -0.53 0.00 0.00 176.83 174.76 1sbo n SER 29 N -3.77 0.20 0.00 6.23 3.41 -1.26 -4.35 113.62 114.08 1sbo n SER 29 Ca 0.12 -0.58 0.00 0.00 -0.26 0.00 0.00 58.87 58.15 1sbo n SER 29 Cb 0.81 0.71 0.00 0.00 -0.26 0.00 0.00 64.21 65.47 1sbo n SER 29 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 1sbo n GLU 30 N -0.71 0.00 -0.32 4.33 2.13 -0.25 -3.20 120.64 122.62 1sbo n GLU 30 Ca 0.00 0.22 0.15 0.00 0.66 0.00 0.00 57.16 58.19 1sbo n GLU 30 Cb 0.00 -0.75 0.31 0.00 0.27 0.00 0.00 31.44 31.28 1sbo n GLU 30 CO 0.00 0.00 0.00 1.25 -0.41 0.00 0.00 177.13 177.97 1sbo h LEU 31 N 0.00 -0.21 -0.43 4.31 5.85 -0.98 0.32 115.31 124.17 1sbo h LEU 31 Ca 0.00 0.24 0.06 0.00 0.84 0.00 0.00 57.88 59.02 1sbo h LEU 31 Cb 0.00 0.37 -0.05 0.00 0.37 0.00 0.00 40.66 41.36 1sbo h LEU 31 CO 0.00 -0.28 0.14 0.50 -0.34 0.00 0.00 178.44 178.46 1sbo h LYS 32 N 0.09 0.29 -0.23 1.25 3.64 -1.75 -1.42 116.57 118.44 1sbo h LYS 32 Ca 0.60 -0.02 -0.11 0.00 -1.27 0.00 0.00 60.65 59.85 1sbo h LYS 32 Cb 1.27 -0.06 -0.00 0.00 -0.41 0.00 0.00 32.23 33.02 1sbo h LYS 32 CO -0.79 0.19 -0.29 1.05 -2.27 0.00 0.00 179.45 177.34 1sbo h GLU 33 N 0.30 0.60 0.00 1.90 4.11 -0.46 -1.25 114.58 119.77 1sbo h GLU 33 Ca 0.20 -0.34 0.00 0.00 0.07 0.00 0.00 59.36 59.29 1sbo h GLU 33 Cb 0.20 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.48 1sbo h GLU 33 CO -0.22 0.94 0.00 1.04 0.07 0.00 0.00 179.01 180.84 1sbo n GLN 34 N -4.33 0.01 -0.02 1.06 1.13 0.21 -1.47 117.38 113.98 1sbo n GLN 34 Ca -0.05 0.43 -0.02 0.00 -1.94 0.00 0.00 57.00 55.42 1sbo n GLN 34 Cb 0.46 -1.53 -0.02 0.00 0.11 0.00 0.00 30.24 29.26 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 -1.56 2.71 -0.26 1.08 4.77 -0.56 -3.87 117.00 119.30 1sbo n LEU 35 Ca 0.01 -0.02 -0.06 0.00 -0.03 0.00 0.00 56.01 55.92 1sbo n LEU 35 Cb 0.06 -0.11 0.06 0.00 -2.33 0.00 0.00 43.42 41.10 1sbo n LEU 35 CO 0.05 0.51 1.10 0.08 -1.33 0.00 0.00 177.39 177.81 1sbo h ARG 36 N 0.00 1.02 -0.13 3.23 0.11 -1.12 0.42 114.38 117.90 1sbo h ARG 36 Ca -0.08 -0.12 -0.22 0.00 0.10 0.00 0.00 59.98 59.65 1sbo h ARG 36 Cb 1.13 -0.20 0.01 0.00 1.11 0.00 0.00 29.97 32.02 1sbo h ARG 36 CO -0.01 0.76 -0.80 -0.97 0.10 0.00 0.00 179.97 179.05 1sbo h ASN 37 N 1.00 0.90 0.05 0.08 -1.24 -1.50 -2.57 115.58 112.31 1sbo h ASN 37 Ca 0.26 -0.60 -0.16 0.00 0.71 0.00 0.00 56.30 56.50 1sbo h ASN 37 Cb 0.05 -0.27 -0.01 0.00 0.73 0.00 0.00 38.32 38.82 1sbo h ASN 37 CO -0.04 1.40 -0.57 0.15 -1.29 0.00 0.00 177.43 177.08 1sbo h PHE 38 N 0.51 0.69 -0.33 0.67 3.57 -1.65 -0.83 116.94 119.57 1sbo h PHE 38 Ca -0.06 -0.25 0.06 0.00 3.53 0.00 0.00 57.97 61.26 1sbo h PHE 38 Cb 1.43 -0.13 -0.02 0.00 2.79 0.00 0.00 35.95 40.03 1sbo h PHE 38 CO 0.08 0.98 0.23 0.82 -2.23 