#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1d4m s ALA 3 N 0.00 3.33 -0.14 4.61 0.00 -1.26 -4.78 121.76 123.52 1d4m s ALA 3 Ca 0.00 0.47 -0.06 0.00 0.00 0.00 0.00 51.96 52.37 1d4m s ALA 3 Cb 0.00 -3.10 -0.04 0.00 0.00 0.00 0.00 23.12 19.98 1d4m s ALA 3 CO 0.00 0.23 0.08 -0.65 0.00 0.00 0.00 175.76 175.42 1d4m s GLN 4 N -1.57 3.56 -0.16 0.00 -0.21 0.07 -4.95 119.66 116.41 1d4m s GLN 4 Ca 0.43 -0.28 0.01 0.00 0.02 0.00 0.00 55.36 55.55 1d4m s GLN 4 Cb -0.22 -3.12 0.02 0.00 1.00 0.00 0.00 33.01 30.69 1d4m s GLN 4 CO 0.27 0.55 -0.20 0.08 -2.12 0.00 0.00 175.29 173.87 1d4m s VAL 5 N -0.42 2.04 0.19 1.09 1.01 -1.26 -0.72 120.40 122.32 1d4m s VAL 5 Ca 0.10 -0.94 -0.01 0.00 0.00 0.00 0.00 61.98 61.13 1d4m s VAL 5 Cb -0.12 -1.83 -0.04 0.00 0.00 0.00 0.00 36.38 34.39 1d4m s VAL 5 CO 0.02 0.54 0.11 -0.94 0.00 0.00 0.00 175.10 174.83 1d4m s SER 6 N 1.13 0.26 0.45 3.32 1.04 -0.73 -4.97 113.70 114.20 1d4m s SER 6 Ca 0.01 -1.36 -0.22 0.00 0.48 0.00 0.00 55.95 54.86 1d4m s SER 6 Cb -0.14 0.35 -0.09 0.00 0.10 0.00 0.00 66.02 66.24 1d4m s SER 6 CO -0.09 -0.81 1.05 0.42 0.98 0.00 0.00 173.24 174.79 1d4m s THR 7 N -4.11 3.71 0.57 2.02 -4.23 -1.26 -0.54 115.64 111.81 1d4m s THR 7 Ca 0.36 1.17 -0.01 0.00 -1.18 0.00 0.00 61.69 62.03 1d4m s THR 7 Cb 0.07 -3.53 0.03 0.00 1.34 0.00 0.00 72.50 70.41 1d4m s THR 7 CO 0.10 -0.13 0.82 -1.10 -0.54 0.00 0.00 174.62 173.77 1d4m s GLN 8 N -2.92 2.58 0.04 3.99 -0.21 -0.72 -4.78 119.66 117.65 1d4m s GLN 8 Ca 0.64 -0.55 -0.30 0.00 0.02 0.00 0.00 55.36 55.17 1d4m s GLN 8 Cb -0.19 -2.41 -0.04 0.00 1.00 0.00 0.00 33.01 31.37 1d4m s GLN 8 CO 0.24 -0.76 0.96 0.21 -2.12 0.00 0.00 175.29 173.82 1d4m s LYS 9 N -4.86 4.61 0.30 2.91 2.47 -1.26 -4.98 119.74 118.93 1d4m s LYS 9 Ca 0.56 1.40 -0.28 0.00 -1.56 0.00 0.00 55.97 56.09 1d4m s LYS 9 Cb -0.10 -3.42 -0.14 0.00 -1.46 0.00 0.00 37.83 32.71 1d4m s LYS 9 CO 0.40 0.07 1.08 2.41 0.16 0.00 0.00 175.35 179.47 1d4m n THR 10 N 3.42 1.99 -2.07 3.43 -1.04 -1.26 -5.04 114.28 113.72 1d4m n THR 10 Ca 0.04 -0.50 0.00 0.00 -2.04 0.00 0.00 64.05 61.55 1d4m n THR 10 Cb 0.50 -1.13 0.00 0.00 -1.82 0.00 0.00 70.33 67.88 1d4m n THR 