#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bsd n ASN 5 N 0.00 0.00 -4.91 4.38 6.94 -1.26 -4.82 115.26 115.58 1bsd n ASN 5 Ca 0.00 -1.35 -0.30 0.00 -0.02 0.00 0.00 54.58 52.91 1bsd n ASN 5 Cb 0.00 -0.07 -0.04 0.00 -2.36 0.00 0.00 39.78 37.31 1bsd n ASN 5 CO 0.00 0.00 0.00 0.42 -1.03 0.00 0.00 177.26 176.65 1bsd s THR 6 N 0.00 5.21 0.16 5.53 -4.23 -1.26 -0.56 115.64 120.49 1bsd s THR 6 Ca 0.00 -0.18 -0.25 0.00 -1.18 0.00 0.00 61.69 60.09 1bsd s THR 6 Cb 0.00 -3.67 0.04 0.00 1.34 0.00 0.00 72.50 70.21 1bsd s THR 6 CO 0.00 -0.04 1.58 -0.26 -0.54 0.00 0.00 174.62 175.36 1bsd h PHE 7 N 2.51 -1.11 -0.43 3.99 0.04 -1.99 0.35 116.94 120.31 1bsd h PHE 7 Ca -0.47 0.07 -0.07 0.00 2.80 0.00 0.00 57.97 60.31 1bsd h PHE 7 Cb 1.17 0.55 -0.02 0.00 2.20 0.00 0.00 35.95 39.86 1bsd h PHE 7 CO 0.59 -0.41 0.01 -0.44 -0.60 0.00 0.00 178.31 177.45 1bsd h ASP 8 N -0.26 0.74 0.22 2.17 3.32 -1.98 0.27 116.42 120.90 1bsd h ASP 8 Ca 0.17 -0.30 0.01 0.00 0.02 0.00 0.00 57.03 56.93 1bsd h ASP 8 Cb 0.56 -0.20 -0.04 0.00 0.22 0.00 0.00 39.33 39.88 1bsd h ASP 8 CO -0.60 0.86 -0.44 1.23 -1.72 0.00 0.00 179.24 178.57 1bsd h GLY 9 N 0.59 -0.96 0.91 2.75 0.00 -1.84 0.24 103.07 104.76 1bsd h GLY 9 Ca 0.12 0.53 -0.04 0.00 0.00 0.00 0.00 47.33 47.94 1bsd h GLY 9 CO 0.02 -0.29 0.06 -2.08 0.00 0.00 0.00 176.54 174.25 1bsd h VAL 10 N -0.74 1.24 -0.53 4.60 2.07 -0.96 -2.15 116.25 119.78 1bsd h VAL 10 Ca -0.00 -0.83 0.07 0.00 0.82 0.00 0.00 66.70 66.76 1bsd h VAL 10 Cb 0.73 1.12 -0.06 0.00 -1.52 0.00 0.00 31.29 31.56 1bsd h VAL 10 CO -0.20 0.28 0.20 0.00 0.02 0.00 0.00 177.57 177.87 1bsd h ALA 11 N 0.90 0.65 -0.67 1.67 0.00 -0.69 -0.28 119.26 120.84 1bsd h ALA 11 Ca 0.10 0.06 -0.06 0.00 0.00 0.00 0.00 54.91 55.02 1bsd h ALA 11 Cb 0.35 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.14 1bsd h ALA 11 CO 0.01 -0.19 0.18 -0.44 0.00 0.00 0.00 179.25 178.81 1bsd h ASP 12 N 0.39 1.01 -0.60 0.00 3.32 -0.34 -1.15 116.42 119.05 1bsd h ASP 12 Ca 0.25 -0.22 0.02 0.00 0.02 0.00 0.00 57.03 57.10 1bsd h ASP 12 Cb 0.27 -0.26 -0.04 0.00 0.22 0.00 0.00 39.33 39.52 1bsd h ASP 12 CO -0.25 0.97 0.37 0.22 -1.72 0.00 0.00 179.24 178.83 1bsd h TYR 13 N 1.00 0.70 -0.50 4.55 5.03 -0.92 0.20 116.97 127.03 1bsd h TYR 13 Ca 0.21 0.02 -0.06 0.00 2.58 0.00 0.00 58.73 61.48 1bsd h TYR 13 Cb 0.34 -0.23 -0.02 0.00 1.55 0.00 0.00 36.73 38.37 1bsd h TYR 13 CO 0.03 0.41 0.06 -0.07 -1.32 0.00 0.00 178.16 177.26 1bsd h LEU 14 N 0.74 0.81 -1.07 2.82 3.38 -0.92 0.63 115.31 121.71 1bsd h LEU 14 Ca 0.24 -0.27 -0.04 0.00 0.09 0.00 0.00 57.88 57.89 1bsd h LEU 14 Cb -0.00 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.50 1bsd h LEU 14 CO -0.09 0.88 0.21 1.56 0.09 0.00 0.00 178.44 181.09 1bsd h GLN 15 N 0.71 0.88 0.03 1.13 1.08 -0.25 -1.56 115.11 117.13 1bsd h GLN 15 Ca 0.15 -0.15 -0.11 0.00 -1.45 0.00 0.00 58.65 57.09 1bsd h GLN 15 Cb 0.43 -0.15 -0.01 0.00 -0.05 0.00 0.00 27.48 27.70 1bsd h GLN 15 CO 0.01 0.74 -0.57 1.15 -0.95 0.00 0.00 178.83 179.21 1bsd h THR 16 N 0.86 1.45 0.00 -0.54 2.02 -0.28 -3.41 112.91 113.01 1bsd h THR 16 Ca 0.20 -2.33 -0.24 0.00 0.77 0.00 0.00 66.41 64.81 1bsd h THR 16 Cb 0.21 3.00 -0.04 0.00 -1.74 0.00 0.00 68.15 69.57 1bsd h THR 16 CO -0.01 0.55 -1.47 1.88 0.37 0.00 0.00 175.52 176.84 1bsd h TYR 17 N -0.86 0.00 -4.38 3.16 0.05 0.18 -3.49 116.97 111.64 1bsd h TYR 17 Ca -0.14 0.00 -0.23 0.00 0.05 0.00 0.00 58.73 58.41 1bsd h TYR 17 Cb 1.23 0.00 0.11 0.00 1.01 0.00 0.00 36.73 39.08 1bsd h TYR 17 CO 0.21 0.87 -0.50 0.72 -1.05 0.00 0.00 178.16 178.41 1bsd n