0.00 0.00 178.31 178.19 1sbo h ILE 39 N 0.41 0.92 -0.03 1.41 2.04 -0.12 0.44 117.51 122.59 1sbo h ILE 39 Ca 0.00 -0.06 -0.01 0.00 1.00 0.00 0.00 64.86 65.80 1sbo h ILE 39 Cb 1.11 0.74 -0.00 0.00 -0.74 0.00 0.00 36.82 37.93 1sbo h ILE 39 CO 0.11 0.03 -0.01 -1.28 0.00 0.00 0.00 178.15 177.00 1sbo h SER 40 N 0.17 0.06 -0.35 1.72 0.87 -0.83 -3.26 113.55 111.92 1sbo h SER 40 Ca 0.15 -0.39 0.05 0.00 -1.23 0.00 0.00 61.79 60.37 1sbo h SER 40 Cb 0.37 -0.02 -0.04 0.00 -0.44 0.00 0.00 62.40 62.27 1sbo h SER 40 CO -0.02 0.43 0.09 0.74 -0.53 0.00 0.00 176.83 177.54 1sbo h THR 41 N -0.31 0.85 -2.85 2.23 2.02 -0.28 -3.46 112.91 111.10 1sbo h THR 41 Ca 0.01 -0.07 -0.53 0.00 0.77 0.00 0.00 66.41 66.58 1sbo h THR 41 Cb 0.41 0.61 0.02 0.00 -1.74 0.00 0.00 68.15 67.44 1sbo h THR 41 CO 0.00 0.04 0.86 0.28 0.37 0.00 0.00 175.52 177.08 1sbo s THR 42 N -6.16 3.25 0.11 3.16 -1.32 0.15 -4.88 115.64 109.95 1sbo s THR 42 Ca -0.13 0.78 0.12 0.00 -1.21 0.00 0.00 61.69 61.24 1sbo s THR 42 Cb 0.12 -3.50 -0.04 0.00 -1.51 0.00 0.00 72.50 67.57 1sbo s THR 42 CO 0.71 0.02 1.49 0.28 -2.21 0.00 0.00 174.62 174.91 1sbo h SER 43 N 7.58 0.00 -2.99 8.08 0.02 -1.89 -3.46 113.55 120.90 1sbo h SER 43 Ca -0.41 0.00 -0.61 0.00 -0.84 0.00 0.00 61.79 59.93 1sbo h SER 43 Cb 1.20 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 63.69 1sbo h SER 43 CO 0.90 0.68 -0.41 -0.54 -1.14 0.00 0.00 176.83 176.32 1sbo s LYS 44 N -3.16 3.53 -0.20 3.45 3.01 -1.26 -5.05 119.74 120.06 1sbo s LYS 44 Ca 0.01 -0.23 -0.09 0.00 -1.01 0.00 0.00 55.97 54.65 1sbo s LYS 44 Cb 0.10 -2.99 -0.20 0.00 -1.01 0.00 0.00 37.83 33.74 1sbo s LYS 44 CO 0.76 0.57 0.05 1.63 0.51 0.00 0.00 175.35 178.88 1sbo n LYS 45 N 0.45 0.66 -1.75 1.68 5.02 -1.15 -4.70 118.16 118.37 1sbo n LYS 45 Ca -0.06 0.30 -0.42 0.00 -2.02 0.00 0.00 58.31 56.11 1sbo n LYS 45 Cb 0.52 -1.63 -0.02 0.00 -0.02 0.00 0.00 35.03 33.88 1sbo n LYS 45 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1sbo s LYS 46 N -2.50 4.12 -0.28 1.97 3.01 -1.25 -0.23 119.74 124.57 1sbo s LYS 46 Ca -0.30 2.60 0.02 0.00 -1.01 0.00 0.00 55.97 57.28 1sbo s LYS 46 Cb 0.09 -3.04 0.08 0.00 -1.01 0.00 0.00 37.83 33.95 1sbo s LYS 46 CO 0.64 -0.68 -0.00 0.42 0.51 0.00 0.00 175.35 176.23 1sbo s ILE 47 N 0.42 1.74 -0.20 2.17 -1.09 -1.23 0.58 121.20 123.58 1sbo s ILE 47 Ca 0.67 -1.67 -0.09 0.00 -2.23 0.00 0.00 60.65 57.34 1sbo s ILE 47 Cb -0.49 -2.12 -0.05 0.00 -1.58 0.00 0.00 42.46 38.22 1sbo s ILE 47 CO 0.42 -0.35 0.11 -0.69 -1.23 0.00 0.00 174.94 173.20 1sbo s VAL 48 N 1.24 5.20 -0.33 2.92 1.01 0.31 -0.54 120.40 130.20 1sbo s VAL 48 Ca 0.02 0.11 0.02 0.00 0.00 0.00 0.00 61.98 62.13 1sbo s VAL 48 Cb -0.19 -3.36 0.09 0.00 0.00 0.00 0.00 36.38 32.92 1sbo s VAL 