10 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1d4m n GLY 11 N 1.12 3.22 0.27 3.41 0.00 -1.26 -5.01 105.19 106.94 1d4m n GLY 11 Ca 0.08 -2.01 0.13 0.00 0.00 0.00 0.00 46.02 44.23 1d4m n GLY 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1d4m h ALA 12 N -0.52 1.27 -2.94 4.61 0.00 -2.07 -3.44 119.26 116.17 1d4m h ALA 12 Ca 0.00 -0.10 -0.64 0.00 0.00 0.00 0.00 54.91 54.17 1d4m h ALA 12 Cb 0.00 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 17.71 1d4m h ALA 12 CO 0.00 0.14 -0.53 -1.58 0.00 0.00 0.00 179.25 177.28 1d4m s HIS 13 N -4.18 3.44 -0.19 0.00 5.65 -1.26 -5.08 115.29 113.67 1d4m s HIS 13 Ca -0.03 0.27 -0.29 0.00 0.25 0.00 0.00 55.06 55.26 1d4m s HIS 13 Cb 0.13 -1.77 -0.03 0.00 -1.18 0.00 0.00 32.58 29.73 1d4m s HIS 13 CO 0.58 0.60 1.55 -1.21 -0.65 0.00 0.00 174.74 175.61 1d4m s GLU 14 N -2.05 3.92 0.61 2.88 0.41 -1.26 -5.06 118.70 118.16 1d4m s GLU 14 Ca 0.28 1.72 -0.13 0.00 -0.41 0.00 0.00 54.97 56.42 1d4m s GLU 14 Cb -0.12 -3.98 -0.10 0.00 -1.78 0.00 0.00 34.13 28.14 1d4m s GLU 14 CO 0.20 -1.13 -0.69 2.41 -0.49 0.00 0.00 175.26 175.56 1d4m n THR 15 N 6.11 0.00 -4.47 3.63 -1.04 -1.26 -5.14 114.28 112.10 1d4m n THR 15 Ca 0.18 -0.18 -0.23 0.00 -2.04 0.00 0.00 64.05 61.77 1d4m n THR 15 Cb 0.45 0.00 -0.16 0.00 -1.82 0.00 0.00 70.33 68.80 1d4m n THR 15 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 1d4m s SER 23 N -0.61 1.50 -0.01 8.00 0.15 -1.26 -5.13 113.70 116.34 1d4m s SER 23 Ca 0.24 -0.24 0.13 0.00 0.70 0.00 0.00 55.95 56.78 1d4m s SER 23 Cb -0.04 -0.63 -0.16 0.00 -1.71 0.00 0.00 66.02 63.48 1d4m s SER 23 CO 0.47 0.03 0.48 -0.38 1.20 0.00 0.00 173.24 175.04 1d4m n ILE 24 N 3.71 0.00 -2.41 6.45 -0.00 -1.26 -4.88 119.36 120.97 1d4m n ILE 24 Ca -0.22 -0.22 -0.42 0.00 -0.00 0.00 0.00 62.75 61.88 1d4m n ILE 24 Cb 0.52 0.77 0.00 0.00 -0.00 0.00 0.00 39.64 40.94 1d4m n ILE 24 CO 0.00 0.00 0.00 2.30 -0.00 0.00 0.00 176.55 178.85 1d4m n ILE 25 N -1.50 4.78 -3.97 1.39 -6.64 -1.26 -4.92 119.36 107.24 1d4m n ILE 25 Ca 0.01 -4.74 -0.09 0.00 -1.77 0.00 0.00 62.75 56.15 1d4m n ILE 25 Cb 0.25 -2.22 -0.11 0.00 -1.44 0.00 0.00 39.64 36.11 1d4m n ILE 25 CO 0.00 0.00 