HIS 18 N -3.06 -1.57 0.00 4.88 8.25 -0.59 -4.98 115.22 118.16 1bsd n HIS 18 Ca -0.12 0.64 0.00 0.00 -0.26 0.00 0.00 57.72 57.98 1bsd n HIS 18 Cb 0.97 -3.97 0.00 0.00 1.12 0.00 0.00 29.99 28.11 1bsd n HIS 18 CO 0.00 0.00 0.00 0.36 0.64 0.00 0.00 176.34 177.34 1bsd n LYS 19 N -3.18 0.00 -2.47 -0.41 2.85 -1.26 -5.07 118.16 108.62 1bsd n LYS 19 Ca -0.14 0.00 -0.36 0.00 -1.05 0.00 0.00 58.31 56.75 1bsd n LYS 19 Cb 0.60 0.00 -0.03 0.00 -0.65 0.00 0.00 35.03 34.94 1bsd n LYS 19 CO 0.00 0.00 0.00 -0.51 -0.05 0.00 0.00 177.40 176.84 1bsd s LEU 20 N 0.00 4.04 1.02 -5.58 1.43 -1.26 -4.10 118.68 114.22 1bsd s LEU 20 Ca 0.00 2.08 -0.11 0.00 -1.03 0.00 0.00 54.13 55.07 1bsd s LEU 20 Cb 0.00 -4.29 0.20 0.00 0.03 0.00 0.00 46.19 42.13 1bsd s LEU 20 CO 0.00 -0.67 1.09 -2.16 0.23 0.00 0.00 176.35 174.84 1bsd s PRO 21 N -2.72 0.22 0.63 1.29 0.04 -1.26 -4.91 135.00 128.29 1bsd s PRO 21 Ca 0.62 1.19 0.35 0.00 0.04 0.00 0.00 61.00 63.20 1bsd s PRO 21 Cb -0.22 -1.66 1.97 0.00 0.04 0.00 0.00 34.50 34.62 1bsd s PRO 21 CO 0.28 -3.06 2.20 -0.44 0.04 0.00 0.00 177.00 176.01 1bsd h ASP 22 N -2.17 0.00 0.08 6.66 3.32 -1.96 -2.98 116.42 119.37 1bsd h ASP 22 Ca -0.51 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.54 1bsd h ASP 22 Cb 1.30 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.85 1bsd h ASP 22 CO 0.46 0.00 0.00 -0.46 -1.72 0.00 0.00 179.24 177.52 1bsd n ASN 23 N -3.41 0.00 -4.87 6.45 6.94 -1.26 -4.86 115.26 114.25 1bsd n ASN 23 Ca -0.01 -0.66 -0.37 0.00 -0.02 0.00 0.00 54.58 53.52 1bsd n ASN 23 Cb 0.20 -0.05 -0.06 0.00 -2.36 0.00 0.00 39.78 37.51 1bsd n ASN 23 CO 0.00 0.00 0.00 -0.31 -1.03 0.00 0.00 177.26 175.92 1bsd s TYR 24 N -2.10 3.63 -0.03 -2.53 2.02 -1.13 -1.74 117.35 115.48 1bsd s TYR 24 Ca 0.35 0.67 -0.03 0.00 -0.37 0.00 0.00 57.07 57.68 1bsd s TYR 24 Cb 0.17 -2.04 0.01 0.00 -0.40 0.00 0.00 41.96 39.69 1bsd s TYR 24 CO 0.30 0.70 0.08 0.96 -1.57 0.00 0.00 175.55 176.02 1bsd s ILE 25 N -1.08 0.01 1.13 2.71 -4.36 -0.47 -4.88 121.20 114.26 1bsd s ILE 25 Ca 0.19 -0.09 -0.13 0.00 -0.26 0.00 0.00 60.65 60.36 1bsd s ILE 25 Cb -0.13 -0.15 0.26 0.00 1.25 0.00 0.00 42.46 43.68 1bsd s ILE 25 CO 0.08 -0.05 1.05 0.42 0.24 0.00 0.00 174.94 176.68 1bsd s THR 26 N -0.13 2.00 0.37 8.37 -4.23 -1.05 -0.91 115.64 120.06 1bsd s THR 26 Ca -0.02 0.00 0.09 0.00 -1.18 0.00 0.00 61.69 60.59 1bsd s THR 26 Cb -0.02 -2.21 0.12 0.00 1.34 0.00 0.00 72.50 71.74 1bsd s THR 26 CO 0.00 -0.00 1.86 0.11 -0.54 0.00 0.00 174.62 176.05 1bsd h LYS 27 N -2.43 0.20 0.05 3.99 1.57 -1.97 -2.24 116.57 115.73 1bsd h LYS 27 Ca -0.60 -0.06 -0.24 0.00 -1.87 0.00 0.00 60.65 57.88 1bsd h LYS 27 Cb 1.34 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 33.63 1bsd h LYS 27 CO 0.53 0.42 -1.05 0.66 -0.57 0.00 0.00 179.45 179.44 1bsd h SER 28 N 0.18 0.48 -0.39 0.86 4.64 -1.98 0.25 113.55 117.58 1bsd h SER 28 Ca 0.03 -0.43 -0.02 0.00 -0.47 0.00 0.00 61.79 60.91 1bsd h SER 28 Cb 0.50 -0.15 -0.02 0.00 -0.31 0.00 0.00 62.40 62.43 1bsd h SER 28 CO 0.03 1.26 0.17 -0.33 -0.87 0.00 0.00 176.83 177.09 1bsd h GLU 29 N 0.16 0.58 -0.56 4.77 5.08 -1.86 0.15 114.58 122.90 1bsd h GLU 29 Ca -0.10 -0.10 -0.06 0.00 -1.00 0.00 0.00 59.36 58.11 1bsd h GLU 29 Cb 1.72 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 30.85 1bsd h GLU 29 CO 0.18 0.54 0.13 0.00 -1.00 0.00 0.00 179.01 178.85 1bsd h ALA 30 N 1.01 0.74 0.17 3.43 0.00 -1.35 -2.64 119.26 120.62 1bsd h ALA 30 Ca 0.13 -0.23 0.01 0.00 0.00 0.00 0.00 54.91 54.83 1bsd h ALA 30 Cb 0.16 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 