#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sbo h ASN 2 N 0.00 -0.34 -1.55 6.12 2.35 -1.97 -3.45 115.58 116.75 1sbo h ASN 2 Ca 0.00 0.01 -0.12 0.00 -0.55 0.00 0.00 56.30 55.65 1sbo h ASN 2 Cb 0.00 0.09 -0.27 0.00 0.05 0.00 0.00 38.32 38.19 1sbo h ASN 2 CO 0.00 -0.00 -0.47 0.21 -1.65 0.00 0.00 177.43 175.51 1sbo s ASN 3 N -4.40 -0.17 0.28 5.81 3.04 -1.26 -5.12 114.94 113.13 1sbo s ASN 3 Ca -0.06 -0.04 -0.30 0.00 0.04 0.00 0.00 52.86 52.50 1sbo s ASN 3 Cb 0.01 1.37 -0.10 0.00 -1.54 0.00 0.00 41.25 40.99 1sbo s ASN 3 CO 0.17 -0.33 1.46 -0.22 -3.04 0.00 0.00 177.10 175.14 1sbo s LEU 4 N 2.63 4.38 0.00 3.21 1.98 -1.26 -4.20 118.68 125.41 1sbo s LEU 4 Ca 0.11 2.77 0.00 0.00 -2.89 0.00 0.00 54.13 54.13 1sbo s LEU 4 Cb -0.13 -3.63 0.00 0.00 0.66 0.00 0.00 46.19 43.09 1sbo s LEU 4 CO -0.26 -0.74 0.00 0.29 -1.89 0.00 0.00 176.35 173.75 1sbo n LYS 5 N 1.85 -0.06 -3.75 1.98 5.02 -0.99 -4.95 118.16 117.27 1sbo n LYS 5 Ca 0.05 0.00 -0.23 0.00 -2.02 0.00 0.00 58.31 56.12 1sbo n LYS 5 Cb 0.40 0.00 -0.03 0.00 -0.02 0.00 0.00 35.03 35.37 1sbo n LYS 5 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1sbo n LEU 6 N 0.00 0.00 0.00 -0.35 4.32 -1.26 -0.48 117.00 119.23 1sbo n LEU 6 Ca 0.00 -2.29 0.00 0.00 -0.02 0.00 0.00 56.01 53.70 1sbo n LEU 6 Cb 0.00 0.17 0.00 0.00 -1.62 0.00 0.00 43.42 41.97 1sbo n LEU 6 CO 0.00 -0.39 -0.33 -0.67 -1.22 0.00 0.00 177.39 174.78 1sbo n ASP 7 N -1.44 2.72 -1.94 -1.43 2.03 0.01 -4.63 116.55 111.88 1sbo n ASP 7 Ca -0.11 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.20 1sbo n ASP 7 Cb 0.47 0.03 0.00 0.00 -0.72 0.00 0.00 41.12 40.90 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 -2.12 -9.29 -3.39 5.18 5.41 -1.26 -4.92 119.36 108.97 1sbo n ILE 8 Ca 0.00 2.53 -0.23 0.00 1.00 0.00 0.00 62.75 66.06 1sbo n ILE 8 Cb 0.33 -4.01 -0.09 0.00 -0.71 0.00 0.00 39.64 35.16 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 -0.65 -0.09 -0.21 1.39 1.01 0.61 -4.94 120.40 117.52 1sbo s VAL 9 Ca 0.00 -1.45 -0.29 0.00 0.00 0.00 0.00 61.98 60.24 1sbo s VAL 9 Cb 0.00 -0.88 -0.02 0.00 0.00 0.00 0.00 36.38 35.48 1sbo s VAL 9 CO 0.00 -0.80 1.41 -1.61 0.00 0.00 0.00 175.10 174.10 1sbo s GLU 10 N 1.13 4.02 0.00 2.72 2.02 -1.26 -0.39 118.70 126.94 1sbo s GLU 10 Ca 0.19 1.59 0.00 0.00 0.02 0.00 0.00 54.97 56.78 1sbo s GLU 10 Cb -0.16 -3.89 0.00 0.00 0.10 0.00 0.00 34.13 30.17 1sbo s GLU 10 CO -0.03 -1.00 0.00 0.94 0.02 0.00 0.00 175.26 175.19 1sbo n GLN 11 N 7.15 3.85 -0.07 1.61 0.00 0.44 -4.92 117.38 125.45 1sbo n GLN 11 Ca 0.16 0.00 -0.10 0.00 -0.00 0.00 0.00 57.00 57.06 1sbo n GLN 11 Cb 0.45 0.00 -0.08 0.00 0.00 0.00 0.00 30.24 30.61 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 0.00 0.00 1.69 3.58 -2.04 -3.44 116.42 116.21 1sbo h ASP 12 Ca 0.00 -0.57 0.00 0.00 0.42 0.00 0.00 57.03 56.88 1sbo h ASP 12 Cb 0.00 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.05 1sbo h ASP 12 CO 0.00 0.88 0.00 -0.67 -2.88 0.00 0.00 179.24 176.57 1sbo n ASP 13 N -4.64 0.19 -4.67 2.28 2.03 -1.26 -5.04 116.55 105.43 1sbo n ASP 13 Ca -0.09 -0.80 -0.35 0.00 0.52 0.00 0.00 54.79 54.07 1sbo n ASP 13 Cb 0.34 0.06 -0.10 0.00 -0.72 0.00 0.00 41.12 40.70 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 -0.06 2.94 -0.45 -0.67 -2.85 -1.26 -3.10 119.74 114.29 1sbo s LYS 14 Ca 0.00 -0.44 -0.13 0.00 -1.00 0.00 0.00 55.97 54.40 1sbo s LYS 14 Cb 0.00 -2.76 0.07 0.00 -2.06 0.00 0.00 37.83 33.08 1sbo s LYS 14 CO 0.00 0.69 0.35 0.00 0.10 0.00 0.00 175.35 176.49 1sbo s ALA 15 N -0.90 3.47 -0.08 0.59 0.00 0.15 -0.42 121.76 124.57 1sbo s ALA 15 Ca 0.14 -2.12 -0.30 0.00 0.00 0.00 0.00 51.96 49.68 