48 CO -0.10 0.44 0.03 -0.76 0.00 0.00 0.00 175.10 174.72 1sbo s LEU 49 N 0.38 4.47 0.07 3.92 2.01 0.31 -0.34 118.68 129.51 1sbo s LEU 49 Ca 0.06 -1.90 -0.30 0.00 0.01 0.00 0.00 54.13 52.01 1sbo s LEU 49 Cb -0.12 -1.65 -0.05 0.00 0.01 0.00 0.00 46.19 44.38 1sbo s LEU 49 CO -0.01 -0.35 1.08 -0.62 1.01 0.00 0.00 176.35 177.45 1sbo s ASP 50 N 1.11 7.27 -0.07 2.29 -1.08 -0.92 0.26 116.67 125.53 1sbo s ASP 50 Ca 0.05 1.89 0.12 0.00 -0.52 0.00 0.00 52.55 54.09 1sbo s ASP 50 Cb -0.20 -2.58 0.35 0.00 -1.46 0.00 0.00 42.92 39.03 1sbo s ASP 50 CO -0.06 -0.30 1.28 0.18 0.52 0.00 0.00 175.17 176.80 1sbo n LEU 51 N 3.42 3.14 0.05 -1.34 7.99 0.89 -1.04 117.00 130.12 1sbo n LEU 51 Ca 0.06 -2.44 0.18 0.00 -0.01 0.00 0.00 56.01 53.81 1sbo n LEU 51 Cb 0.48 -0.33 0.70 0.00 -0.11 0.00 0.00 43.42 44.16 1sbo n LEU 51 CO 0.53 0.69 1.17 0.77 -1.51 0.00 0.00 177.39 179.04 1sbo h SER 52 N 1.61 0.00 -0.47 -1.43 4.64 -1.71 0.50 113.55 116.69 1sbo h SER 52 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1sbo h SER 52 Cb 0.98 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.07 1sbo h SER 52 CO 0.08 0.00 0.00 -1.20 -0.87 0.00 0.00 176.83 174.84 1sbo n SER 53 N -4.32 2.60 -4.62 4.97 7.64 -1.26 -4.83 113.62 113.80 1sbo n SER 53 Ca 0.07 -1.99 -0.25 0.00 1.01 0.00 0.00 58.87 57.71 1sbo n SER 53 Cb 0.52 -0.32 -0.08 0.00 -1.01 0.00 0.00 64.21 63.32 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 -1.37 3.40 0.00 0.44 1.01 0.17 -1.12 120.40 122.92 1sbo s VAL 54 Ca 0.33 -1.72 0.00 0.00 0.00 0.00 0.00 61.98 60.59 1sbo s VAL 54 Cb 0.17 -2.74 0.00 0.00 0.00 0.00 0.00 36.38 33.81 1sbo s VAL 54 CO 0.23 -0.22 0.00 -1.20 0.00 0.00 0.00 175.10 173.91 1sbo n SER 55 N -0.37 0.00 -4.76 3.32 7.64 -1.26 -4.91 113.62 113.28 1sbo n SER 55 Ca -0.09 0.00 -0.26 0.00 1.01 0.00 0.00 58.87 59.53 1sbo n SER 55 Cb 0.57 0.00 -0.06 0.00 -1.01 0.00 0.00 64.21 63.71 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 -0.90 3.06 -0.14 1.43 6.14 -1.26 -4.65 117.35 121.03 1sbo s TYR 56 Ca 0.00 -0.05 -0.05 0.00 0.64 0.00 0.00 57.07 57.61 1sbo s TYR 56 Cb 0.00 -1.48 0.07 0.00 0.42 0.00 0.00 41.96 40.97 1sbo s TYR 56 CO 0.00 0.52 0.29 1.41 0.64 0.00 0.00 175.55 178.41 1sbo s MET 57 N -3.02 0.19 0.78 4.97 1.75 -1.25 -2.56 119.30 120.15 1sbo s MET 57 Ca 0.30 0.76 -0.12 0.00 -1.25 0.00 0.00 55.69 55.39 1sbo s MET 57 Cb -0.10 0.01 0.06 0.00 2.84 0.00 0.00 34.83 37.64 1sbo s MET 57 CO 0.22 -0.26 1.14 0.34 -0.65 0.00 0.00 175.02 175.81 1sbo s ASP 58 N 2.26 4.80 0.55 1.11 2.15 -0.52 -4.93 116.67 122.09 1sbo s ASP 58 Ca -0.01 0.95 0.38 0.00 0.43 0.00 0.00 52.55 54.30 1sbo s ASP 58 Cb -0.12 -1.57 1.55 0.00 -0.30 0.00 0.00 42.92 42.48 1sbo s ASP 58 CO -0.09 -1.74 1.75 -1.28 -0.17 0.00 