1bsd h ALA 30 CO -0.01 0.45 -0.32 1.96 0.00 0.00 0.00 179.25 181.33 1bsd h GLN 31 N 0.81 -0.55 -0.93 0.00 4.20 -0.68 0.36 115.11 118.33 1bsd h GLN 31 Ca 0.18 0.04 0.23 0.00 0.06 0.00 0.00 58.65 59.15 1bsd h GLN 31 Cb 0.36 0.12 -0.12 0.00 0.30 0.00 0.00 27.48 28.14 1bsd h GLN 31 CO 0.00 -0.37 0.45 0.00 -0.67 0.00 0.00 178.83 178.25 1bsd h ALA 32 N 0.06 1.54 0.00 3.87 0.00 -0.48 -0.86 119.26 123.38 1bsd h ALA 32 Ca 0.02 0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1bsd h ALA 32 Cb 0.58 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.47 1bsd h ALA 32 CO -0.16 -0.32 0.00 1.28 0.00 0.00 0.00 179.25 180.06 1bsd n LEU 33 N -5.00 0.58 0.00 0.00 4.77 -0.85 -4.88 117.00 111.62 1bsd n LEU 33 Ca 0.23 0.60 0.00 0.00 -0.03 0.00 0.00 56.01 56.82 1bsd n LEU 33 Cb 0.68 -0.48 0.00 0.00 -2.33 0.00 0.00 43.42 41.29 1bsd n LEU 33 CO 0.14 -0.36 0.00 0.61 -1.33 0.00 0.00 177.39 176.45 1bsd n GLY 34 N 0.52 1.45 3.72 -0.72 0.00 -0.33 -4.87 105.19 104.96 1bsd n GLY 34 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 1bsd n GLY 34 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1bsd s TRP 35 N -2.00 3.25 -0.28 1.61 -0.00 0.12 -4.91 118.94 116.74 1bsd s TRP 35 Ca 0.00 1.03 0.01 0.00 -0.00 0.00 0.00 56.10 57.14 1bsd s TRP 35 Cb 0.00 -3.65 0.08 0.00 -0.00 0.00 0.00 33.47 29.89 1bsd s TRP 35 CO 0.00 -2.22 -0.00 0.08 -0.00 0.00 0.00 176.95 174.80 1bsd s VAL 36 N 0.85 1.62 0.29 5.86 1.01 -1.26 -4.36 120.40 124.41 1bsd s VAL 36 Ca 0.62 -1.55 -0.05 0.00 0.00 0.00 0.00 61.98 61.01 1bsd s VAL 36 Cb -0.37 -2.01 0.43 0.00 0.00 0.00 0.00 36.38 34.44 1bsd s VAL 36 CO 0.32 -0.33 1.57 0.00 0.00 0.00 0.00 175.10 176.66 1bsd h ALA 37 N 7.89 0.83 -0.12 5.51 0.00 -2.00 -1.38 119.26 129.99 1bsd h ALA 37 Ca -0.14 0.37 0.03 0.00 0.00 0.00 0.00 54.91 55.17 1bsd h ALA 37 Cb 1.05 0.69 -0.00 0.00 0.00 0.00 0.00 17.79 19.52 1bsd h ALA 37 CO 0.45 -0.45 0.10 0.77 0.00 0.00 0.00 179.25 180.12 1bsd h SER 38 N 0.00 0.00 -0.22 0.00 0.02 -2.03 -2.59 113.55 108.73 1bsd h SER 38 Ca 0.51 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.46 1bsd h SER 38 Cb 0.90 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.44 1bsd h SER 38 CO -0.98 0.00 0.00 0.29 -1.14 0.00 0.00 176.83 175.00 1bsd n LYS 39 N -4.22 2.21 -4.23 3.45 4.76 -0.52 -4.97 118.16 114.63 1bsd n LYS 39 Ca -0.00 -1.80 -0.36 0.00 -2.87 0.00 0.00 58.31 53.28 1bsd n LYS 39 Cb 0.21 -1.47 -0.03 0.00 -1.84 0.00 0.00 35.03 31.90 1bsd n LYS 39 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1bsd n GLY 40 N 1.35 -0.41 1.30 0.72 0.00 -0.98 -4.89 105.19 102.29 1bsd n GLY 40 Ca 0.17 0.13 0.10 0.00 0.00 0.00 0.00 46.02 46.42 1bsd n GLY 40 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1bsd n ASN 41 N -2.68 4.11 -0.23 1.61 6.94 -1.26 -3.97 115.26 119.77 1bsd n ASN 41 Ca 0.03 -2.23 -0.01 0.00 -0.02 0.00 0.00 54.58 52.35 1bsd n ASN 41 Cb 0.51 -0.48 0.06 0.00 -2.36 0.00 0.00 39.78 37.51 1bsd n ASN 41 CO 0.00 0.00 0.00 0.25 -1.03 0.00 0.00 177.26 176.48 1bsd h LEU 42 N 3.71 -0.80 -2.48 -4.53 5.85 -1.89 0.15 115.31 115.31 1bsd h LEU 42 Ca 0.00 0.22 -0.00 0.00 0.84 0.00 0.00 57.88 58.93 1bsd h LEU 42 Cb 1.15 0.48 -0.00 0.00 0.37 0.00 0.00 40.66 42.66 1bsd h LEU 42 CO 0.10 -0.25 -0.02 0.00 -0.34 0.00 0.00 178.44 177.93 1bsd h ALA 43 N 1.51 1.37 0.12 1.25 0.00 -1.84 0.20 119.26 121.87 1bsd h ALA 43 Ca 0.31 -0.02 -0.16 0.00 0.00 0.00 0.00 54.91 55.05 1bsd h ALA 43 Cb 0.53 -0.00 0.02 0.00 0.00 0.00 0.00 17.79 18.33 1bsd h ALA 43 CO -0.72 0.02 -0.70 -0.44 0.00 0.00 0.00 179.25 177.42 1bsd h ASP 44 N 