0.00 -1.38 -1.77 0.00 0.00 176.55 173.40 1d4m s HIS 26 N -0.70 0.24 0.23 4.28 -3.43 -1.26 -1.75 115.29 112.90 1d4m s HIS 26 Ca 0.40 -0.47 0.10 0.00 -0.80 0.00 0.00 55.06 54.29 1d4m s HIS 26 Cb 0.11 -0.18 -0.05 0.00 -1.43 0.00 0.00 32.58 31.04 1d4m s HIS 26 CO 0.00 -0.17 -0.17 1.52 -2.00 0.00 0.00 174.74 173.92 1d4m s TYR 27 N -1.30 1.96 0.03 0.38 -0.85 0.30 -4.86 117.35 113.01 1d4m s TYR 27 Ca -0.14 -0.46 0.08 0.00 -0.52 0.00 0.00 57.07 56.03 1d4m s TYR 27 Cb -0.09 -0.89 -0.03 0.00 0.38 0.00 0.00 41.96 41.33 1d4m s TYR 27 CO -0.01 0.50 -0.24 0.95 -1.52 0.00 0.00 175.55 175.23 1d4m s THR 28 N -2.66 2.30 0.06 -3.49 -4.23 -1.26 -1.77 115.64 104.60 1d4m s THR 28 Ca 0.25 -1.27 0.04 0.00 -1.18 0.00 0.00 61.69 59.52 1d4m s THR 28 Cb -0.03 -1.90 -0.03 0.00 1.34 0.00 0.00 72.50 71.89 1d4m s THR 28 CO 0.10 0.41 -0.12 0.21 -0.54 0.00 0.00 174.62 174.67 1d4m s ASN 29 N -1.16 1.45 -0.03 3.99 3.84 0.10 -4.98 114.94 118.15 1d4m s ASN 29 Ca 0.12 -0.58 -0.01 0.00 0.21 0.00 0.00 52.86 52.61 1d4m s ASN 29 Cb -0.10 -0.03 0.03 0.00 -0.55 0.00 0.00 41.25 40.59 1d4m s ASN 29 CO 0.02 -0.10 0.05 -0.63 -2.79 0.00 0.00 177.10 173.66 1d4m s ILE 30 N -1.24 -0.05 0.01 -5.21 1.01 -1.26 -0.75 121.20 113.72 1d4m s ILE 30 Ca -0.04 0.17 -0.24 0.00 0.00 0.00 0.00 60.65 60.53 1d4m s ILE 30 Cb -0.10 -0.11 -0.05 0.00 0.01 0.00 0.00 42.46 42.22 1d4m s ILE 30 CO 0.02 0.07 0.75 0.20 0.00 0.00 0.00 174.94 175.97 1d4m s ASN 31 N 0.87 7.15 -0.00 3.58 0.01 -1.26 -4.97 114.94 120.31 1d4m s ASN 31 Ca -0.07 1.38 0.17 0.00 -0.71 0.00 0.00 52.86 53.63 1d4m s ASN 31 Cb -0.10 -2.45 -0.20 0.00 0.41 0.00 0.00 41.25 38.91 1d4m s ASN 31 CO -0.03 -0.02 0.70 -1.22 -1.51 0.00 0.00 177.10 175.02 1d4m n TYR 32 N 3.06 0.00 -4.24 2.20 4.01 -1.26 -5.01 117.16 115.91 1d4m n TYR 32 Ca -0.02 0.00 -0.25 0.00 -0.16 0.00 0.00 57.90 57.47 1d4m n TYR 32 Cb 0.51 -0.05 -0.08 0.00 -0.31 0.00 0.00 39.34 39.41 1d4m n TYR 32 CO 0.00 0.00 0.00 0.71 -0.46 0.00 0.00 176.86 177.11 1d4m s TYR 33 N -2.70 2.78 -1.02 -0.72 2.02 -1.26 -5.04 117.35 111.41 1d4m s TYR 33 Ca 0.05 -0.18 0.28 0.00 -0.37 0.00 0.00 57.07 56.85 1d4m s TYR 33 Cb 0.13 -1.30 1.20 0.00 -0.40 