0.00 175.17 173.64 1sbo h SER 59 N -0.93 0.00 -0.15 -0.34 0.87 -1.99 -0.38 113.55 110.63 1sbo h SER 59 Ca -0.46 0.00 -0.14 0.00 -1.23 0.00 0.00 61.79 59.96 1sbo h SER 59 Cb 1.30 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.25 1sbo h SER 59 CO 0.65 0.00 -0.40 0.00 -0.53 0.00 0.00 176.83 176.55 1sbo h ALA 60 N 1.30 0.76 0.02 6.23 0.00 -1.92 -3.13 119.26 122.52 1sbo h ALA 60 Ca 0.59 -0.45 0.03 0.00 0.00 0.00 0.00 54.91 55.09 1sbo h ALA 60 Cb 2.46 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 20.09 1sbo h ALA 60 CO -0.01 0.66 -0.47 0.78 0.00 0.00 0.00 179.25 180.21 1sbo h GLY 61 N 0.97 -0.93 0.85 0.00 0.00 -1.32 -0.42 103.07 102.23 1sbo h GLY 61 Ca 0.05 0.57 -0.07 0.00 0.00 0.00 0.00 47.33 47.88 1sbo h GLY 61 CO 0.08 -0.25 -0.13 0.17 0.00 0.00 0.00 176.54 176.41 1sbo h LEU 62 N -0.63 0.53 -2.63 3.11 -0.00 -1.66 -0.68 115.31 113.35 1sbo h LEU 62 Ca 0.03 -0.42 -0.00 0.00 -0.00 0.00 0.00 57.88 57.49 1sbo h LEU 62 Cb 0.69 -0.15 -0.00 0.00 -0.00 0.00 0.00 40.66 41.20 1sbo h LEU 62 CO -0.33 0.84 -0.00 1.23 -0.00 0.00 0.00 178.44 180.18 1sbo h GLY 63 N 0.23 0.00 0.81 0.17 0.00 -1.47 0.10 103.07 102.91 1sbo h GLY 63 Ca 0.05 0.00 -0.33 0.00 0.00 0.00 0.00 47.33 47.06 1sbo h GLY 63 CO 0.04 0.00 -1.84 2.41 0.00 0.00 0.00 176.54 177.14 1sbo n THR 64 N -3.14 1.69 0.07 4.70 -1.04 -0.18 -4.00 114.28 112.38 1sbo n THR 64 Ca -0.02 -0.73 -0.19 0.00 -2.04 0.00 0.00 64.05 61.06 1sbo n THR 64 Cb 0.12 -1.35 -0.15 0.00 -1.82 0.00 0.00 70.33 67.14 1sbo n THR 64 CO 0.00 0.00 0.00 -0.07 -0.64 0.00 0.00 175.07 174.36 1sbo h LEU 65 N 0.03 0.49 -2.03 -4.42 3.38 -0.39 -3.32 115.31 109.05 1sbo h LEU 65 Ca -0.35 -0.68 -0.00 0.00 0.09 0.00 0.00 57.88 56.94 1sbo h LEU 65 Cb 2.03 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 42.62 1sbo h LEU 65 CO 0.08 1.57 -0.02 1.62 0.09 0.00 0.00 178.44 181.78 1sbo h VAL 66 N 0.09 0.07 -0.61 1.22 3.04 -1.02 0.77 116.25 119.80 1sbo h VAL 66 Ca -0.27 -0.35 -0.09 0.00 -1.01 0.00 0.00 66.70 64.98 1sbo h VAL 66 Cb 2.05 1.33 -0.02 0.00 -2.01 0.00 0.00 31.29 32.64 1sbo h VAL 66 CO 0.18 0.02 0.04 1.62 -1.01 0.00 0.00 177.57 178.41 1sbo h VAL 67 N 0.00 1.26 0.00 1.51 3.04 -1.69 -3.07 116.25 117.30 1sbo h VAL 67 Ca -0.00 -1.10 -0.05 0.00 -1.01 0.00 0.00 66.70 64.54 1sbo h VAL 67 Cb 0.32 0.76 -0.01 0.00 -2.01 0.00 0.00 31.29 30.36 1sbo h VAL 67 CO 0.00 0.40 -0.26 0.40 -1.01 0.00 0.00 177.57 177.10 1sbo h ILE 68 N 0.96 0.97 -0.98 3.17 1.08 -0.96 -0.78 117.51 120.96 1sbo h ILE 68 Ca 0.18 -0.97 0.22 0.00 -0.39 0.00 0.00 64.86 63.91 1sbo h ILE 68 Cb 0.51 1.55 -0.09 0.00 -3.07 0.00 0.00 36.82 35.73 1sbo h ILE 68 CO 0.02 0.25 0.63 0.25 -0.69 0.00 0.00 178.15 178.62 1sbo h LEU 69 N 0.00 0.52 0.00 1.44 7.12 -1.36 -0.14 115.31 122.89 1sbo h LEU 69 Ca -0.00 0.07 -0.00 0.00 0.13 0.00 0.00 57.88 58.07 1sbo h LEU 69 Cb 0.53 -0.02 -0.00 0.00 -0.53 0.00 0.00 40.66 40.64 1sbo h LEU 69 CO 0.03 0.17 -0.12 0.50 -0.13 0.00 0.00 178.44 178.89 1sbo h LYS 70 N 0.50 0.00 -0.90 1.25 3.64 -1.30 -3.31 116.57 116.45 1sbo h LYS 70 Ca 0.54 0.00 0.20 0.00 -1.27 0.00 0.00 60.65 60.12 1sbo h LYS 70 Cb 1.22 0.00 -0.17 0.00 -0.41 0.00 0.00 32.23 32.87 1sbo h LYS 70 CO -0.27 0.10 -0.15 -0.44 -2.27 0.00 0.00 179.45 176.42 1sbo h ASP 71 N -1.00 -0.71 0.64 4.20 3.32 -0.67 0.20 116.42 122.40 1sbo h ASP 71 Ca -0.01 0.26 -0.03 0.00 0.02 0.00 0.00 57.03 57.28 1sbo h ASP 71 Cb 0.20 0.52 0.00 0.00 0.22 0.00 0.00 39.33 40.27 1sbo h ASP 71 CO -0.00 -0.30 -0.34 0.00 -1.72 0.00 0.00 179.24 176.88 1sbo h ALA 72 N 1.90 -0.92 -0.96 3.45 0.00 -1.26 -2.45 119.26 119.01 1sbo h ALA 72 Ca 0.46 -0.19 0.19 0.00 0.00 0.00 0.00 54.91 55.37 1sbo h ALA 72 Cb 0.78 0.40 -0.09 0.00 0.00 0.00 0.00 17.79 18.88 1sbo h ALA 72 CO -0.90 -1.02 0.61 -0.22 0.00 0.00 0.00 179.25 177.72 1sbo h LYS 73 N -0.91 0.60 -0.44 0.00 3.11 -0.47 0.26 116.57 118.72 1sbo h LYS 73 Ca -0.08 -0.04 0.02 0.00 -2.81 0.00 0.00 60.65 57.74 1sbo h LYS 73 Cb 0.72 -0.13 -0.03 0.00 -1.00 0.00 0.00 32.23 31.78 1sbo h LYS 73 CO 0.12 0.39 0.25 0.82 -2.81 0.00 0.00 179.45 178.22 1sbo h ILE 74 N 0.61 1.02 -0.25 2.00 2.04 -0.41 -1.29 117.51 121.24 1sbo h ILE 74 Ca 0.52 -0.17 0.00 0.00 1.00 0.00 0.00 64.86 66.21 1sbo h ILE 74 Cb 1.00 0.49 0.00 0.00 -0.74 0.00 0.00 36.82 37.56 1sbo h ILE 74 CO -0.27 0.09 0.00 -3.20 0.00 0.00 0.00 178.15 174.77 1sbo n ASN 75 N -4.86 1.96 -3.27 1.72 5.15 -0.21 -4.88 115.26 110.86 1sbo n ASN 75 Ca 0.02 -2.14 -0.18 0.00 -0.60 0.00 0.00 54.58 51.69 1sbo n ASN 75 Cb 0.08 -0.34 0.08 0.00 -0.53 0.00 0.00 39.78 39.07 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 0.65 -0.34 3.48 8.20 0.00 -0.49 -5.02 105.19 111.67 1sbo n GLY 76 Ca 0.09 0.10 -0.29 0.00 0.00 0.00 0.00 46.02 45.92 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 -5.58 1.78 0.91 1.61 -0.14 0.75 -4.89 119.74 114.17 1sbo s LYS 77 Ca 0.19 -1.18 -0.13 0.00 -1.36 0.00 0.00 55.97 53.49 1sbo s LYS 77 Cb -0.08 -2.11 0.18 0.00 -1.68 0.00 0.00 37.83 34.14 1sbo s LYS 77 CO 0.67 0.48 1.25 -1.21 -0.76 0.00 0.00 175.35 175.78 1sbo s GLU 78 N -2.10 0.89 -0.29 1.68 8.01 0.68 -2.59 118.70 124.98 1sbo s GLU 78 Ca 0.18 -0.54 -0.12 0.00 0.01 0.00 0.00 54.97 54.50 1sbo s GLU 78 Cb -0.11 -1.95 0.12 0.00 -4.31 0.00 0.00 34.13 27.89 1sbo s GLU 78 CO 0.10 -2.20 0.69 0.12 0.01 0.00 0.00 175.26 173.98 1sbo s PHE 79 N -3.73 -1.23 0.05 1.61 5.36 -1.26 -3.58 117.98 115.20 1sbo s PHE 79 Ca 0.72 2.20 0.01 0.00 -0.96 0.00 0.00 56.93 58.90 1sbo s PHE 79 Cb -0.04 