#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bcg s LYS 1 N 0.00 2.77 0.23 2.12 1.02 -1.26 -3.21 119.74 121.40 1bcg s LYS 1 Ca 0.00 -1.29 -0.09 0.00 0.02 0.00 0.00 55.97 54.61 1bcg s LYS 1 Cb 0.00 -2.73 -0.02 0.00 -0.52 0.00 0.00 37.83 34.56 1bcg s LYS 1 CO 0.00 -0.32 0.36 -1.59 -0.92 0.00 0.00 175.35 172.88 1bcg s LYS 2 N -4.37 1.41 0.18 1.68 -2.85 0.70 -4.88 119.74 111.61 1bcg s LYS 2 Ca 0.55 -1.36 0.10 0.00 -1.00 0.00 0.00 55.97 54.26 1bcg s LYS 2 Cb -0.09 0.40 -0.04 0.00 -2.06 0.00 0.00 37.83 36.04 1bcg s LYS 2 CO 0.33 -0.55 -0.16 -0.80 0.10 0.00 0.00 175.35 174.27 1bcg s ASN 3 N -3.06 3.87 0.00 0.03 0.01 -1.26 0.34 114.94 114.88 1bcg s ASN 3 Ca 0.27 -0.69 0.00 0.00 -0.71 0.00 0.00 52.86 51.73 1bcg s ASN 3 Cb 0.02 -0.51 0.00 0.00 0.41 0.00 0.00 41.25 41.17 1bcg s ASN 3 CO 0.09 0.12 0.00 0.61 -1.51 0.00 0.00 177.10 176.41 1bcg n GLY 4 N 0.22 -2.70 3.48 0.66 0.00 -0.62 -5.00 105.19 101.22 1bcg n GLY 4 Ca -0.12 -1.31 -0.43 0.00 0.00 0.00 0.00 46.02 44.16 1bcg n GLY 4 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1bcg s TYR 5 N -2.14 2.86 0.37 1.61 2.02 -1.26 -1.21 117.35 119.60 1bcg s TYR 5 Ca 0.00 -0.34 -0.28 0.00 -0.37 0.00 0.00 57.07 56.08 1bcg s TYR 5 Cb 0.00 -3.95 -0.10 0.00 -0.40 0.00 0.00 41.96 37.51 1bcg s TYR 5 CO 0.00 -1.31 1.35 -1.25 -1.57 0.00 0.00 175.55 172.76 1bcg s PRO 6 N 3.50 4.15 -0.00 -1.71 0.04 -1.26 0.09 135.00 139.80 1bcg s PRO 6 Ca 0.23 2.28 -0.03 0.00 0.04 0.00 0.00 61.00 63.52 1bcg s PRO 6 Cb -0.16 -2.93 -0.04 0.00 0.04 0.00 0.00 34.50 31.41 1bcg s PRO 6 CO 0.14 -0.39 0.20 -0.51 0.04 0.00 0.00 177.00 176.49 1bcg s LEU 7 N -2.11 4.37 0.00 -3.56 1.43 -0.68 -4.28 118.68 113.84 1bcg s LEU 7 Ca 0.53 0.39 -0.00 0.00 -1.03 0.00 0.00 54.13 54.01 1bcg s LEU 7 Cb -0.41 -2.64 0.03 0.00 0.03 0.00 0.00 46.19 43.20 1bcg s LEU 7 CO 0.54 0.26 0.20 -0.90 0.23 0.00 0.00 176.35 176.67 1bcg n ASP 8 N 0.95 0.24 0.33 2.29 5.68 0.09 -4.87 116.55 121.26 1bcg n ASP 8 Ca -0.11 -1.21 0.22 0.00 -0.50 0.00 0.00 54.79 53.19 1bcg n ASP 8 Cb 0.53 -0.13 1.16 0.00 -1.14 0.00 0.00 41.12 41.54 1bcg n ASP 8 CO 0.00 0.00 0.00 0.08 -1.33 0.00 0.00 177.20 175.95 1bcg h ARG 9 N 0.00 0.00 -0.26 0.11 0.11 -2.00 -0.16 114.38 112.18 1bcg h ARG 9 Ca -0.07 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.01 1bcg h ARG 9 Cb 0.23 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.31 1bcg h ARG 9 CO 0.07 0.00 0.00 0.09 0.10 0.00 0.00 179.97 180.23 1bcg n ASN 