0.00 0.00 41.96 41.59 1d4m s TYR 33 CO 0.71 0.55 1.90 1.63 -1.57 0.00 0.00 175.55 178.77 1d4m n LYS 34 N -0.40 0.02 -4.89 -0.62 5.02 -1.26 -4.76 118.16 111.26 1d4m n LYS 34 Ca -0.09 0.02 -0.33 0.00 -2.02 0.00 0.00 58.31 55.90 1d4m n LYS 34 Cb 0.57 -1.50 -0.15 0.00 -0.02 0.00 0.00 35.03 33.93 1d4m n LYS 34 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1d4m s ASP 35 N -2.98 3.82 0.58 4.39 1.01 -1.26 -5.01 116.67 117.22 1d4m s ASP 35 Ca 0.14 -0.35 0.29 0.00 0.71 0.00 0.00 52.55 53.34 1d4m s ASP 35 Cb 0.18 -1.40 1.76 0.00 1.01 0.00 0.00 42.92 44.47 1d4m s ASP 35 CO 0.51 0.20 2.23 0.00 0.21 0.00 0.00 175.17 178.31 1d4m h ALA 36 N 6.43 1.50 -0.22 5.23 0.00 -2.00 -1.08 119.26 129.12 1d4m h ALA 36 Ca -0.29 -0.02 0.06 0.00 0.00 0.00 0.00 54.91 54.67 1d4m h ALA 36 Cb 1.20 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.98 1d4m h ALA 36 CO 0.53 0.02 0.16 0.00 0.00 0.00 0.00 179.25 179.96 1d4m h ALA 37 N 1.98 2.19 0.00 0.00 0.00 -1.98 -1.51 119.26 119.94 1d4m h ALA 37 Ca -0.00 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 1d4m h ALA 37 Cb 0.05 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 1d4m h ALA 37 CO 0.00 -0.27 -0.15 0.77 0.00 0.00 0.00 179.25 179.60 1d4m h SER 38 N 0.00 0.00 -4.23 0.00 0.02 -1.58 -3.46 113.55 104.30 1d4m h SER 38 Ca 0.10 0.00 -0.53 0.00 -0.84 0.00 0.00 61.79 60.52 1d4m h SER 38 Cb 0.42 0.00 0.19 0.00 0.14 0.00 0.00 62.40 63.14 1d4m h SER 38 CO -0.00 0.15 0.29 0.20 -1.14 0.00 0.00 176.83 176.34 1d4m s ASN 39 N -6.06 3.30 1.08 3.07 0.01 -0.57 -5.02 114.94 110.74 1d4m s ASN 39 Ca -0.00 2.31 -0.16 0.00 -0.71 0.00 0.00 52.86 54.30 1d4m s ASN 39 Cb 0.11 -2.58 0.23 0.00 0.41 0.00 0.00 41.25 39.41 1d4m s ASN 39 CO 0.60 -2.86 1.13 -0.94 -1.51 0.00 0.00 177.10 173.51 1d4m s SER 40 N -2.34 2.01 0.81 -1.22 1.04 -1.26 -5.03 113.70 107.71 1d4m s SER 40 Ca 0.71 0.83 -0.11 0.00 0.48 0.00 0.00 55.95 57.86 1d4m s SER 40 Cb -0.27 -1.25 0.08 0.00 0.10 0.00 0.00 66.02 64.68 1d4m s SER 40 CO 0.53 -3.47 1.09 0.00 0.98 0.00 0.00 173.24 172.37 1d4m s ALA 41 N -3.10 2.06 -1.14 5.32 0.00 -1.26 -4.96 121.76 118.67 1d4m s ALA 41 Ca 0.68 0.11 -0.05 0.00 0.00 0.00 0.00 