0.74 -0.03 0.00 -0.34 0.00 0.00 43.02 43.34 1sbo s PHE 79 CO 0.51 -0.61 -0.05 0.42 -1.46 0.00 0.00 175.22 174.03 1sbo s ILE 80 N 2.53 0.36 0.22 3.12 1.01 0.30 -4.47 121.20 124.27 1sbo s ILE 80 Ca -0.07 -1.34 0.09 0.00 0.00 0.00 0.00 60.65 59.32 1sbo s ILE 80 Cb -0.10 -0.90 -0.04 0.00 0.01 0.00 0.00 42.46 41.44 1sbo s ILE 80 CO -0.19 -0.65 -0.02 -0.76 0.00 0.00 0.00 174.94 173.33 1sbo s LEU 81 N -2.11 3.20 0.01 2.97 1.43 0.48 -0.53 118.68 124.14 1sbo s LEU 81 Ca -0.04 -0.54 -0.03 0.00 -1.03 0.00 0.00 54.13 52.49 1sbo s LEU 81 Cb -0.03 -1.80 -0.01 0.00 0.03 0.00 0.00 46.19 44.38 1sbo s LEU 81 CO -0.03 0.05 0.03 -0.94 0.23 0.00 0.00 176.35 175.69 1sbo s SER 82 N -3.27 0.15 -0.68 2.29 1.04 0.14 -0.90 113.70 112.46 1sbo s SER 82 Ca 0.29 -0.37 -0.04 0.00 0.48 0.00 0.00 55.95 56.31 1sbo s SER 82 Cb -0.08 0.14 -0.04 0.00 0.10 0.00 0.00 66.02 66.14 1sbo s SER 82 CO 0.19 -0.31 0.60 -1.20 0.98 0.00 0.00 173.24 173.49 1sbo n SER 83 N 1.60 -5.14 -4.95 7.02 7.64 0.07 -0.08 113.62 119.79 1sbo n SER 83 Ca -0.23 -0.44 -0.19 0.00 1.01 0.00 0.00 58.87 59.02 1sbo n SER 83 Cb 0.55 -3.64 -0.01 0.00 -1.01 0.00 0.00 64.21 60.10 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 -4.50 3.52 0.03 -3.43 2.01 -1.26 -2.49 118.68 112.56 1sbo s LEU 84 Ca 0.28 -0.58 -0.03 0.00 0.01 0.00 0.00 54.13 53.81 1sbo s LEU 84 Cb -0.04 -2.36 -0.02 0.00 0.01 0.00 0.00 46.19 43.79 1sbo s LEU 84 CO 0.49 -0.72 0.03 -0.54 1.01 0.00 0.00 176.35 176.62 1sbo s LYS 85 N -4.25 0.49 0.52 1.70 1.02 -1.26 -4.97 119.74 112.99 1sbo s LYS 85 Ca 0.52 -0.77 0.20 0.00 0.02 0.00 0.00 55.97 55.94 1sbo s LYS 85 Cb -0.07 0.18 1.37 0.00 -0.52 0.00 0.00 37.83 38.79 1sbo s LYS 85 CO 0.31 -0.10 2.14 1.49 -0.92 0.00 0.00 175.35 178.27 1sbo h GLU 86 N 3.95 0.00 -0.01 1.68 4.81 -1.98 0.23 114.58 123.26 1sbo h GLU 86 Ca -0.32 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.91 1sbo h GLU 86 Cb 1.19 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.57 1sbo h GLU 86 CO 0.49 0.04 0.00 0.43 -0.73 0.00 0.00 179.01 179.24 1sbo n SER 87 N -4.29 0.30 0.00 1.04 7.64 -1.26 -2.82 113.62 114.24 1sbo n SER 87 Ca -0.03 -1.16 0.00 0.00 1.01 0.00 0.00 58.87 58.69 1sbo n SER 87 Cb 0.12 -0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.32 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 -0.73 0.00 -0.15 0.44 2.08 0.16 -4.51 119.36 116.65 1sbo n ILE 88 Ca 0.22 0.00 -0.05 0.00 0.56 0.00 0.00 62.75 63.48 1sbo n ILE 88 Cb 0.15 -0.37 0.04 0.00 -0.75 0.00 0.00 39.64 38.72 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 0.27 -0.39 4.38 4.64 -0.78 0.31 113.55 121.99 1sbo h SER 89 Ca 0.00 0.04 0.05 0.00 -0.47 0.00 0.00 61.79 61.40 1sbo h SER 89 Cb 0.67 -0.01 -0.04 0.00 -0.31 0.00 0.00 62.40 