0.00 0.41 0.81 0.00 3.32 -1.05 -3.10 116.42 116.80 1bsd h ASP 44 Ca -0.00 -0.96 0.00 0.00 0.02 0.00 0.00 57.03 56.09 1bsd h ASP 44 Cb 0.06 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 39.48 1bsd h ASP 44 CO 0.00 1.33 -0.79 -0.37 -1.72 0.00 0.00 179.24 177.70 1bsd h VAL 45 N -0.45 0.00 -0.99 -1.35 -1.51 -1.33 -3.41 116.25 107.20 1bsd h VAL 45 Ca -0.12 -0.59 -0.38 0.00 -1.23 0.00 0.00 66.70 64.37 1bsd h VAL 45 Cb 1.55 1.10 -0.27 0.00 -2.13 0.00 0.00 31.29 31.54 1bsd h VAL 45 CO 0.13 0.00 -0.80 0.00 -1.23 0.00 0.00 177.57 175.67 1bsd n ALA 46 N -1.90 0.51 -1.60 5.19 0.00 0.68 -4.86 120.51 118.52 1bsd n ALA 46 Ca 0.02 -2.40 -0.46 0.00 0.00 0.00 0.00 53.44 50.60 1bsd n ALA 46 Cb 0.46 -1.07 -0.03 0.00 0.00 0.00 0.00 19.45 18.81 1bsd n ALA 46 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1bsd n PRO 47 N 1.36 1.38 -0.79 0.00 -0.02 -1.17 -2.21 135.00 133.54 1bsd n PRO 47 Ca 0.15 0.49 0.00 0.00 -2.02 0.00 0.00 63.50 62.12 1bsd n PRO 47 Cb 0.59 -1.95 0.00 0.00 -0.02 0.00 0.00 33.50 32.12 1bsd n PRO 47 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1bsd n GLY 48 N 1.68 1.21 3.89 -1.23 0.00 -1.26 -5.03 105.19 104.45 1bsd n GLY 48 Ca 0.12 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.81 1bsd n GLY 48 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bsd s LYS 49 N -0.08 3.64 0.07 1.61 -0.14 -0.94 -4.84 119.74 119.07 1bsd s LYS 49 Ca 0.00 -0.03 0.07 0.00 -1.36 0.00 0.00 55.97 54.65 1bsd s LYS 49 Cb 0.00 -2.95 -0.03 0.00 -1.68 0.00 0.00 37.83 33.17 1bsd s LYS 49 CO 0.00 0.54 -0.18 -1.12 -0.76 0.00 0.00 175.35 173.83 1bsd s SER 50 N -2.08 2.19 -0.01 2.83 0.01 -0.71 -4.83 113.70 111.11 1bsd s SER 50 Ca 0.35 -0.59 -0.30 0.00 1.31 0.00 0.00 55.95 56.73 1bsd s SER 50 Cb -0.13 -0.13 -0.04 0.00 0.21 0.00 0.00 66.02 65.93 1bsd s SER 50 CO 0.21 0.06 1.11 -0.63 0.41 0.00 0.00 173.24 174.40 1bsd s ILE 51 N -1.02 4.42 -0.10 1.44 -1.09 -1.26 -1.37 121.20 122.20 1bsd s ILE 51 Ca 0.04 1.73 -0.30 0.00 -2.23 0.00 0.00 60.65 59.89 1bsd s ILE 51 Cb -0.09 -4.11 0.10 0.00 -1.58 0.00 0.00 42.46 36.78 1bsd s ILE 51 CO 0.03 0.08 0.86 -0.83 -1.23 0.00 0.00 174.94 173.85 1bsd s GLY 52 N 1.16 -0.41 0.00 6.18 0.00 -0.08 -1.27 107.32 112.89 1bsd s GLY 52 Ca 0.55 1.66 0.00 0.00 0.00 0.00 0.00 44.72 46.93 1bsd s GLY 52 CO 0.26 0.94 0.00 0.61 0.00 0.00 0.00 173.10 174.91 1bsd n GLY 53 N 0.72 0.76 3.87 0.20 0.00 0.88 -2.54 105.19 109.07 1bsd n GLY 53 Ca -0.14 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.58 1bsd n GLY 53 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1bsd s ASP 54 N -2.48 6.47 0.14 1.61 1.01 -1.24 -4.81 116.67 117.37 1bsd s ASP 54 Ca 0.00 1.27 -0.31 0.00 0.71 0.00 0.00 52.55 54.23 1bsd s ASP 54 Cb 0.00 -2.39 -0.08 0.00 1.01 0.00 0.00 42.92 41.46 1bsd s ASP 54 CO 0.00 -0.55 1.37 -0.63 0.21 0.00 0.00 175.17 175.57 1bsd s ILE 55 N -2.62 3.28 -0.22 0.77 -1.09 -1.26 -1.53 121.20 118.53 1bsd s ILE 55 Ca 0.53 0.96 -0.10 0.00 -2.23 0.00 0.00 60.65 59.81 1bsd s ILE 55 Cb -0.10 -3.61 -0.05 0.00 -1.58 0.00 0.00 42.46 37.12 1bsd s ILE 55 CO 0.37 0.09 0.15 0.12 -1.23 0.00 0.00 174.94 174.44 1bsd s PHE 56 N 0.82 3.35 0.04 3.97 5.36 0.11 -4.84 117.98 126.79 1bsd s PHE 56 Ca 0.62 0.26 -0.28 0.00 -0.96 0.00 0.00 56.93 56.58 1bsd s PHE 56 Cb -0.37 -2.22 -0.17 0.00 -0.34 0.00 0.00 43.02 39.92 1bsd s PHE 56 CO 0.32 0.16 1.45 0.77 -1.46 0.00 0.00 175.22 176.46 1bsd h SER 57 N 7.16 -0.45 -2.78 6.13 0.02 -1.96 -3.38 113.55 118.30 1bsd h SER 57 Ca -0.39 -0.07 -0.15 0.00 -0.84 0.00 0.00 61.79 60.33 1bsd h SER 57 Cb 1.16 0.12 