1sbo s ALA 15 Cb -0.11 -2.93 -0.02 0.00 0.00 0.00 0.00 23.12 20.06 1sbo s ALA 15 CO 0.03 -1.70 1.02 0.42 0.00 0.00 0.00 175.76 175.53 1sbo s ILE 16 N 1.57 4.76 -0.76 0.00 1.01 0.48 -1.31 121.20 126.95 1sbo s ILE 16 Ca 0.04 2.01 0.03 0.00 0.00 0.00 0.00 60.65 62.72 1sbo s ILE 16 Cb -0.24 -4.29 0.18 0.00 0.01 0.00 0.00 42.46 38.12 1sbo s ILE 16 CO 0.05 0.04 0.57 -0.69 0.00 0.00 0.00 174.94 174.92 1sbo s VAL 17 N 1.80 3.39 0.26 2.92 1.01 0.11 -0.28 120.40 129.60 1sbo s VAL 17 Ca 0.50 -4.06 -0.31 0.00 0.00 0.00 0.00 61.98 58.11 1sbo s VAL 17 Cb -0.19 -3.18 -0.12 0.00 0.00 0.00 0.00 36.38 32.89 1sbo s VAL 17 CO 0.20 -1.02 1.60 0.54 0.00 0.00 0.00 175.10 176.42 1sbo n ARG 18 N 2.19 2.60 -2.83 2.72 1.74 -1.26 -3.61 116.66 118.21 1sbo n ARG 18 Ca 0.19 0.93 -0.26 0.00 -0.77 0.00 0.00 57.85 57.94 1sbo n ARG 18 Cb 0.36 -2.71 -0.00 0.00 -1.02 0.00 0.00 32.46 29.08 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 0.28 4.90 0.06 1.55 1.01 -0.66 -0.80 120.40 126.73 1sbo s VAL 19 Ca 0.68 0.00 0.04 0.00 0.00 0.00 0.00 61.98 62.70 1sbo s VAL 19 Cb -0.53 -3.84 -0.03 0.00 0.00 0.00 0.00 36.38 31.98 1sbo s VAL 19 CO 0.45 -0.75 -0.13 -1.10 0.00 0.00 0.00 175.10 173.57 1sbo s GLN 20 N -4.64 0.78 0.00 2.72 -0.21 0.37 -4.54 119.66 114.13 1sbo s GLN 20 Ca 0.46 -0.86 0.00 0.00 0.02 0.00 0.00 55.36 54.97 1sbo s GLN 20 Cb -0.10 -0.74 0.00 0.00 1.00 0.00 0.00 33.01 33.17 1sbo s GLN 20 CO 0.42 0.17 0.00 0.41 -2.12 0.00 0.00 175.29 174.17 1sbo n GLY 21 N 1.46 -0.05 3.75 3.09 0.00 -1.25 -2.34 105.19 109.85 1sbo n GLY 21 Ca -0.21 -1.70 -0.34 0.00 0.00 0.00 0.00 46.02 43.78 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 -1.94 4.75 -0.35 1.61 1.01 -1.26 -3.88 116.67 116.61 1sbo s ASP 22 Ca 0.00 2.14 0.00 0.00 0.71 0.00 0.00 52.55 55.41 1sbo s ASP 22 Cb 0.00 -2.57 0.09 0.00 1.01 0.00 0.00 42.92 41.45 1sbo s ASP 22 CO 0.00 -1.88 0.08 -0.51 0.21 0.00 0.00 175.17 173.07 1sbo s ILE 23 N -2.19 2.79 0.05 0.77 2.07 -0.53 -4.79 121.20 119.38 1sbo s ILE 23 Ca 0.70 -1.94 -0.01 0.00 -1.41 0.00 0.00 60.65 57.99 1sbo s ILE 23 Cb -0.24 -2.85 0.00 0.00 0.13 0.00 0.00 42.46 39.50 1sbo s ILE 23 CO 0.43 -0.46 0.08 -0.90 -1.91 0.00 0.00 174.94 172.18 1sbo n ASP 24 N 4.48 -0.23 -0.02 4.50 5.68 -1.26 -1.60 116.55 128.09 1sbo n ASP 24 Ca -0.04 -1.28 0.23 0.00 -0.50 0.00 0.00 54.79 53.20 1sbo n ASP 24 Cb 0.42 0.42 0.64 0.00 -1.14 0.00 0.00 41.12 41.46 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 1.60 2.43 0.05 2.12 0.00 -1.96 0.84 119.26 124.34 1sbo h ALA 25 Ca -0.04 -0.02 -0.29 0.00 0.00 0.00 0.00 54.91 54.55 1sbo h ALA 25 Cb 0.18 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 1sbo h ALA 25 CO 0.06 -1.07 -1.60 1.88 0.00 0.00 0.00 179.25 178.51 1sbo h TYR 26 N 0.00 0.18 0.00 0.00 0.05 -1.96 -3.28 116.97 111.96 1sbo h TYR 26 Ca 0.31 -0.13 0.00 0.00 0.05 0.00 0.00 58.73 58.95 1sbo h TYR 26 Cb 1.78 -0.01 0.00 0.00 1.01 0.00 0.00 36.73 39.52 1sbo h TYR 26 CO 0.00 1.21 -0.02 -1.71 -1.05 0.00 0.00 178.16 176.58 1sbo n ASN 27 N -3.25 0.71 0.00 3.88 5.15 -0.13 -3.89 115.26 117.73 1sbo n ASN 27 Ca -0.16 0.55 0.00 0.00 -0.60 0.00 0.00 54.58 54.36 1sbo n ASN 27 Cb 1.03 -0.72 0.00 0.00 -0.53 0.00 0.00 39.78 39.56 1sbo n ASN 27 CO 0.00 0.00 0.00 -1.20 1.40 0.00 0.00 177.26 177.46 1sbo n SER 28 N -2.16 0.00 0.00 1.20 7.64 0.10 -1.47 113.62 118.94 1sbo n SER 28 Ca 0.06 0.46 0.00 0.00 1.01 0.00 0.00 58.87 60.40 1sbo n SER 28 Cb 0.42 -0.46 0.00 0.00 -1.01 0.00 0.00 64.21 63.16 1sbo n SER 28 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 1sbo n SER 29 N -1.46 4.85 0.00 6.43 3.41 -1.25 -4.69 113.62 120.91 1sbo n SER 29 