10 N -3.20 2.53 -0.48 0.08 3.02 -1.26 -4.92 115.26 111.02 1bcg n ASN 10 Ca -0.03 -1.85 -0.05 0.00 -0.03 0.00 0.00 54.58 52.62 1bcg n ASN 10 Cb 0.08 -0.17 -0.01 0.00 -0.61 0.00 0.00 39.78 39.07 1bcg n ASN 10 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1bcg n GLY 11 N 1.31 0.45 3.42 7.41 0.00 -0.07 -5.04 105.19 112.67 1bcg n GLY 11 Ca 0.17 -0.75 -0.24 0.00 0.00 0.00 0.00 46.02 45.21 1bcg n GLY 11 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1bcg s LYS 12 N -3.39 1.52 0.75 1.61 1.02 -1.26 -4.82 119.74 115.18 1bcg s LYS 12 Ca 0.00 -1.63 -0.11 0.00 0.02 0.00 0.00 55.97 54.25 1bcg s LYS 12 Cb 0.00 -1.63 0.05 0.00 -0.52 0.00 0.00 37.83 35.73 1bcg s LYS 12 CO 0.00 0.32 1.12 0.95 -0.92 0.00 0.00 175.35 176.82 1bcg s THR 13 N -2.29 2.73 -0.41 2.17 -4.23 -1.26 -0.73 115.64 111.61 1bcg s THR 13 Ca 0.24 0.19 -0.19 0.00 -1.18 0.00 0.00 61.69 60.75 1bcg s THR 13 Cb -0.05 -3.23 0.02 0.00 1.34 0.00 0.00 72.50 70.58 1bcg s THR 13 CO 0.11 -0.29 0.58 -0.89 -0.54 0.00 0.00 174.62 173.59 1bcg s THR 14 N -3.44 4.92 0.53 3.99 2.01 -1.26 -4.89 115.64 117.50 1bcg s THR 14 Ca 0.60 0.09 -0.20 0.00 0.31 0.00 0.00 61.69 62.49 1bcg s THR 14 Cb -0.11 -4.12 -0.06 0.00 0.01 0.00 0.00 72.50 68.22 1bcg s THR 14 CO 0.50 -0.47 1.15 -1.61 -0.69 0.00 0.00 174.62 173.49 1bcg s GLU 15 N 2.59 3.40 -0.12 4.92 2.02 -1.26 -0.64 118.70 129.61 1bcg s GLU 15 Ca 0.20 1.68 -0.06 0.00 0.02 0.00 0.00 54.97 56.81 1bcg s GLU 15 Cb -0.15 -2.09 0.06 0.00 0.10 0.00 0.00 34.13 32.05 1bcg s GLU 15 CO 0.17 -0.82 0.28 0.00 0.02 0.00 0.00 175.26 174.90 1bcg s SER 17 N 1.74 0.40 1.50 0.00 1.04 -1.26 -4.26 113.70 112.85 1bcg s SER 17 Ca -0.05 -1.23 0.00 0.00 0.48 0.00 0.00 55.95 55.14 1bcg s SER 17 Cb -0.11 0.64 0.00 0.00 0.10 0.00 0.00 66.02 66.65 1bcg s SER 17 CO -0.09 -1.26 0.00 0.61 0.98 0.00 0.00 173.24 173.48 1bcg n GLY 18 N -0.48 2.96 0.26 7.32 0.00 -1.26 -1.84 105.19 112.16 1bcg n GLY 18 Ca -0.01 -0.28 0.12 0.00 0.00 0.00 0.00 46.02 45.86 1bcg n GLY 18 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1bcg h VAL 19 N 0.00 0.60 -0.01 1.61 3.04 -1.99 -1.51 116.25 117.99 1bcg h VAL 19 Ca 0.00 -0.50 0.00 0.00 -1.01 0.00 0.00 66.70 65.19 1bcg h VAL 19 Cb 0.00 1.32 0.00 0.00 -2.01 0.00 0.00 31.29 30.60 1bcg h VAL 19 CO 0.00 0.11 0.00 0.59 -1.01 0.00 0.00 177.57 177.26 1bcg n ASN 20 N -3.71 0.58 -0.06 3.17 3.02 -0.77 -2.13 115.26 115.37 1bcg n ASN 20 Ca -0.02 -1.23 -0.03 0.00 -0.03 0.00 0.00 54.58 53.27 