0.05 0.00 0.14 0.00 0.00 62.40 63.87 1bsd h SER 57 CO 0.70 -0.19 -0.25 -3.20 -1.14 0.00 0.00 176.83 172.74 1bsd n ASN 58 N -5.25 -3.64 -0.11 3.07 5.15 -1.26 -4.95 115.26 108.26 1bsd n ASN 58 Ca -0.11 -0.20 -0.10 0.00 -0.60 0.00 0.00 54.58 53.58 1bsd n ASN 58 Cb 0.27 -2.21 -0.02 0.00 -0.53 0.00 0.00 39.78 37.28 1bsd n ASN 58 CO 0.00 0.00 0.00 0.03 1.40 0.00 0.00 177.26 178.69 1bsd h ARG 59 N -0.99 0.55 0.00 1.20 -0.00 -1.99 -3.01 114.38 110.14 1bsd h ARG 59 Ca -0.21 -0.14 0.00 0.00 -0.50 0.00 0.00 59.98 59.13 1bsd h ARG 59 Cb 1.14 -0.07 0.00 0.00 0.00 0.00 0.00 29.97 31.04 1bsd h ARG 59 CO 0.21 0.61 0.00 0.39 0.00 0.00 0.00 179.97 181.18 1bsd n GLU 60 N -4.62 0.84 -1.25 0.04 1.02 -1.26 -4.93 120.64 110.49 1bsd n GLU 60 Ca -0.02 0.00 -0.09 0.00 -0.02 0.00 0.00 57.16 57.04 1bsd n GLU 60 Cb 0.20 -1.50 -0.04 0.00 -0.02 0.00 0.00 31.44 30.09 1bsd n GLU 60 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1bsd n GLY 61 N 1.00 0.98 0.23 0.62 0.00 -1.14 -4.91 105.19 101.98 1bsd n GLY 61 Ca 0.21 -0.31 0.08 0.00 0.00 0.00 0.00 46.02 46.00 1bsd n GLY 61 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1bsd h LYS 62 N 0.13 0.00 -6.02 1.61 1.57 -1.92 -3.42 116.57 108.52 1bsd h LYS 62 Ca -0.17 0.00 -0.66 0.00 -1.87 0.00 0.00 60.65 57.94 1bsd h LYS 62 Cb 0.74 0.00 -0.12 0.00 0.08 0.00 0.00 32.23 32.93 1bsd h LYS 62 CO 0.26 0.23 -0.60 -0.51 -0.57 0.00 0.00 179.45 178.25 1bsd s LEU 63 N -7.68 3.75 -0.46 2.94 1.43 -1.26 -4.93 118.68 112.47 1bsd s LEU 63 Ca -0.03 0.12 -0.43 0.00 -1.03 0.00 0.00 54.13 52.77 1bsd s LEU 63 Cb 0.13 -2.09 -0.18 0.00 0.03 0.00 0.00 46.19 44.09 1bsd s LEU 63 CO 0.65 0.31 2.04 -2.65 0.23 0.00 0.00 176.35 176.92 1bsd n PRO 64 N 1.50 0.27 -3.53 1.29 -0.02 -1.26 -4.96 135.00 128.29 1bsd n PRO 64 Ca -0.15 0.08 -0.22 0.00 -2.02 0.00 0.00 63.50 61.19 1bsd n PRO 64 Cb 0.53 -1.71 -0.01 0.00 -0.02 0.00 0.00 33.50 32.29 1bsd n PRO 64 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1bsd s GLY 65 N 5.59 1.39 -0.16 -1.23 0.00 -1.26 -5.09 107.32 106.56 1bsd s GLY 65 Ca 1.14 -1.15 -0.31 0.00 0.00 0.00 0.00 44.72 44.40 1bsd s GLY 65 CO 0.66 -1.10 1.09 1.25 0.00 0.00 0.00 173.10 175.00 1bsd s LYS 66 N -4.22 0.47 0.31 2.90 2.20 -1.26 -5.07 119.74 115.08 1bsd s LYS 66 Ca 0.40 -0.04 -0.29 0.00 -0.36 0.00 0.00 55.97 55.68 1bsd s LYS 66 Cb -0.09 0.22 -0.10 0.00 -1.51 0.00 0.00 37.83 36.35 1bsd s LYS 66 CO 0.33 -0.18 1.21 0.45 -0.36 0.00 0.00 175.35 176.80 1bsd s SER 67 N -1.70 6.99 0.00 1.43 0.15 -1.26 -2.38 113.70 116.93 1bsd s SER 67 Ca 0.05 2.50 0.00 0.00 0.70 0.00 0.00 55.95 59.19 1bsd s SER 67 Cb -0.01 -2.64 0.00 0.00 -1.71 0.00 0.00 66.02 61.66 1bsd s SER 67 CO -0.04 -0.36 0.00 0.61 1.20 0.00 0.00 173.24 174.65 1bsd n GLY 68 N 0.97 2.57 3.73 9.45 0.00 -1.26 -5.00 105.19 115.64 1bsd n GLY 68 Ca -0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 1bsd n GLY 68 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1bsd s ARG 69 N -0.01 4.46 0.10 1.61 3.52 -1.00 -4.95 118.95 122.68 1bsd s ARG 69 Ca 0.00 1.00 0.08 0.00 -0.13 0.00 0.00 55.73 56.68 1bsd s ARG 69 Cb 0.00 -3.40 -0.03 0.00 -1.56 0.00 0.00 34.95 29.96 1bsd s ARG 69 CO 0.00 0.18 -0.21 0.95 -0.81 0.00 0.00 175.30 175.42 1bsd s THR 70 N 0.33 1.70 -0.08 4.11 -4.23 -1.26 -4.75 115.64 111.46 1bsd s THR 70 Ca 0.39 -1.53 0.01 0.00 -1.18 0.00 0.00 61.69 59.38 1bsd s THR 70 Cb -0.19 -1.54 -0.03 0.00 1.34 0.00 0.00 72.50 72.08 1bsd s THR 70 CO 0.21 -0.06 -0.10 0.26 -0.54 0.00 0.00 174.62 174.40 1bsd s TRP 71 N -1.15 2.85 0.19 3.99 0.52 -1.26 -0.21 118.94 123.87 1bsd s