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 1sbo n SER 29 Cb 0.00 0.62 0.00 0.00 -0.26 0.00 0.00 64.21 64.57 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 -1.82 0.00 0.11 4.33 4.07 -0.54 -0.60 120.64 126.18 1sbo n GLU 30 Ca 0.00 0.24 0.09 0.00 -0.06 0.00 0.00 57.16 57.43 1sbo n GLU 30 Cb 0.36 -1.16 0.57 0.00 -0.06 0.00 0.00 31.44 31.14 1sbo n GLU 30 CO 0.00 0.00 0.00 1.25 -0.06 0.00 0.00 177.13 178.32 1sbo h LEU 31 N 0.00 0.18 0.45 4.31 5.85 -1.83 0.53 115.31 124.80 1sbo h LEU 31 Ca 0.00 -0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 1sbo h LEU 31 Cb 0.00 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 40.97 1sbo h LEU 31 CO 0.00 0.13 -0.42 0.50 -0.34 0.00 0.00 178.44 178.31 1sbo h LYS 32 N 0.21 -0.84 -0.01 1.25 3.64 -1.65 -1.60 116.57 117.56 1sbo h LYS 32 Ca 0.11 0.06 -0.00 0.00 -1.27 0.00 0.00 60.65 59.55 1sbo h LYS 32 Cb 0.18 0.19 -0.00 0.00 -0.41 0.00 0.00 32.23 32.19 1sbo h LYS 32 CO -0.02 -0.56 0.01 0.93 -2.27 0.00 0.00 179.45 177.54 1sbo h GLU 33 N -0.88 0.02 0.00 1.90 5.08 -0.05 -0.26 114.58 120.40 1sbo h GLU 33 Ca -0.04 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 1sbo h GLU 33 Cb 0.77 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.01 1sbo h GLU 33 CO -0.05 0.10 0.00 1.04 -1.00 0.00 0.00 179.01 179.11 1sbo n GLN 34 N -5.04 0.13 -0.07 2.33 1.13 0.10 -0.74 117.38 115.23 1sbo n GLN 34 Ca -0.07 0.20 -0.13 0.00 -1.94 0.00 0.00 57.00 55.06 1sbo n GLN 34 Cb 0.07 -1.50 -0.04 0.00 0.11 0.00 0.00 30.24 28.88 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 -1.31 1.45 -0.28 1.08 4.77 -0.61 -3.91 117.00 118.19 1sbo n LEU 35 Ca 0.05 0.24 0.16 0.00 -0.03 0.00 0.00 56.01 56.43 1sbo n LEU 35 Cb 0.09 -0.56 0.43 0.00 -2.33 0.00 0.00 43.42 41.05 1sbo n LEU 35 CO 0.09 0.01 1.22 0.08 -1.33 0.00 0.00 177.39 177.45 1sbo h ARG 36 N -0.65 0.54 -0.17 3.23 0.11 -0.79 0.72 114.38 117.37 1sbo h ARG 36 Ca -0.25 -0.03 -0.05 0.00 0.10 0.00 0.00 59.98 59.74 1sbo h ARG 36 Cb 1.06 -0.12 -0.00 0.00 1.11 0.00 0.00 29.97 32.02 1sbo h ARG 36 CO -0.15 0.36 -0.10 -0.97 0.10 0.00 0.00 179.97 179.21 1sbo h ASN 37 N 0.56 0.39 -0.31 0.08 -1.24 -1.17 -3.03 115.58 110.86 1sbo h ASN 37 Ca 0.49 -0.43 -0.16 0.00 0.71 0.00 0.00 56.30 56.91 1sbo h ASN 37 Cb 1.01 -0.11 -0.00 0.00 0.73 0.00 0.00 38.32 39.95 1sbo h ASN 37 CO -0.23 0.73 -0.44 0.15 -1.29 0.00 0.00 177.43 176.35 1sbo h PHE 38 N 0.05 1.04 -1.00 0.67 3.04 -1.23 -3.01 116.94 116.50 1sbo h PHE 38 Ca 0.04 -0.35 0.27 0.00 3.98 0.00 0.00 57.97 61.91 1sbo h PHE 38 Cb 0.59 -0.21 -0.06 0.00 2.56 0.00 0.00 35.95 38.84 1sbo h PHE 38 CO 0.07 1.16 0.68 0.82 -2.02 0.00 0.00 178.31 179.02 1sbo h ILE 39 N 0.63 0.54 0.42 1.41 5.03 0.35 0.58 117.51 126.47 1sbo h ILE 39 Ca 0.03 -0.07 -0.02 0.00 -0.12 0.00 0.00 64.86 64.68 1sbo h ILE 39 Cb 1.04 0.32 0.00 0.00 -3.03 0.00 0.00 36.82 35.16 1sbo h ILE 39 CO 0.10 0.04 -0.20 -1.28 -0.68 0.00 0.00 178.15 176.13 1sbo h SER 40 N 0.20 -0.48 -0.34 1.72 0.87 -1.40 -3.32 113.55 110.81 1sbo h SER 40 Ca 0.51 -0.10 -0.08 0.00 -1.23 0.00 0.00 61.79 60.90 1sbo h SER 40 Cb 1.64 0.12 -0.02 0.00 -0.44 0.00 0.00 62.40 63.70 1sbo h SER 40 CO -0.13 -0.16 -0.04 0.74 -0.53 0.00 0.00 176.83 176.71 1sbo h THR 41 N -0.83 1.24 -1.99 2.23 2.02 -1.04 -3.46 112.91 111.09 1sbo h THR 41 Ca -0.06 -1.03 -0.59 0.00 0.77 0.00 0.00 66.41 65.50 1sbo h THR 41 Cb 0.55 0.96 0.01 0.00 -1.74 0.00 0.00 68.15 67.92 1sbo h THR 41 CO 0.10 0.36 1.30 1.07 0.37 0.00 0.00 175.52 178.71 1sbo n THR 42 N -4.20 0.52 0.27 3.16 5.66 0.19 -4.83 114.28 115.04 1sbo n THR 42 Ca 0.02 -0.24 0.12 0.00 -3.05 0.00 0.00 64.05 60.90 1sbo n THR 42 Cb 0.31 -2.19 