1bcg n ASN 20 Cb 0.23 -0.01 -0.15 0.00 -0.61 0.00 0.00 39.78 39.24 1bcg n ASN 20 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1bcg n ALA 21 N -0.53 1.96 0.02 5.41 0.00 -0.58 -4.48 120.51 122.30 1bcg n ALA 21 Ca 0.21 -0.96 -0.14 0.00 0.00 0.00 0.00 53.44 52.54 1bcg n ALA 21 Cb 0.20 -0.33 -0.14 0.00 0.00 0.00 0.00 19.45 19.18 1bcg n ALA 21 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.50 178.47 1bcg h ILE 22 N 0.00 0.98 -3.50 0.00 2.10 -1.43 -3.44 117.51 112.22 1bcg h ILE 22 Ca -0.33 -2.71 -0.68 0.00 1.08 0.00 0.00 64.86 62.23 1bcg h ILE 22 Cb 1.72 2.60 -0.18 0.00 -1.09 0.00 0.00 36.82 39.87 1bcg h ILE 22 CO 0.02 0.74 -0.67 0.00 -1.08 0.00 0.00 178.15 177.16 1bcg s ALA 23 N -2.60 3.09 0.10 0.18 0.00 -0.90 -5.02 121.76 116.60 1bcg s ALA 23 Ca -0.10 -0.85 0.31 0.00 0.00 0.00 0.00 51.96 51.32 1bcg s ALA 23 Cb 0.07 -1.36 1.25 0.00 0.00 0.00 0.00 23.12 23.08 1bcg s ALA 23 CO 0.82 0.52 1.94 -1.35 0.00 0.00 0.00 175.76 177.70 1bcg h PRO 24 N 5.43 0.00 -0.74 0.00 0.11 -1.89 -3.38 132.00 131.54 1bcg h PRO 24 Ca -0.47 0.00 0.15 0.00 0.11 0.00 0.00 66.00 65.79 1bcg h PRO 24 Cb 1.18 0.00 -0.14 0.00 0.11 0.00 0.00 31.00 32.15 1bcg h PRO 24 CO 0.55 0.05 -0.18 0.45 -0.21 0.00 0.00 178.00 178.66 1bcg h HIS 25 N 0.00 -0.38 0.77 0.65 3.86 -1.92 0.20 115.15 118.34 1bcg h HIS 25 Ca -0.00 0.07 -0.03 0.00 -1.16 0.00 0.00 60.37 59.24 1bcg h HIS 25 Cb 0.57 0.28 -0.01 0.00 1.06 0.00 0.00 27.41 29.32 1bcg h HIS 25 CO 0.00 -0.32 -0.50 -0.92 0.86 0.00 0.00 177.93 177.05 1bcg h TYR 26 N 0.00 -1.34 -0.19 2.45 3.20 -1.87 -1.28 116.97 117.95 1bcg h TYR 26 Ca 0.36 -0.01 -0.03 0.00 3.14 0.00 0.00 58.73 62.19 1bcg h TYR 26 Cb 0.55 0.48 -0.01 0.00 1.54 0.00 0.00 36.73 39.29 1bcg h TYR 26 CO -0.58 -0.74 -0.01 0.00 -1.64 0.00 0.00 178.16 175.19 1bcg h ASN 28 N 0.27 0.77 -0.19 0.00 -0.73 -0.41 -0.26 115.58 115.02 1bcg h ASN 28 Ca 0.06 -0.23 -0.04 0.00 1.87 0.00 0.00 56.30 57.97 1bcg h ASN 28 Cb 0.20 -0.21 -0.01 0.00 0.27 0.00 0.00 38.32 38.58 1bcg h ASN 28 CO 0.01 0.90 -0.03 0.28 -0.37 0.00 0.00 177.43 178.21 1bcg h SER 29 N 0.71 0.36 0.01 1.15 0.02 -0.65 -1.65 113.55 113.51 1bcg h SER 29 Ca 0.12 -0.35 0.00 0.00 -0.84 0.00 0.00 61.79 60.72 1bcg h SER 29 Cb 0.58 -0.10 -0.00 0.00 0.14 0.00 0.00 62.40 63.02 1bcg h SER 29 CO 0.04 0.63 -0.02 -0.33 -1.14 0.00 0.00 176.83 176.00 1bcg h GLU 30 N 0.09 -0.04 -0.28 3.45 4.39 -1.20 0.66 114.58 121.64 1bcg h GLU 30 Ca 0.05 0.00 0.04 0.00 0.34 