TRP 71 Ca 0.06 -0.15 0.08 0.00 0.02 0.00 0.00 56.10 56.11 1bsd s TRP 71 Cb -0.10 -1.72 -0.04 0.00 -1.15 0.00 0.00 33.47 30.45 1bsd s TRP 71 CO 0.04 0.18 -0.16 1.03 0.02 0.00 0.00 176.95 178.07 1bsd s ARG 72 N -0.53 1.30 0.26 4.98 0.52 0.30 0.03 118.95 125.81 1bsd s ARG 72 Ca 0.08 -1.51 0.06 0.00 -0.52 0.00 0.00 55.73 53.83 1bsd s ARG 72 Cb -0.12 -1.20 -0.06 0.00 0.52 0.00 0.00 34.95 34.10 1bsd s ARG 72 CO 0.02 0.22 -0.05 -1.83 0.02 0.00 0.00 175.30 173.68 1bsd s GLU 73 N -3.29 1.47 -0.20 3.54 -1.05 -0.58 -0.87 118.70 117.71 1bsd s GLU 73 Ca 0.20 -1.74 -0.20 0.00 -0.15 0.00 0.00 54.97 53.08 1bsd s GLU 73 Cb -0.03 -0.99 0.05 0.00 -0.44 0.00 0.00 34.13 32.73 1bsd s GLU 73 CO 0.07 0.01 0.56 0.00 0.95 0.00 0.00 175.26 176.85 1bsd s ALA 74 N -3.13 -1.39 0.03 -0.84 0.00 -0.88 -0.08 121.76 115.47 1bsd s ALA 74 Ca 0.29 1.56 -0.30 0.00 0.00 0.00 0.00 51.96 53.51 1bsd s ALA 74 Cb 0.04 -0.89 -0.05 0.00 0.00 0.00 0.00 23.12 22.22 1bsd s ALA 74 CO 0.10 -0.27 1.25 -0.51 0.00 0.00 0.00 175.76 176.34 1bsd s ASP 75 N 0.24 7.01 -0.04 0.00 1.11 -0.40 -0.14 116.67 124.45 1bsd s ASP 75 Ca -0.00 2.02 0.03 0.00 0.18 0.00 0.00 52.55 54.78 1bsd s ASP 75 Cb -0.04 -2.57 -0.03 0.00 1.07 0.00 0.00 42.92 41.35 1bsd s ASP 75 CO 0.01 -0.55 -0.13 -0.63 1.18 0.00 0.00 175.17 175.05 1bsd s ILE 76 N 1.51 3.16 -1.46 0.77 -1.09 -0.71 -4.63 121.20 118.75 1bsd s ILE 76 Ca 0.60 -0.72 0.00 0.00 -2.23 0.00 0.00 60.65 58.29 1bsd s ILE 76 Cb -0.30 -2.26 0.00 0.00 -1.58 0.00 0.00 42.46 38.32 1bsd s ILE 76 CO 0.27 0.57 0.00 0.59 -1.23 0.00 0.00 174.94 175.14 1bsd n ASN 77 N 2.20 -4.77 -4.76 3.58 3.02 0.28 -4.41 115.26 110.40 1bsd n ASN 77 Ca -0.17 0.13 -0.40 0.00 -0.03 0.00 0.00 54.58 54.11 1bsd n ASN 77 Cb 0.52 -3.81 -0.05 0.00 -0.61 0.00 0.00 39.78 35.83 1bsd n ASN 77 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1bsd s TYR 78 N -2.71 3.81 0.00 3.10 5.04 -1.26 -4.95 117.35 120.38 1bsd s TYR 78 Ca 0.00 1.53 0.00 0.00 -2.44 0.00 0.00 57.07 56.16 1bsd s TYR 78 Cb 0.00 -2.79 0.00 0.00 0.35 0.00 0.00 41.96 39.52 1bsd s TYR 78 CO 0.00 0.39 0.00 0.25 -1.34 0.00 0.00 175.55 174.85 1bsd n THR 79 N 2.27 0.00 -3.48 4.34 -2.24 -1.26 -4.92 114.28 108.98 1bsd n THR 79 Ca -0.04 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 61.64 1bsd n THR 79 Cb 0.50 -1.14 -0.02 0.00 -2.10 0.00 0.00 70.33 67.57 1bsd n THR 79 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1bsd s SER 80 N -4.97 -0.43 0.00 3.42 1.04 -1.26 -4.74 113.70 106.75 1bsd s SER 80 Ca 0.00 0.02 0.00 0.00 0.48 0.00 0.00 55.95 56.45 1bsd s SER 80 Cb 0.00 0.45 0.00 0.00 0.10 0.00 0.00 66.02 66.57 1bsd s SER 80 CO 0.00 -0.72 0.00 0.61 0.98 0.00 0.00 173.24 174.11 1bsd n GLY 81 N -0.25 -1.81 3.73 7.32 0.00 -1.25 -4.94 105.19 107.99 1bsd n GLY 81 Ca -0.11 -1.88 -0.31 0.00 0.00 0.00 0.00 46.02 43.72 1bsd n GLY 81 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1bsd s PHE 82 N 0.00 2.26 0.45 1.61 0.08 -1.26 -4.53 117.98 116.59 1bsd s PHE 82 Ca 0.00 1.55 -0.23 0.00 0.12 0.00 0.00 56.93 58.37 1bsd s PHE 82 Cb 0.00 -3.14 -0.08 0.00 -0.57 0.00 0.00 43.02 39.24 1bsd s PHE 82 CO 0.00 -2.22 1.17 1.03 -0.10 0.00 0.00 175.22 175.10 1bsd s ARG 83 N -4.83 3.81 0.00 0.44 0.52 -1.26 -5.00 118.95 112.62 1bsd s ARG 83 Ca 0.63 1.79 0.00 0.00 -0.52 0.00 0.00 55.73 57.63 1bsd s ARG 83 Cb -0.19 -2.45 0.00 0.00 0.52 0.00 0.00 34.95 32.83 1bsd s ARG 83 CO 0.57 -0.52 0.00 0.27 0.02 0.00 0.00 175.30 175.64 1bsd n ASN 84 N -0.40 0.00 -0.36 0.23 0.23 -1.26 -5.04 115.26 108.66 1bsd n ASN 84 Ca 0.07 0.00 0.06 0.00 -0.53 0.00 0.00 