0.76 0.00 -1.55 0.00 0.00 70.33 67.67 1sbo n THR 42 CO 0.00 0.00 0.00 0.77 -3.05 0.00 0.00 175.07 172.79 1sbo h SER 43 N 11.79 0.00 -1.31 1.09 4.64 -1.89 -3.45 113.55 124.43 1sbo h SER 43 Ca -0.44 0.00 -0.47 0.00 -0.47 0.00 0.00 61.79 60.41 1sbo h SER 43 Cb 1.26 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.35 1sbo h SER 43 CO 0.96 0.08 -0.28 -0.54 -0.87 0.00 0.00 176.83 176.18 1sbo s LYS 44 N -4.45 2.61 -0.02 4.77 1.02 -1.26 -5.07 119.74 117.34 1sbo s LYS 44 Ca -0.04 -1.45 0.01 0.00 0.02 0.00 0.00 55.97 54.51 1sbo s LYS 44 Cb 0.14 -2.57 -0.02 0.00 -0.52 0.00 0.00 37.83 34.86 1sbo s LYS 44 CO 0.59 -0.36 0.00 1.63 -0.92 0.00 0.00 175.35 176.29 1sbo n LYS 45 N -1.80 3.47 -2.23 1.68 5.02 -1.18 -4.87 118.16 118.25 1sbo n LYS 45 Ca 0.07 0.00 -0.41 0.00 -2.02 0.00 0.00 58.31 55.95 1sbo n LYS 45 Cb 0.61 -1.04 -0.03 0.00 -0.02 0.00 0.00 35.03 34.54 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 -2.04 4.39 -0.33 1.97 3.01 -1.24 -0.15 119.74 125.35 1sbo s LYS 46 Ca -0.01 2.03 0.02 0.00 -1.01 0.00 0.00 55.97 57.01 1sbo s LYS 46 Cb 0.01 -3.20 0.09 0.00 -1.01 0.00 0.00 37.83 33.71 1sbo s LYS 46 CO 0.07 -0.25 0.03 0.42 0.51 0.00 0.00 175.35 176.13 1sbo s ILE 47 N 0.15 2.47 -0.36 2.17 -1.09 -1.21 0.32 121.20 123.65 1sbo s ILE 47 Ca 0.57 -2.03 -0.11 0.00 -2.23 0.00 0.00 60.65 56.84 1sbo s ILE 47 Cb -0.36 -2.67 0.01 0.00 -1.58 0.00 0.00 42.46 37.86 1sbo s ILE 47 CO 0.38 -0.42 0.21 -0.69 -1.23 0.00 0.00 174.94 173.19 1sbo s VAL 48 N 1.02 4.76 -0.32 2.92 1.01 -0.43 -1.26 120.40 128.10 1sbo s VAL 48 Ca 0.04 -0.65 -0.00 0.00 0.00 0.00 0.00 61.98 61.37 1sbo s VAL 48 Cb -0.20 -3.57 0.07 0.00 0.00 0.00 0.00 36.38 32.68 1sbo s VAL 48 CO -0.06 -0.14 0.03 -0.76 0.00 0.00 0.00 175.10 174.16 1sbo s LEU 49 N 1.61 4.22 0.22 3.92 1.43 -0.31 0.05 118.68 129.81 1sbo s LEU 49 Ca 0.04 -1.60 -0.30 0.00 -1.03 0.00 0.00 54.13 51.24 1sbo s LEU 49 Cb -0.18 -1.69 -0.08 0.00 0.03 0.00 0.00 46.19 44.26 1sbo s LEU 49 CO 0.07 -0.32 0.99 -0.62 0.23 0.00 0.00 176.35 176.70 1sbo s ASP 50 N 1.27 7.51 -0.18 2.29 2.15 -1.24 0.02 116.67 128.49 1sbo s ASP 50 Ca -0.01 1.99 0.14 0.00 0.43 0.00 0.00 52.55 55.11 1sbo s ASP 50 Cb -0.20 -2.61 0.38 0.00 -0.30 0.00 0.00 42.92 40.19 1sbo s ASP 50 CO -0.04 0.02 1.21 0.18 -0.17 0.00 0.00 175.17 176.37 1sbo n LEU 51 N 1.78 2.65 0.10 -1.34 7.99 0.15 -1.65 117.00 126.67 1sbo n LEU 51 Ca -0.01 -3.59 0.04 0.00 -0.01 0.00 0.00 56.01 52.44 1sbo n LEU 51 Cb 0.47 -0.50 0.44 0.00 -0.11 0.00 0.00 43.42 43.72 1sbo n LEU 51 CO 0.51 1.14 1.01 -1.28 -1.51 0.00 0.00 177.39 177.26 1sbo h SER 52 N 0.65 0.28 0.58 -1.43 0.87 -1.51 -2.23 113.55 110.76 1sbo h SER 52 Ca 0.01 -0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.54 1sbo h SER 52 Cb 1.03 -0.07 0.00 0.00 -0.44 0.00 0.00 62.40 62.92 1sbo h SER 52 CO 0.02 0.32 -0.25 -1.20 -0.53 0.00 0.00 176.83 175.19 1sbo n SER 53 N -4.38 0.40 -4.41 6.23 7.64 -1.26 -4.72 113.62 113.12 1sbo n SER 53 Ca 0.00 -0.18 -0.44 0.00 1.01 0.00 0.00 58.87 59.26 1sbo n SER 53 Cb 0.17 -0.04 -0.04 0.00 -1.01 0.00 0.00 64.21 63.29 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 -2.83 4.72 -0.62 0.44 1.01 -0.84 -3.84 120.40 118.45 1sbo s VAL 54 Ca 0.17 -1.06 0.24 0.00 0.00 0.00 0.00 61.98 61.34 1sbo s VAL 54 Cb 0.19 -4.61 0.09 0.00 0.00 0.00 0.00 36.38 32.05 1sbo s VAL 54 CO 0.58 -1.30 1.37 0.28 0.00 0.00 0.00 175.10 176.04 1sbo h SER 55 N 9.11 0.00 -4.53 3.32 0.02 -1.84 -3.43 113.55 116.20 1sbo h SER 55 Ca -0.16 -0.16 -0.18 0.00 -0.84 0.00 0.00 61.79 60.44 1sbo h SER 55 Cb 1.07 0.00 -0.23 0.00 0.14 0.00 0.00 62.40 63.37 1sbo h SER 55 CO 1.10 0.08 -0.63 -0.47 -1.14 0.00 