0.00 0.00 59.36 59.80 1bcg h GLU 30 Cb 0.46 0.01 -0.04 0.00 -0.10 0.00 0.00 28.75 29.08 1bcg h GLU 30 CO 0.02 -0.03 0.04 0.00 -1.16 0.00 0.00 179.01 177.88 1bcg h THR 32 N 0.13 1.57 0.10 0.00 1.35 -1.21 0.14 112.91 114.99 1bcg h THR 32 Ca 0.13 -1.89 -0.26 0.00 -0.55 0.00 0.00 66.41 63.84 1bcg h THR 32 Cb 0.15 2.80 0.00 0.00 -1.73 0.00 0.00 68.15 69.37 1bcg h THR 32 CO -0.19 0.51 -1.16 0.11 -0.25 0.00 0.00 175.52 174.53 1bcg h LYS 33 N -0.61 0.27 0.07 4.72 1.57 -0.91 -2.57 116.57 119.11 1bcg h LYS 33 Ca -0.02 -0.42 -0.37 0.00 -1.87 0.00 0.00 60.65 57.97 1bcg h LYS 33 Cb 0.91 0.15 -0.04 0.00 0.08 0.00 0.00 32.23 33.33 1bcg h LYS 33 CO 0.03 1.18 -2.19 0.28 -0.57 0.00 0.00 179.45 178.18 1bcg n VAL 34 N -3.56 1.65 -0.13 0.50 0.31 0.06 -4.52 118.33 112.64 1bcg n VAL 34 Ca -0.07 -0.63 0.06 0.00 -0.01 0.00 0.00 64.34 63.69 1bcg n VAL 34 Cb 0.98 -1.56 0.16 0.00 -0.91 0.00 0.00 33.84 32.51 1bcg n VAL 34 CO 0.00 0.00 0.00 -1.22 -1.32 0.00 0.00 176.83 174.29 1bcg n TYR 35 N -3.36 0.47 -3.96 3.52 4.01 -1.04 -4.99 117.16 111.80 1bcg n TYR 35 Ca -0.37 -0.45 -0.32 0.00 -0.16 0.00 0.00 57.90 56.60 1bcg n TYR 35 Cb 1.03 -0.02 -0.00 0.00 -0.31 0.00 0.00 39.34 40.03 1bcg n TYR 35 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 1bcg n TYR 36 N 0.63 -1.98 -2.53 -0.72 4.02 -0.82 -4.76 117.16 111.00 1bcg n TYR 36 Ca 0.12 0.79 -0.24 0.00 -0.01 0.00 0.00 57.90 58.56 1bcg n TYR 36 Cb 0.43 -3.36 0.13 0.00 -0.02 0.00 0.00 39.34 36.52 1bcg n TYR 36 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1bcg n ALA 37 N -4.36 -0.01 0.08 -0.72 0.00 0.42 -4.78 120.51 111.14 1bcg n ALA 37 Ca 0.05 -1.95 -0.14 0.00 0.00 0.00 0.00 53.44 51.41 1bcg n ALA 37 Cb 0.51 0.28 -0.14 0.00 0.00 0.00 0.00 19.45 20.10 1bcg n ALA 37 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1bcg h GLU 38 N 0.00 0.19 0.00 0.00 5.08 -1.05 -3.37 114.58 115.42 1bcg h GLU 38 Ca -0.34 -0.32 0.20 0.00 -1.00 0.00 0.00 59.36 57.89 1bcg h GLU 38 Cb 1.23 0.12 -0.04 0.00 0.50 0.00 0.00 28.75 30.56 1bcg h GLU 38 CO 0.35 1.11 0.58 -1.13 -1.00 0.00 0.00 179.01 178.92 1bcg n SER 39 N -3.45 -1.11 -3.58 1.42 3.41 -1.18 -4.90 113.62 104.23 1bcg n SER 39 Ca -0.09 -1.43 0.03 0.00 -0.26 0.00 0.00 58.87 57.12 1bcg n SER 39 Cb 1.01 1.77 -0.00 0.00 -0.26 0.00 0.00 64.21 66.73 1bcg n SER 39 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1bcg s GLY 40 N -3.35 -0.46 0.36 5.00 0.00 -1.26 -1.06 107.32 106.55 1bcg s GLY 40 Ca 0.21 0.93 -0.15 0.00 0.00 0.00 0.00 44.72 45.70 1bcg s GLY 40 CO 0.02 0.18 0.74 -2.52 0.00 0.00 0.00 173.10 171.52 1bcg s TYR 41 N -2.16 0.17 -0.43 1.90 1.13 -0.66 -3.30 117.35 114.00 1bcg s TYR 41 Ca 0.14 -0.76 -0.22 0.00 -1.41 0.00 0.00 57.07 54.82 1bcg s TYR 41 Cb 0.06 0.72 0.02 0.00 -1.10 0.00 0.00 41.96 41.67 1bcg s TYR 41 CO -0.06 -1.47 0.74 0.00 -2.51 0.00 0.00 175.55 172.25 1bcg n TRP 44 N 4.69 -2.02 -0.85 0.00 -0.00 -1.26 -3.03 117.44 114.97 1bcg n TRP 44 Ca -0.11 0.79 0.00 0.00 -0.00 0.00 0.00 57.50 58.18 1bcg n TRP 44 Cb 0.43 -4.28 0.00 0.00 -0.00 0.00 0.00 31.31 27.47 1bcg n TRP 44 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 1bcg n GLY 45 N -1.49 0.85 3.17 5.87 0.00 -1.26 -5.02 105.19 107.30 1bcg n GLY 45 Ca -0.23 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.66 1bcg n GLY 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1bcg s ALA 46 N -3.31 -0.56 -0.03 4.61 0.00 -1.17 -1.71 121.76 119.58 1bcg s ALA 46 Ca 0.00 0.17 -0.30 0.00 0.00 0.00 0.00 51.96 51.83 1bcg s ALA 46 Cb 0.00 0.03 -0.05 0.00 0.00 0.00 0.00 23.12 23.10 1bcg s ALA 46 CO 0.00 -0.22 1.45 0.00 0.00 0.00 0.00 175.76 176.99 1bcg s TYR 48 N 2.93 3.01 0.14 0.00 5.04 0.04 -4.27 117.35 124.24 1bcg s TYR 48 Ca 0.65 -0.35 0.08 0.00 -2.44 0.00 0.00 57.07 55.00 1bcg s TYR 48 Cb -0.31 -1.97 -0.04 0.00 0.35 0.00 0.00 41.96 39.99 1bcg s TYR 48 CO 0.26 -0.09 -0.10 0.00 -1.34 0.00 0.00 175.55 174.28 1bcg s PHE 50 N -1.42 2.69 -0.54 0.00 0.40 -0.22 -1.59 117.98 117.30 1bcg s PHE 50 Ca 0.23 -0.17 -0.01 0.00 -0.60 0.00 0.00 56.93 56.38 1bcg s PHE 50 Cb -0.10 -1.53 0.00 0.00 0.51 0.00 0.00 43.02 41.90 1bcg s PHE 50 CO 0.14 0.29 0.14 0.41 0.70 0.00 0.00 175.22 176.90 1bcg n GLY 51 N 1.63 0.22 3.80 4.36 0.00 -1.03 -0.79 105.19 113.39 1bcg n GLY 51 Ca -0.16 -0.52 -0.34 0.00 0.00 0.00 0.00 46.02 45.00 1bcg n GLY 51 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1bcg s LEU 52 N -2.37 3.97 0.49 0.99 1.43 0.15 -3.78 118.68 119.57 1bcg s LEU 52 Ca 0.07 1.83 -0.21 0.00 -1.03 0.00 0.00 54.13 54.79 1bcg s LEU 52 Cb -0.03 -4.45 -0.07 0.00 0.03 0.00 0.00 46.19 41.66 1bcg s LEU 52 CO 0.09 -0.50 1.11 -1.61 0.23 0.00 0.00 176.35 175.67 1bcg s GLU 53 N -3.01 3.64 0.57 1.70 2.02 -1.26 -0.22 118.70 122.14 1bcg s GLU 53 Ca 0.62 1.60 0.27 0.00 0.02 0.00 0.00 54.97 57.48 1bcg s GLU 53 Cb -0.14 -2.19 1.52 0.00 0.10 0.00 0.00 34.13 33.42 1bcg s GLU 53 CO 0.18 -0.61 2.04 0.22 0.02 0.00 0.00 175.26 177.11 1bcg