62.71 1sbo h SER 89 CO 0.00 0.20 0.13 0.08 -0.87 0.00 0.00 176.83 176.37 1sbo h ARG 90 N 0.42 0.28 -0.22 4.77 0.11 -1.74 -1.51 114.38 116.49 1sbo h ARG 90 Ca 0.21 -0.02 0.02 0.00 0.10 0.00 0.00 59.98 60.30 1sbo h ARG 90 Cb 0.16 -0.06 -0.02 0.00 1.11 0.00 0.00 29.97 31.15 1sbo h ARG 90 CO -0.18 0.19 0.07 0.82 0.10 0.00 0.00 179.97 180.97 1sbo h ILE 91 N 0.29 0.94 -0.47 0.08 2.04 -1.21 0.49 117.51 119.67 1sbo h ILE 91 Ca 0.18 -0.06 -0.05 0.00 1.00 0.00 0.00 64.86 65.93 1sbo h ILE 91 Cb 0.16 0.76 -0.02 0.00 -0.74 0.00 0.00 36.82 36.98 1sbo h ILE 91 CO -0.18 0.03 0.11 -0.07 0.00 0.00 0.00 178.15 178.04 1sbo h LEU 92 N 0.17 0.72 0.69 1.44 3.38 -1.21 -1.61 115.31 118.89 1sbo h LEU 92 Ca 0.09 -0.24 -0.03 0.00 0.09 0.00 0.00 57.88 57.79 1sbo h LEU 92 Cb 0.06 -0.19 0.01 0.00 0.09 0.00 0.00 40.66 40.63 1sbo h LEU 92 CO -0.10 0.77 -0.33 0.50 0.09 0.00 0.00 178.44 179.37 1sbo h LYS 93 N 0.64 -0.89 -1.08 1.13 3.64 -0.08 0.47 116.57 120.39 1sbo h LYS 93 Ca 0.15 0.06 0.34 0.00 -1.27 0.00 0.00 60.65 59.92 1sbo h LYS 93 Cb 0.34 0.20 -0.13 0.00 -0.41 0.00 0.00 32.23 32.23 1sbo h LYS 93 CO 0.00 -0.59 0.65 -0.07 -2.27 0.00 0.00 179.45 177.18 1sbo h LEU 94 N -0.96 0.45 -2.29 5.20 3.38 -0.07 0.12 115.31 121.14 1sbo h LEU 94 Ca -0.09 0.16 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1sbo h LEU 94 Cb 0.72 0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.58 1sbo h LEU 94 CO 0.16 -0.10 0.00 0.41 0.09 0.00 0.00 178.44 179.00 1sbo n THR 95 N -4.89 0.73 -1.94 0.22 -1.04 -0.61 -4.94 114.28 101.81 1sbo n THR 95 Ca 0.32 -0.80 -0.21 0.00 -2.04 0.00 0.00 64.05 61.32 1sbo n THR 95 Cb 1.06 0.57 -0.05 0.00 -1.82 0.00 0.00 70.33 70.09 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 1.36 -0.45 0.09 -1.42 8.25 0.03 -4.91 115.22 118.17 1sbo n HIS 96 Ca 0.21 0.00 -0.19 0.00 -0.26 0.00 0.00 57.72 57.48 1sbo n HIS 96 Cb 0.55 -3.65 -0.15 0.00 1.12 0.00 0.00 29.99 27.87 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 0.53 -1.18 2.41 -0.00 -0.29 -3.36 115.31 113.41 1sbo h LEU 97 Ca -0.45 -0.64 -0.05 0.00 -0.00 0.00 0.00 57.88 56.75 1sbo h LEU 97 Cb 1.35 -0.17 -0.02 0.00 -0.00 0.00 0.00 40.66 41.82 1sbo h LEU 97 CO 0.60 1.52 0.06 -0.78 -0.00 0.00 0.00 178.44 179.84 1sbo h ASP 98 N 0.09 0.58 0.33 -0.43 3.58 -1.71 -1.35 116.42 117.51 1sbo h ASP 98 Ca -0.23 -0.10 0.00 0.00 0.42 0.00 0.00 57.03 57.12 1sbo h ASP 98 Cb 2.05 -0.15 0.00 0.00 1.72 0.00 0.00 39.33 42.94 1sbo h ASP 98 CO 0.20 0.61 0.00 2.29 -2.88 0.00 0.00 179.24 179.47 1sbo n LYS 99 N -4.29 0.15 0.00 0.28 2.85 -1.26 -2.95 118.16 112.94 1sbo n LYS 99 Ca 0.02 0.18 0.00 0.00 -1.05 0.00 0.00 58.31 57.46 1sbo n LYS 99 Cb 0.23 -1.50 0.00 0.00 -0.65 0.00 0.00 35.03 33.11 