0.00 176.83 175.77 1sbo s TYR 56 N -3.17 0.09 -0.02 3.45 5.04 -1.26 -4.99 117.35 116.49 1sbo s TYR 56 Ca 0.06 -0.18 0.02 0.00 -2.44 0.00 0.00 57.07 54.53 1sbo s TYR 56 Cb 0.13 -0.08 0.01 0.00 0.35 0.00 0.00 41.96 42.37 1sbo s TYR 56 CO 0.71 -0.16 -0.06 1.41 -1.34 0.00 0.00 175.55 176.11 1sbo s MET 57 N -0.90 0.68 0.47 4.97 -2.45 -1.26 -1.45 119.30 119.36 1sbo s MET 57 Ca -0.10 -0.19 0.08 0.00 -1.25 0.00 0.00 55.69 54.23 1sbo s MET 57 Cb -0.06 -0.67 0.01 0.00 1.25 0.00 0.00 34.83 35.36 1sbo s MET 57 CO 0.00 0.05 0.46 0.34 1.05 0.00 0.00 175.02 176.93 1sbo s ASP 58 N 0.30 5.02 0.63 1.11 2.15 -0.63 -4.99 116.67 120.27 1sbo s ASP 58 Ca -0.04 -0.84 0.31 0.00 0.43 0.00 0.00 52.55 52.41 1sbo s ASP 58 Cb -0.08 -0.23 1.67 0.00 -0.30 0.00 0.00 42.92 43.98 1sbo s ASP 58 CO -0.00 -0.86 2.00 0.28 -0.17 0.00 0.00 175.17 176.41 1sbo h SER 59 N 0.80 0.00 -0.55 -0.34 0.02 -2.00 0.17 113.55 111.66 1sbo h SER 59 Ca -0.38 0.00 0.03 0.00 -0.84 0.00 0.00 61.79 60.59 1sbo h SER 59 Cb 1.28 0.00 -0.04 0.00 0.14 0.00 0.00 62.40 63.78 1sbo h SER 59 CO 0.54 0.00 0.32 0.00 -1.14 0.00 0.00 176.83 176.55 1sbo h ALA 60 N 1.53 0.70 -0.25 3.77 0.00 -1.91 -1.17 119.26 121.94 1sbo h ALA 60 Ca 0.07 -0.01 0.01 0.00 0.00 0.00 0.00 54.91 54.98 1sbo h ALA 60 Cb 0.69 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.32 1sbo h ALA 60 CO -0.00 0.03 0.15 0.78 0.00 0.00 0.00 179.25 180.21 1sbo h GLY 61 N 0.64 0.34 0.73 0.00 0.00 -1.09 -1.34 103.07 102.35 1sbo h GLY 61 Ca 0.22 -0.12 -0.01 0.00 0.00 0.00 0.00 47.33 47.43 1sbo h GLY 61 CO -0.11 0.11 -0.30 -2.00 0.00 0.00 0.00 176.54 174.24 1sbo h LEU 62 N 0.32 -0.80 -0.78 3.11 5.85 -1.30 0.17 115.31 121.88 1sbo h LEU 62 Ca 0.09 0.06 0.00 0.00 0.84 0.00 0.00 57.88 58.88 1sbo h LEU 62 Cb -0.02 0.26 0.00 0.00 0.37 0.00 0.00 40.66 41.27 1sbo h LEU 62 CO -0.03 -0.45 0.00 0.61 -0.34 0.00 0.00 178.44 178.23 1sbo n GLY 63 N -1.43 -0.74 0.01 3.75 0.00 -0.48 -0.78 105.19 105.52 1sbo n GLY 63 Ca -0.10 0.11 0.09 0.00 0.00 0.00 0.00 46.02 46.12 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 -1.92 0.00 -0.12 2.61 -1.04 -0.51 -3.97 114.28 109.33 1sbo n THR 64 Ca -0.01 -0.32 -0.24 0.00 -2.04 0.00 0.00 64.05 61.44 1sbo n THR 64 Cb 0.03 0.35 -0.10 0.00 -1.82 0.00 0.00 70.33 68.80 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 -1.94 1.91 0.20 -4.42 4.77 -0.06 -4.32 117.00 113.13 1sbo n LEU 65 Ca -0.01 0.39 0.06 0.00 -0.03 0.00 0.00 56.01 56.41 1sbo n LEU 65 Cb 0.43 -0.88 0.54 0.00 -2.33 0.00 0.00 43.42 41.19 1sbo n LEU 65 CO 0.39 0.34 1.01 1.62 -1.33 0.00 0.00 177.39 179.42 1sbo h VAL 66 N -1.00 1.07 -0.95 4.08 3.04 -1.19 0.72 116.25 122.03 1sbo h VAL 66 Ca -0.48 -0.31 0.12 0.00 -1.01 0.00 0.00 66.70 65.02 1sbo h VAL 66 Cb 1.39 1.07 -0.08 0.00 -2.01 0.00 0.00 31.29 31.66 1sbo h VAL 66 CO -0.29 0.10 0.57 1.62 -1.01 0.00 0.00 177.57 178.56 1sbo h VAL 67 N 0.09 0.88 0.00 1.51 3.04 -1.79 -1.86 116.25 118.12 1sbo h VAL 67 Ca 0.02 -0.30 -0.02 0.00 -1.01 0.00 0.00 66.70 65.39 1sbo h VAL 67 Cb 0.14 -0.09 -0.00 0.00 -2.01 0.00 0.00 31.29 29.33 1sbo h VAL 67 CO 0.01 0.16 -0.08 0.40 -1.01 0.00 0.00 177.57 177.05 1sbo h ILE 68 N 0.89 0.22 -0.84 3.17 1.08 -1.04 -2.59 117.51 118.41 1sbo h ILE 68 Ca 0.48 -0.64 0.05 0.00 -0.39 0.00 0.00 64.86 64.36 1sbo h ILE 68 Cb 0.51 1.52 -0.06 0.00 -3.07 0.00 0.00 36.82 35.72 1sbo h ILE 68 CO -0.28 0.07 0.52 0.25 -0.69 0.00 0.00 178.15 178.03 1sbo h LEU 69 N 0.00 0.85 0.26 1.44 5.85 -1.29 0.20 115.31 122.62 1sbo h LEU 69 Ca -0.00 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 1sbo h LEU 69 Cb 0.51 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.37 