54.58 54.18 1bsd n ASN 84 Cb 0.48 0.00 0.02 0.00 -2.08 0.00 0.00 39.78 38.20 1bsd n ASN 84 CO 0.00 0.00 0.00 -1.20 -0.93 0.00 0.00 177.26 175.13 1bsd n SER 85 N 0.00 1.63 -4.75 0.53 7.64 -1.26 -4.97 113.62 112.44 1bsd n SER 85 Ca 0.00 -1.32 -0.39 0.00 1.01 0.00 0.00 58.87 58.18 1bsd n SER 85 Cb 0.00 0.26 -0.05 0.00 -1.01 0.00 0.00 64.21 63.40 1bsd n SER 85 CO 0.00 0.00 0.00 -1.81 -3.01 0.00 0.00 175.04 170.22 1bsd s ASP 86 N -1.28 6.96 0.01 6.43 1.01 -1.26 -2.21 116.67 126.34 1bsd s ASP 86 Ca 0.12 1.15 -0.04 0.00 0.71 0.00 0.00 52.55 54.49 1bsd s ASP 86 Cb 0.10 -2.37 -0.01 0.00 1.01 0.00 0.00 42.92 41.65 1bsd s ASP 86 CO 0.23 0.05 0.06 -0.13 0.21 0.00 0.00 175.17 175.59 1bsd s ARG 87 N 0.07 0.40 -0.05 8.23 1.81 -0.40 -1.74 118.95 127.27 1bsd s ARG 87 Ca 0.32 -0.48 0.03 0.00 -1.72 0.00 0.00 55.73 53.88 1bsd s ARG 87 Cb -0.18 0.16 -0.03 0.00 -0.45 0.00 0.00 34.95 34.45 1bsd s ARG 87 CO 0.17 -0.08 -0.11 -1.50 -0.68 0.00 0.00 175.30 173.10 1bsd s ILE 88 N -1.38 3.37 -0.12 1.52 2.07 0.80 -2.37 121.20 125.10 1bsd s ILE 88 Ca -0.15 -0.66 0.03 0.00 -1.41 0.00 0.00 60.65 58.46 1bsd s ILE 88 Cb -0.08 -2.37 0.01 0.00 0.13 0.00 0.00 42.46 40.15 1bsd s ILE 88 CO 0.00 0.56 -0.20 -0.76 -1.91 0.00 0.00 174.94 172.64 1bsd s LEU 89 N -0.89 1.95 0.00 8.50 2.01 0.02 -2.07 118.68 128.21 1bsd s LEU 89 Ca 0.13 -0.52 0.03 0.00 0.01 0.00 0.00 54.13 53.78 1bsd s LEU 89 Cb -0.11 -1.28 -0.01 0.00 0.01 0.00 0.00 46.19 44.80 1bsd s LEU 89 CO 0.02 0.07 -0.09 -0.72 1.01 0.00 0.00 176.35 176.65 1bsd s TYR 90 N 0.77 0.76 0.15 0.29 1.13 -0.05 0.46 117.35 120.86 1bsd s TYR 90 Ca -0.10 -0.19 0.03 0.00 -1.41 0.00 0.00 57.07 55.40 1bsd s TYR 90 Cb -0.16 -0.48 -0.04 0.00 -1.10 0.00 0.00 41.96 40.18 1bsd s TYR 90 CO 0.01 -0.01 0.26 -1.54 -2.51 0.00 0.00 175.55 171.76 1bsd s SER 91 N -0.40 6.22 0.66 -0.18 1.04 -1.03 0.11 113.70 120.12 1bsd s SER 91 Ca 0.02 0.13 0.40 0.00 0.48 0.00 0.00 55.95 56.98 1bsd s SER 91 Cb -0.04 -1.84 2.24 0.00 0.10 0.00 0.00 66.02 66.47 1bsd s SER 91 CO -0.00 0.05 2.30 0.77 0.98 0.00 0.00 173.24 177.34 1bsd h SER 92 N 2.17 0.00 -0.29 7.02 4.64 -0.94 0.30 113.55 126.45 1bsd h SER 92 Ca -0.48 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 60.78 1bsd h SER 92 Cb 1.20 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.25 1bsd h SER 92 CO 0.68 0.00 -0.00 -0.90 -0.87 0.00 0.00 176.83 175.74 1bsd n ASP 93 N -3.19 3.53 -1.76 4.97 5.75 -1.26 -4.98 116.55 119.61 1bsd n ASP 93 Ca -0.03 -3.20 -0.14 0.00 -0.01 0.00 0.00 54.79 51.41 1bsd n ASP 93 Cb 0.12 -0.57 0.01 0.00 -1.03 0.00 0.00 41.12 39.65 1bsd n ASP 93 CO 0.00 0.00 0.00 0.79 -0.11 0.00 0.00 177.20 177.88 1bsd n TRP 94 N -0.69 -0.91 -2.29 2.11 7.02 0.11 -5.04 117.44 117.75 1bsd n TRP 94 Ca 0.25 0.14 -0.32 0.00 -1.02 0.00 0.00 57.50 56.55 1bsd n TRP 94 Cb 0.94 -3.09 -0.02 0.00 -2.42 0.00 0.00 31.31 26.71 1bsd n TRP 94 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 1bsd s LEU 95 N -4.18 3.53 -0.05 -0.99 1.43 -1.26 -4.87 118.68 112.30 1bsd s LEU 95 Ca 0.08 1.48 -0.02 0.00 -1.03 0.00 0.00 54.13 54.65 1bsd s LEU 95 Cb -0.04 -4.45 0.04 0.00 0.03 0.00 0.00 46.19 41.77 1bsd s LEU 95 CO 0.10 -0.65 0.10 0.54 0.23 0.00 0.00 176.35 176.67 1bsd s VAL 96 N -2.76 -0.05 0.27 -1.59 0.11 -0.61 -2.45 120.40 113.31 1bsd s VAL 96 Ca 0.57 0.20 0.06 0.00 -2.93 0.00 0.00 61.98 59.87 1bsd s VAL 96 Cb -0.10 -0.18 -0.06 0.00 -1.53 0.00 0.00 36.38 34.51 1bsd s VAL 96 CO 0.38 0.08 -0.04 -0.31 -3.33 0.00 0.00 175.10 171.88 1bsd s TYR 97 N 1.14 1.86 0.01 1.54 1.51 0.17 -0.53 117.35 123.05 1bsd s TYR 97 