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 -1.34 0.41 -4.12 0.58 -5.35 -0.57 -5.05 119.36 103.92 1sbo n ILE 100 Ca 0.06 -0.51 -0.05 0.00 -0.27 0.00 0.00 62.75 61.97 1sbo n ILE 100 Cb 0.13 0.92 -0.01 0.00 -1.74 0.00 0.00 39.64 38.94 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 -0.21 0.14 -4.46 4.28 3.01 -0.85 -5.08 117.46 114.28 1sbo n PHE 101 Ca 0.00 -0.46 -0.20 0.00 1.01 0.00 0.00 57.45 57.80 1sbo n PHE 101 Cb 0.27 -0.04 -0.15 0.00 -0.01 0.00 0.00 39.48 39.55 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 -2.31 0.90 -0.05 -1.08 2.20 -1.26 -4.94 119.74 113.19 1sbo s LYS 102 Ca 0.02 -0.38 0.00 0.00 -0.36 0.00 0.00 55.97 55.25 1sbo s LYS 102 Cb 0.00 -0.87 0.02 0.00 -1.51 0.00 0.00 37.83 35.48 1sbo s LYS 102 CO 0.01 0.22 -0.03 0.42 -0.36 0.00 0.00 175.35 175.61 1sbo s ILE 103 N -0.19 0.49 0.24 5.43 1.01 -1.26 -0.39 121.20 126.53 1sbo s ILE 103 Ca 0.03 -0.06 0.00 0.00 0.00 0.00 0.00 60.65 60.62 1sbo s ILE 103 Cb -0.05 -0.55 0.00 0.00 0.01 0.00 0.00 42.46 41.88 1sbo s ILE 103 CO -0.00 0.23 0.04 0.35 0.00 0.00 0.00 174.94 175.56 1sbo n THR 104 N 4.29 0.00 -0.05 2.92 -2.24 -0.08 -4.96 114.28 114.16 1sbo n THR 104 Ca -0.21 -1.08 -0.07 0.00 -2.27 0.00 0.00 64.05 60.42 1sbo n THR 104 Cb 0.51 0.11 -0.02 0.00 -2.10 0.00 0.00 70.33 68.82 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 -1.31 1.67 -4.87 3.42 8.00 -1.26 -3.29 116.55 118.90 1sbo n ASP 105 Ca -0.08 0.27 -0.29 0.00 0.71 0.00 0.00 54.79 55.40 1sbo n ASP 105 Cb 0.29 -0.61 -0.05 0.00 -0.02 0.00 0.00 41.12 40.73 1sbo n ASP 105 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 1sbo s THR 106 N -2.61 5.03 0.39 -3.53 -4.23 -1.26 -0.75 115.64 108.68 1sbo s THR 106 Ca -0.20 -0.63 0.07 0.00 -1.18 0.00 0.00 61.69 59.74 1sbo s THR 106 Cb 0.03 -3.49 0.28 0.00 1.34 0.00 0.00 72.50 70.67 1sbo s THR 106 CO 0.30 0.06 2.02 0.58 -0.54 0.00 0.00 174.62 177.04 1sbo h VAL 107 N 2.13 1.07 -0.94 2.29 2.07 -1.94 -2.57 116.25 118.36 1sbo h VAL 107 Ca -0.46 -0.22 0.09 0.00 0.82 0.00 0.00 66.70 66.92 1sbo h VAL 107 Cb 1.17 0.38 -0.07 0.00 -1.52 0.00 0.00 31.29 31.25 1sbo h VAL 107 CO 0.70 0.12 0.61 -0.33 0.02 0.00 0.00 177.57 178.68 1sbo h GLU 108 N 0.64 0.97 0.00 1.57 4.39 -2.01 -2.13 114.58 118.01 1sbo h GLU 108 Ca 0.22 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.86 1sbo h GLU 108 Cb 0.07 -0.22 0.00 0.00 -0.10 0.00 0.00 28.75 28.51 1sbo h GLU 108 CO -0.06 0.64 0.00 -1.91 -1.16 0.00 0.00 179.01 176.52 1sbo n GLU 109 N -4.53 0.78 0.00 2.33 4.07 -0.97 -5.17 120.64 117.14 1sbo n GLU 109 Ca 0.16 0.00 0.13 0.00 -0.06 0.00 0.00 57.16 57.39 1sbo n GLU 109 Cb 0.27 -1.50 0.40 0.00 -0.06 0.00 0.00 31.44 30.54 1sbo n GLU 109 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07