1sbo h LEU 69 CO 0.01 0.56 -0.13 0.11 -0.34 0.00 0.00 178.44 178.66 1sbo h LYS 70 N 0.99 -0.34 -0.89 1.25 1.57 -1.58 -0.65 116.57 116.91 1sbo h LYS 70 Ca 0.35 0.02 0.24 0.00 -1.87 0.00 0.00 60.65 59.40 1sbo h LYS 70 Cb 0.09 0.08 -0.15 0.00 0.08 0.00 0.00 32.23 32.33 1sbo h LYS 70 CO -0.14 -0.23 0.19 -0.44 -0.57 0.00 0.00 179.45 178.26 1sbo h ASP 71 N -0.75 -0.10 0.33 0.86 5.19 -1.45 0.45 116.42 120.95 1sbo h ASP 71 Ca -0.04 0.21 -0.01 0.00 -0.62 0.00 0.00 57.03 56.58 1sbo h ASP 71 Cb 0.27 0.31 -0.01 0.00 0.18 0.00 0.00 39.33 40.08 1sbo h ASP 71 CO 0.06 -0.21 -0.32 0.00 -3.12 0.00 0.00 179.24 175.65 1sbo h ALA 72 N 1.82 -1.01 -0.67 3.45 0.00 -0.64 -2.22 119.26 119.99 1sbo h ALA 72 Ca 0.56 -0.12 0.13 0.00 0.00 0.00 0.00 54.91 55.47 1sbo h ALA 72 Cb 1.15 0.55 -0.13 0.00 0.00 0.00 0.00 17.79 19.36 1sbo h ALA 72 CO -0.71 -1.03 -0.27 -0.22 0.00 0.00 0.00 179.25 177.02 1sbo h LYS 73 N -0.64 -0.08 -0.83 0.00 3.64 0.77 0.23 116.57 119.66 1sbo h LYS 73 Ca -0.04 0.01 0.16 0.00 -1.27 0.00 0.00 60.65 59.51 1sbo h LYS 73 Cb 0.55 0.02 -0.06 0.00 -0.41 0.00 0.00 32.23 32.33 1sbo h LYS 73 CO -0.04 -0.05 0.55 0.82 -2.27 0.00 0.00 179.45 178.46 1sbo h ILE 74 N -0.08 0.77 -0.45 2.00 2.04 -0.14 0.12 117.51 121.77 1sbo h ILE 74 Ca 0.29 -0.16 0.00 0.00 1.00 0.00 0.00 64.86 65.99 1sbo h ILE 74 Cb 0.55 0.25 0.00 0.00 -0.74 0.00 0.00 36.82 36.88 1sbo h ILE 74 CO -0.73 0.09 0.00 -3.20 0.00 0.00 0.00 178.15 174.31 1sbo n ASN 75 N -4.51 3.29 0.00 1.72 2.85 -0.28 -4.98 115.26 113.36 1sbo n ASN 75 Ca 0.16 -1.95 0.00 0.00 -0.11 0.00 0.00 54.58 52.69 1sbo n ASN 75 Cb 0.56 -0.30 0.00 0.00 1.24 0.00 0.00 39.78 41.28 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 1.11 0.47 3.96 8.20 0.00 0.14 -5.04 105.19 114.03 1sbo n GLY 76 Ca 0.17 -0.78 -0.22 0.00 0.00 0.00 0.00 46.02 45.19 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 -1.44 3.45 0.44 1.61 -0.14 0.58 -4.93 119.74 119.31 1sbo s LYS 77 Ca 0.00 -0.65 0.07 0.00 -1.36 0.00 0.00 55.97 54.04 1sbo s LYS 77 Cb 0.00 -2.83 0.07 0.00 -1.68 0.00 0.00 37.83 33.39 1sbo s LYS 77 CO 0.00 0.36 0.59 -1.91 -0.76 0.00 0.00 175.35 173.62 1sbo n GLU 78 N -1.50 0.71 -3.64 1.68 4.07 0.78 -3.40 120.64 119.35 1sbo n GLU 78 Ca -0.08 -2.39 -0.09 0.00 -0.06 0.00 0.00 57.16 54.55 1sbo n GLU 78 Cb 0.57 -0.15 -0.07 0.00 -0.06 0.00 0.00 31.44 31.73 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 -1.75 -0.97 0.02 4.31 5.36 -1.26 -3.30 117.98 120.39 1sbo s PHE 79 Ca 0.45 2.04 -0.07 0.00 -0.96 0.00 0.00 56.93 58.38 1sbo s PHE 79 Cb -0.04 0.52 -0.00 0.00 -0.34 0.00 0.00 43.02 43.16 1sbo s PHE 79 CO 0.28 -0.48 0.13 0.42 -1.46 0.00 0.00 175.22 174.12 1sbo s ILE 80 N 1.28 0.11 0.18 3.12 1.01 -0.39 -4.64 121.20 121.85 1sbo s ILE 80 Ca -0.07 -0.87 0.09 0.00 0.00 0.00 0.00 60.65 59.79 1sbo s ILE 80 Cb -0.05 -0.68 -0.04 0.00 0.01 0.00 0.00 42.46 41.70 1sbo s ILE 80 CO -0.14 -0.48 -0.09 -0.76 0.00 0.00 0.00 174.94 173.47 1sbo s LEU 81 N -1.77 2.99 0.03 2.97 1.43 0.12 -1.16 118.68 123.28 1sbo s LEU 81 Ca -0.10 -0.56 -0.00 0.00 -1.03 0.00 0.00 54.13 52.44 1sbo s LEU 81 Cb -0.04 -1.68 -0.02 0.00 0.03 0.00 0.00 46.19 44.47 1sbo s LEU 81 CO -0.02 0.11 -0.03 -0.94 0.23 0.00 0.00 176.35 175.71 1sbo s SER 82 N -2.79 0.30 -1.03 2.29 1.04 0.10 -0.37 113.70 113.23 1sbo s SER 82 Ca 0.25 -0.62 -0.06 0.00 0.48 0.00 0.00 55.95 55.99 1sbo s SER 82 Cb -0.09 0.13 0.01 0.00 0.10 0.00 0.00 66.02 66.17 1sbo s SER 82 CO 0.15 -0.38 0.90 -0.24 0.98 0.00 0.00 173.24 174.65 1sbo n SER 83 N 1.21 -5.12 -4.71 7.02 2.88 -0.14 0.33 113.62 115.09 1sbo n SER 83 Ca -0.21 -0.42 -0.29 0.00 -1.33 0.00 0.00 58.87 56.62 1sbo n