h ASP 54 N 1.64 0.00 0.95 -0.19 3.58 -1.89 -1.94 116.42 118.58 1bcg h ASP 54 Ca -0.50 0.00 0.00 0.00 0.42 0.00 0.00 57.03 56.95 1bcg h ASP 54 Cb 1.24 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.29 1bcg h ASP 54 CO 0.59 0.00 0.00 -0.90 -2.88 0.00 0.00 179.24 176.05 1bcg n ASP 55 N -4.01 0.00 -4.67 2.28 5.75 -1.26 -4.82 116.55 109.82 1bcg n ASP 55 Ca 0.05 0.45 -0.43 0.00 -0.01 0.00 0.00 54.79 54.85 1bcg n ASP 55 Cb 0.45 -0.48 -0.02 0.00 -1.03 0.00 0.00 41.12 40.04 1bcg n ASP 55 CO 0.00 0.00 0.00 -0.54 -0.11 0.00 0.00 177.20 176.55 1bcg s LYS 56 N -2.97 4.26 0.16 0.11 -0.14 -0.73 -4.98 119.74 115.45 1bcg s LYS 56 Ca 0.15 1.72 -0.31 0.00 -1.36 0.00 0.00 55.97 56.16 1bcg s LYS 56 Cb 0.19 -3.71 -0.10 0.00 -1.68 0.00 0.00 37.83 32.53 1bcg s LYS 56 CO 0.52 -0.64 1.53 -2.14 -0.76 0.00 0.00 175.35 173.86 1bcg s PRO 57 N 3.11 4.24 0.22 -1.68 0.02 -1.26 -4.98 135.00 134.67 1bcg s PRO 57 Ca 0.57 2.30 0.10 0.00 0.02 0.00 0.00 61.00 63.99 1bcg s PRO 57 Cb -0.24 -3.17 -0.05 0.00 0.02 0.00 0.00 34.50 31.06 1bcg s PRO 57 CO 0.18 -0.57 -0.18 0.96 -0.33 0.00 0.00 177.00 177.06 1bcg s ILE 58 N 1.11 2.08 0.35 2.83 -4.36 -1.26 -1.69 121.20 120.26 1bcg s ILE 58 Ca 0.69 -2.19 -0.26 0.00 -0.26 0.00 0.00 60.65 58.63 1bcg s ILE 58 Cb -0.42 -2.10 -0.09 0.00 1.25 0.00 0.00 42.46 41.10 1bcg s ILE 58 CO 0.31 -0.41 1.02 -0.83 0.24 0.00 0.00 174.94 175.27 1bcg s GLY 59 N -3.16 2.82 0.62 6.27 0.00 0.11 -4.86 107.32 109.13 1bcg s GLY 59 Ca 0.23 0.67 -0.18 0.00 0.00 0.00 0.00 44.72 45.44 1bcg s GLY 59 CO 0.10 1.13 1.22 -4.14 0.00 0.00 0.00 173.10 171.41 1bcg s PRO 60 N -2.14 2.77 -0.08 2.90 0.02 -1.26 -4.61 135.00 132.59 1bcg s PRO 60 Ca 0.53 1.86 -0.28 0.00 0.02 0.00 0.00 61.00 63.12 1bcg s PRO 60 Cb -0.22 -1.90 0.06 0.00 0.02 0.00 0.00 34.50 32.46 1bcg s PRO 60 CO 0.28 -1.37 0.64 0.00 -0.33 0.00 0.00 177.00 176.22 1bcg s MET 61 N -3.44 0.97 0.69 5.54 0.23 -1.26 -5.06 119.30 116.97 1bcg s MET 61 Ca 0.78 0.34 -0.11 0.00 -1.03 0.00 0.00 55.69 55.67 1bcg s MET 61 Cb -0.31 0.46 0.01 0.00 -1.53 0.00 0.00 34.83 33.45 1bcg s MET 61 CO 0.36 -0.27 1.06 0.15 -2.03 0.00 0.00 175.02 174.29 1bcg s LYS 62 N -0.92 2.97 0.37 3.16 1.02 -1.26 -4.83 119.74 120.24 1bcg s LYS 62 Ca -0.09 0.95 0.09 0.00 0.02 0.00 0.00 55.97 56.93 1bcg s LYS 62 Cb -0.01 -1.99 0.82 0.00 -0.52 0.00 0.00 37.83 36.12 1bcg s LYS 62 CO 0.08 -1.07 1.93 -0.44 -0.92 0.00 0.00 175.35 174.92 1bcg h ASP 63 N -0.70 0.61 -0.77 2.83 3.32 -2.02 -1.43 116.42 118.26 1bcg h ASP 63 Ca -0.44 0.02 -0.03 0.00 0.02 0.00 0.00 57.03 56.60 1bcg h ASP 63 Cb 1.21 -0.11 -0.03 0.00 0.22 0.00 0.00 39.33 40.61 1bcg h ASP 63 CO 0.57 0.36 0.35 -0.29 -1.72 0.00 0.00 179.24 178.51 1bcg h ILE 64 N 0.67 1.25 -0.27 0.35 2.10 -2.00 -1.50 117.51 118.12 1bcg h ILE 64 Ca 0.36 -0.73 -0.13 0.00 1.08 0.00 0.00 64.86 65.44 1bcg h ILE 64 Cb 0.49 0.30 -0.00 0.00 -1.09 0.00 0.00 36.82 36.52 1bcg h ILE 64 CO -0.13 0.31 -0.33 0.74 -1.08 0.00 0.00 178.15 177.65 1bcg h THR 65 N 1.10 1.30 -0.30 2.19 2.02 -1.67 -2.43 112.91 115.12 1bcg h THR 65 Ca 0.26 -1.52 -0.01 0.00 0.77 0.00 0.00 66.41 65.92 1bcg h THR 65 Cb 0.15 1.64 -0.01 0.00 -1.74 0.00 0.00 68.15 68.19 1bcg h THR 65 CO -0.03 0.48 0.16 0.50 0.37 0.00 0.00 175.52 177.00 1bcg h LYS 66 N 0.44 0.42 -0.67 6.66 3.64 -1.13 -0.78 116.57 125.16 1bcg h LYS 66 Ca 0.04 -0.05 -0.04 0.00 -1.27 0.00 0.00 60.65 59.32 1bcg h LYS 66 Cb 0.91 -0.08 -0.03 0.00 -0.41 0.00 0.00 32.23 32.62 1bcg h LYS 66 CO 0.08 0.38 0.25 0.87 -2.27 0.00 0.00 179.45 178.75 1bcg h LYS 67 N 0.36 0.99 -0.39 1.90 1.57 -1.31 -1.78 116.57 117.91 1bcg h LYS 67 Ca 0.10 -0.18 -0.07 0.00 -1.87 0.00 0.00 60.65 58.63 1bcg h LYS 67 Cb 0.08 -0.16 -0.01 0.00 0.08 0.00 0.00 32.23 32.22 1bcg h LYS 67 CO -0.02 0.82 -0.05 -0.92 -0.57 0.00 0.00 179.45 178.72 1bcg h TYR 68 N 0.97 0.79 -0.00 -1.35 3.20 -1.21 -3.28 116.97 116.09 1bcg h TYR 68 Ca 0.22 -0.16 -0.16 0.00 3.14 0.00 0.00 58.73 61.78 1bcg h TYR 68 Cb 0.22 -0.20 -0.02 0.00 1.54 0.00 0.00 36.73 38.27 1bcg h TYR 68 CO 0.02 0.83 -0.74 0.00 -1.64 0.00 0.00 178.16 176.63 1bcg s ASP 70 N -6.82 5.07 -0.24 0.00 1.01 -0.69 -4.89 116.67 110.11 1bcg s ASP 70 Ca -0.01 -0.27 -0.17 0.00 0.71 0.00 0.00 52.55 52.81 1bcg s ASP 70 Cb 0.12 -2.55 0.07 0.00 1.01 0.00 0.00 42.92 41.57 1bcg s ASP 70 CO 0.78 -2.72 0.60 -0.69 0.21 0.00 0.00 175.17 173.36 1bcg s VAL 71 N 10.19 -0.00 0.00 -1.27 1.01 -1.26 -5.01 120.40 124.06 1bcg s VAL 71 Ca 0.72 0.02 0.00 0.00 0.00 0.00 0.00 61.98 62.71 1bcg s VAL 71 Cb -0.09 -0.86 0.00 0.00 0.00 0.00 0.00 36.38 35.43 1bcg s VAL 71 CO 0.07 0.01 0.00 0.00 0.00 0.00 0.00 175.10 175.18 1bcg n GLN 72 N 3.52 0.00 0.00 2.72 1.13 -1.26 -5.04 117.38 118.45 1bcg n GLN 72 Ca -0.17 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 54.89 1bcg n GLN 72 Cb 0.57 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.92 1bcg n GLN 72 CO 0.00 0.00 0.00 0.44 -1.44 0.00 0.00 177.06 176.06