Ca -0.09 -0.75 -0.03 0.00 -1.01 0.00 0.00 57.07 55.19 1bsd s TYR 97 Cb -0.12 -1.07 -0.01 0.00 -0.11 0.00 0.00 41.96 40.65 1bsd s TYR 97 CO -0.05 0.20 0.04 -1.59 -1.11 0.00 0.00 175.55 173.04 1bsd s LYS 98 N -3.76 0.33 0.01 -0.62 0.00 -0.32 -0.80 119.74 114.58 1bsd s LYS 98 Ca 0.29 -0.42 0.00 0.00 0.00 0.00 0.00 55.97 55.84 1bsd s LYS 98 Cb 0.04 0.13 -0.01 0.00 0.00 0.00 0.00 37.83 37.99 1bsd s LYS 98 CO 0.11 -0.06 -0.01 -0.08 0.00 0.00 0.00 175.35 175.30 1bsd s THR 99 N -1.18 0.05 -0.06 3.79 -1.32 -1.00 -0.45 115.64 115.47 1bsd s THR 99 Ca -0.13 -0.36 0.08 0.00 -1.21 0.00 0.00 61.69 60.07 1bsd s THR 99 Cb -0.08 -0.11 0.13 0.00 -1.51 0.00 0.00 72.50 70.93 1bsd s THR 99 CO 0.00 -0.19 1.04 0.35 -2.21 0.00 0.00 174.62 173.61 1bsd n THR 100 N 2.50 0.86 -2.48 5.08 -2.24 -1.26 -1.27 114.28 115.47 1bsd n THR 100 Ca -0.17 -1.03 0.00 0.00 -2.27 0.00 0.00 64.05 60.59 1bsd n THR 100 Cb 0.58 0.20 0.05 0.00 -2.10 0.00 0.00 70.33 69.06 1bsd n THR 100 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 1bsd n ASP 101 N -0.65 1.62 -3.35 3.42 5.68 -1.19 -4.69 116.55 117.40 1bsd n ASP 101 Ca 0.07 -2.37 -0.16 0.00 -0.50 0.00 0.00 54.79 51.83 1bsd n ASP 101 Cb 0.65 -0.39 0.08 0.00 -1.14 0.00 0.00 41.12 40.32 1bsd n ASP 101 CO 0.00 0.00 0.00 1.57 -1.33 0.00 0.00 177.20 177.44 1bsd n HIS 102 N -0.17 -2.27 -2.01 2.11 -0.00 -0.94 -3.18 115.22 108.75 1bsd n HIS 102 Ca 0.11 0.91 -0.20 0.00 -0.00 0.00 0.00 57.72 58.53 1bsd n HIS 102 Cb 0.96 -4.75 -0.05 0.00 -0.00 0.00 0.00 29.99 26.16 1bsd n HIS 102 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.34 177.00 1bsd n TYR 103 N -3.81 -0.55 -0.02 1.57 4.02 -1.26 -4.89 117.16 112.22 1bsd n TYR 103 Ca -0.21 0.00 -0.16 0.00 -0.01 0.00 0.00 57.90 57.52 1bsd n TYR 103 Cb 0.65 -3.67 -0.11 0.00 -0.02 0.00 0.00 39.34 36.19 1bsd n TYR 103 CO 0.00 0.00 0.00 1.96 -1.01 0.00 0.00 176.86 177.81 1bsd h GLN 104 N 0.00 0.25 -4.47 -0.72 1.08 -1.96 -3.47 115.11 105.82 1bsd h GLN 104 Ca -0.45 -0.25 -0.22 0.00 -1.45 0.00 0.00 58.65 56.27 1bsd h GLN 104 Cb 1.34 0.07 -0.18 0.00 -0.05 0.00 0.00 27.48 28.66 1bsd h GLN 104 CO 0.59 0.96 -0.71 0.95 -0.95 0.00 0.00 178.83 179.67 1bsd s THR 105 N -3.25 0.49 0.10 -0.54 -4.23 -1.26 -5.10 115.64 101.86 1bsd s THR 105 Ca -0.15 -1.43 0.05 0.00 -1.18 0.00 0.00 61.69 58.98 1bsd s THR 105 Cb 0.02 -1.03 -0.04 0.00 1.34 0.00 0.00 72.50 72.80 1bsd s THR 105 CO 0.76 -0.64 -0.12 -0.36 -0.54 0.00 0.00 174.62 173.73 1bsd s PHE 106 N -2.45 1.20 -0.08 3.99 0.08 -1.26 -4.31 117.98 115.15 1bsd s PHE 106 Ca -0.02 -0.59 0.01 0.00 0.12 0.00 0.00 56.93 56.45 1bsd s PHE 106 Cb -0.03 -0.65 0.02 0.00 -0.57 0.00 0.00 43.02 41.80 1bsd s PHE 106 CO -0.03 0.06 -0.08 0.99 -0.10 0.00 0.00 175.22 176.06 1bsd s THR 107 N -2.15 0.95 0.22 0.64 2.01 0.40 -4.94 115.64 112.77 1bsd s THR 107 Ca 0.05 -0.31 -0.30 0.00 0.31 0.00 0.00 61.69 61.44 1bsd s THR 107 Cb -0.05 -0.94 -0.09 0.00 0.01 0.00 0.00 72.50 71.43 1bsd s THR 107 CO 0.01 0.34 1.36 -0.75 -0.69 0.00 0.00 174.62 174.89 1bsd s LYS 108 N 1.22 4.34 0.00 4.92 2.20 -1.26 -1.17 119.74 129.98 1bsd s LYS 108 Ca -0.05 2.15 0.00 0.00 -0.36 0.00 0.00 55.97 57.71 1bsd s LYS 108 Cb -0.14 -3.16 0.00 0.00 -1.51 0.00 0.00 37.83 33.02 1bsd s LYS 108 CO -0.02 -0.32 0.00 0.44 -0.36 0.00 0.00 175.35 175.09 1bsd n ILE 109 N 2.51 0.00 -1.70 5.43 -5.35 0.30 -4.92 119.36 115.63 1bsd n ILE 109 Ca 0.06 -0.34 0.00 0.00 -0.27 0.00 0.00 62.75 62.21 1bsd n ILE 109 Cb 0.42 0.90 0.00 0.00 -1.74 0.00 0.00 39.64 39.22 1bsd n ILE 109 CO 0.00 0.00 0.00 0.54 -1.76 0.00 0.00 176.55 175.33