SER 83 Cb 0.57 -3.99 0.17 0.00 -0.75 0.00 0.00 64.21 60.20 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 -5.81 1.68 0.21 2.46 2.01 -1.26 -1.60 118.68 116.36 1sbo s LEU 84 Ca 0.42 1.09 0.05 0.00 0.01 0.00 0.00 54.13 55.70 1sbo s LEU 84 Cb -0.18 -3.30 -0.03 0.00 0.01 0.00 0.00 46.19 42.68 1sbo s LEU 84 CO 0.56 -2.99 0.24 -0.54 1.01 0.00 0.00 176.35 174.63 1sbo s LYS 85 N -5.07 3.15 0.41 1.70 1.02 -1.26 -4.86 119.74 114.83 1sbo s LYS 85 Ca 0.65 -0.85 0.16 0.00 0.02 0.00 0.00 55.97 55.95 1sbo s LYS 85 Cb -0.17 -2.74 0.90 0.00 -0.52 0.00 0.00 37.83 35.29 1sbo s LYS 85 CO 0.56 0.45 1.90 1.49 -0.92 0.00 0.00 175.35 178.83 1sbo h GLU 86 N 1.74 0.00 0.00 1.68 4.81 -1.97 0.27 114.58 121.11 1sbo h GLU 86 Ca -0.49 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 58.74 1sbo h GLU 86 Cb 1.22 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 30.60 1sbo h GLU 86 CO 0.63 0.29 -0.00 0.77 -0.73 0.00 0.00 179.01 179.96 1sbo h SER 87 N 0.00 0.00 0.00 1.04 0.02 -1.95 -2.93 113.55 109.73 1sbo h SER 87 Ca -0.00 0.00 -0.12 0.00 -0.84 0.00 0.00 61.79 60.82 1sbo h SER 87 Cb 0.55 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.06 1sbo h SER 87 CO 0.04 0.00 -1.46 -0.38 -1.14 0.00 0.00 176.83 173.89 1sbo n ILE 88 N -3.10 0.46 -0.16 3.27 2.08 0.33 -3.80 119.36 118.43 1sbo n ILE 88 Ca -0.02 -0.16 -0.05 0.00 0.56 0.00 0.00 62.75 63.07 1sbo n ILE 88 Cb 0.14 -0.93 0.04 0.00 -0.75 0.00 0.00 39.64 38.14 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 -0.05 0.39 -0.60 4.38 0.02 -0.66 0.19 113.55 117.22 1sbo h SER 89 Ca -0.18 0.02 0.02 0.00 -0.84 0.00 0.00 61.79 60.81 1sbo h SER 89 Cb 1.26 -0.06 -0.04 0.00 0.14 0.00 0.00 62.40 63.71 1sbo h SER 89 CO -0.05 0.27 0.38 0.08 -1.14 0.00 0.00 176.83 176.37 1sbo h ARG 90 N 0.51 0.73 -0.69 3.45 0.11 -1.75 -2.77 114.38 113.97 1sbo h ARG 90 Ca 0.21 -0.04 0.01 0.00 0.10 0.00 0.00 59.98 60.25 1sbo h ARG 90 Cb 0.09 -0.17 -0.03 0.00 1.11 0.00 0.00 29.97 30.97 1sbo h ARG 90 CO -0.13 0.48 0.46 0.82 0.10 0.00 0.00 179.97 181.70 1sbo h ILE 91 N 0.75 1.17 -0.51 0.08 2.04 -1.10 0.31 117.51 120.26 1sbo h ILE 91 Ca 0.23 -0.32 -0.00 0.00 1.00 0.00 0.00 64.86 65.77 1sbo h ILE 91 Cb -0.02 0.16 -0.02 0.00 -0.74 0.00 0.00 36.82 36.20 1sbo h ILE 91 CO -0.08 0.17 0.32 -0.07 0.00 0.00 0.00 178.15 178.48 1sbo h LEU 92 N 0.93 0.61 -0.43 1.44 3.38 -1.24 -2.91 115.31 117.09 1sbo h LEU 92 Ca 0.25 -0.05 0.01 0.00 0.09 0.00 0.00 57.88 58.19 1sbo h LEU 92 Cb -0.10 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.47 1sbo h LEU 92 CO -0.06 0.48 0.27 0.50 0.09 0.00 0.00 178.44 179.72 1sbo h LYS 93 N 0.69 0.53 -0.96 1.13 3.64 -0.26 0.39 116.57 121.74 1sbo h LYS 93 Ca 0.19 -0.03 0.20 0.00 -1.27 0.00 0.00 60.65 59.73 1sbo h LYS 93 Cb -0.02 -0.12 -0.08 0.00 -0.41 0.00 0.00 32.23 31.59 1sbo h LYS 93 CO -0.04 0.35 0.61 -0.07 -2.27 0.00 0.00 179.45 178.03 1sbo h LEU 94 N 0.54 0.58 -3.13 5.20 -0.00 -0.49 0.79 115.31 118.80 1sbo h LEU 94 Ca 0.17 0.06 0.00 0.00 -0.00 0.00 0.00 57.88 58.11 1sbo h LEU 94 Cb -0.02 -0.04 0.00 0.00 -0.00 0.00 0.00 40.66 40.60 1sbo h LEU 94 CO -0.06 0.22 0.00 0.41 -0.00 0.00 0.00 178.44 179.01 1sbo n THR 95 N -4.62 1.81 -3.41 0.22 -1.04 -1.00 -4.94 114.28 101.30 1sbo n THR 95 Ca 0.21 -1.26 -0.25 0.00 -2.04 0.00 0.00 64.05 60.71 1sbo n THR 95 Cb 0.64 0.12 0.04 0.00 -1.82 0.00 0.00 70.33 69.31 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 0.86 -2.21 -0.08 -1.42 8.25 0.27 -4.91 115.22 115.97 1sbo n HIS 96 Ca 0.24 0.70 -0.15 0.00 -0.26 0.00 0.00 57.72 58.25 1sbo n HIS 96 Cb 0.84 -4.21 -0.14 0.00 1.12 0.00 0.00 29.99 27.61 1sbo n HIS 96 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 1sbo n LEU 97 N -4.34 1.88 -0.08 2.41 -0.00 0.13 -4.24 117.00 112.76 1sbo n LEU 97 Ca -0.03 0.03 -0.09 0.00 -0.00 0.00 0.00 56.01 55.91 1sbo n LEU 97 Cb 0.57 -0.45 -0.02 0.00 -0.00 0.00 0.00 43.42 43.52 1sbo n LEU 97 CO 0.58 0.74 0.96 -0.78 -0.00 0.00 0.00 177.39 178.90 1sbo h ASP 98 N 0.01 0.35 0.00 1.96 3.58 -1.85 -1.71 116.42 118.76 1sbo h ASP 98 Ca -0.51 -0.06 0.00 0.00 0.42 0.00 0.00 57.03 56.88 1sbo h ASP 98 Cb 2.03 -0.09 0.00 0.00 1.72 0.00 0.00 39.33 42.99 1sbo h ASP 98 CO -0.01 0.30 0.17 0.07 -2.88 0.00 0.00 179.24 176.89 1sbo h LYS 99 N 0.36 0.00 -0.01 0.28 2.10 -1.88 -1.42 116.57 116.01 1sbo h LYS 99 Ca 0.10 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.75 1sbo h LYS 99 Cb 0.02 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.35 1sbo h LYS 99 CO -0.02 0.00 -0.07 0.44 -2.00 0.00 0.00 179.45 177.80 1sbo n ILE 100 N -2.82 0.00 -3.63 0.07 -5.35 -0.87 -4.97 119.36 101.77 1sbo n ILE 100 Ca -0.02 -0.46 -0.04 0.00 -0.27 0.00 0.00 62.75 61.95 1sbo n ILE 100 Cb 0.22 1.13 -0.00 0.00 -1.74 0.00 0.00 39.64 39.24 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 0.08 -1.16 -4.27 4.28 3.01 -0.53 -5.09 117.46 113.77 1sbo n PHE 101 Ca 0.04 -0.38 -0.18 0.00 1.01 0.00 0.00 57.45 57.94 1sbo n PHE 101 Cb 0.18 -0.07 -0.13 0.00 -0.01 0.00 0.00 39.48 39.44 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 -2.36 0.72 -0.10 -1.08 2.20 -1.26 -4.91 119.74 112.96 1sbo s LYS 102 Ca 0.04 -0.56 0.01 0.00 -0.36 0.00 0.00 55.97 55.11 1sbo s LYS 102 Cb -0.00 -0.67 0.02 0.00 -1.51 0.00 0.00 37.83 35.67 1sbo s LYS 102 CO 0.03 0.17 -0.12 0.42 -0.36 0.00 0.00 175.35 175.49 1sbo s ILE 103 N -0.69 1.24 0.47 5.43 1.09 -1.26 -0.70 121.20 126.79 1sbo s ILE 103 Ca -0.00 -0.48 0.06 0.00 -1.10 0.00 0.00 60.65 59.12 1sbo s ILE 103 Cb -0.06 -1.17 -0.01 0.00 -1.06 0.00 0.00 42.46 40.16 1sbo s ILE 103 CO 0.00 0.39 0.29 0.42 -0.10 0.00 0.00 174.94 175.95 1sbo s THR 104 N 1.10 2.04 -0.16 2.92 -4.23 0.50 -4.97 115.64 112.85 1sbo s THR 104 Ca -0.06 -1.57 -0.18 0.00 -1.18 0.00 0.00 61.69 58.70 1sbo s THR 104 Cb -0.14 -2.62 -0.15 0.00 1.34 0.00 0.00 72.50 70.92 1sbo s THR 104 CO -0.02 0.00 0.27 -0.78 -0.54 0.00 0.00 174.62 173.55 1sbo h ASP 105 N 1.09 0.00 -2.11 3.99 3.58 -1.92 -2.34 116.42 118.70 1sbo h ASP 105 Ca -0.40 -0.48 -0.54 0.00 0.42 0.00 0.00 57.03 56.02 1sbo h ASP 105 Cb 1.28 0.00 -0.08 0.00 1.72 0.00 0.00 39.33 42.25 1sbo h ASP 105 CO 0.63 1.08 -0.59 0.42 -2.88 0.00 0.00 179.24 177.91 1sbo s THR 106 N -2.19 3.57 0.49 2.25 -4.23 -1.26 -0.97 115.64 113.30 1sbo s THR 106 Ca -0.20 -1.73 0.34 0.00 -1.18 0.00 0.00 61.69 58.92 1sbo s THR 106 Cb 0.02 -3.01 0.36 0.00 1.34 0.00 0.00 72.50 71.21 1sbo s THR 106 CO 0.47 -0.32 2.19 -0.37 -0.54 0.00 0.00 174.62 176.05 1sbo h VAL 107 N 1.70 0.32 0.00 2.29 -1.51 -1.92 -2.70 116.25 114.43 1sbo h VAL 107 Ca -0.45 -0.26 -0.10 0.00 -1.23 0.00 0.00 66.70 64.66 1sbo h VAL 107 Cb 1.25 1.19 -0.01 0.00 -2.13 0.00 0.00 31.29 31.58 1sbo h VAL 107 CO 0.61 0.04 -0.47 -0.33 -1.23 0.00 0.00 177.57 176.19 1sbo h GLU 108 N 0.00 0.00 -0.01 5.19 5.08 -2.01 -3.11 114.58 119.72 1sbo h GLU 108 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1sbo h GLU 108 Cb 0.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.44 1sbo h GLU 108 CO 0.01 0.47 -0.03 -1.91 -1.00 0.00 0.00 179.01 176.55 1sbo n GLU 109 N -3.54 1.14 0.00 2.33 2.13 -1.02 -5.14 120.64 116.54 1sbo n GLU 109 Ca -0.00 -0.39 0.08 0.00 0.66 0.00 0.00 57.16 57.51 1sbo n GLU 109 Cb 0.58 -1.49 0.07 0.00 0.27 0.00 0.00 31.44 30.86 1sbo n GLU 109 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72