51.96 52.71 1d4m s ALA 41 Cb -0.13 -3.23 0.26 0.00 0.00 0.00 0.00 23.12 20.02 1d4m s ALA 41 CO 0.56 -1.91 1.74 0.09 0.00 0.00 0.00 175.76 176.24 1d4m n ASN 42 N -3.60 6.53 0.25 0.00 3.02 -1.26 -4.77 115.26 115.43 1d4m n ASN 42 Ca 0.08 -3.38 0.17 0.00 -0.03 0.00 0.00 54.58 51.42 1d4m n ASN 42 Cb 0.54 -1.30 0.76 0.00 -0.61 0.00 0.00 39.78 39.17 1d4m n ASN 42 CO 0.00 0.00 0.00 0.03 -2.62 0.00 0.00 177.26 174.67 1d4m h ARG 43 N 5.14 0.00 -0.36 3.52 2.47 -2.05 -3.31 114.38 119.78 1d4m h ARG 43 Ca 0.37 0.00 -0.12 0.00 -1.26 0.00 0.00 59.98 58.97 1d4m h ARG 43 Cb 0.52 0.00 -0.07 0.00 -1.65 0.00 0.00 29.97 28.77 1d4m h ARG 43 CO 1.38 0.00 0.02 1.04 0.56 0.00 0.00 179.97 182.97 1d4m n GLN 44 N -2.83 2.46 -3.42 0.04 6.02 -1.26 -4.94 117.38 113.44 1d4m n GLN 44 Ca -0.00 -3.01 -0.40 0.00 -0.01 0.00 0.00 57.00 53.58 1d4m n GLN 44 Cb 0.21 -1.87 -0.09 0.00 1.02 0.00 0.00 30.24 29.51 1d4m n GLN 44 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 1d4m s ASP 45 N -2.11 6.17 -0.22 1.08 2.15 -1.25 -4.96 116.67 117.54 1d4m s ASP 45 Ca 0.45 -0.13 0.14 0.00 0.43 0.00 0.00 52.55 53.44 1d4m s ASP 45 Cb 0.38 -2.19 0.50 0.00 -0.30 0.00 0.00 42.92 41.31 1d4m s ASP 45 CO 0.05 -0.28 1.41 0.49 -0.17 0.00 0.00 175.17 176.67 1d4m n PHE 46 N 5.34 0.91 -1.93 -5.34 3.72 -1.26 -5.02 117.46 113.88 1d4m n PHE 46 Ca -0.10 -1.16 -0.40 0.00 -0.05 0.00 0.00 57.45 55.74 1d4m n PHE 46 Cb 0.50 -0.37 -0.00 0.00 -0.94 0.00 0.00 39.48 38.67 1d4m n PHE 46 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 1d4m s THR 47 N -2.99 2.33 -0.27 4.37 2.01 -1.26 -5.01 115.64 114.81 1d4m s THR 47 Ca 0.42 0.32 -0.21 0.00 0.31 0.00 0.00 61.69 62.52 1d4m s THR 47 Cb 0.36 -3.20 0.08 0.00 0.01 0.00 0.00 72.50 69.75 1d4m s THR 47 CO 0.05 0.06 0.72 -1.58 -0.69 0.00 0.00 174.62 173.19 1d4m s GLN 48 N -2.12 0.77 -0.23 4.92 0.74 -1.26 -5.14 119.66 117.34 1d4m s GLN 48 Ca 0.54 1.07 -0.04 0.00 0.05 0.00 0.00 55.36 56.98 1d4m s GLN 48 Cb -0.43 0.29 0.09 0.00 1.10 0.00 0.00 33.01 34.06 1d4m s GLN 48 CO 0.57 -0.12 0.15 0.34 -0.55 0.00 0.00 175.29 175.68 1d4m s ASP 49 N 0.89 2.54 0.00 6.67 2.15 -1.26 -5.03 116.67 122.64 1d4m s ASP 49 Ca -0.04 -0.81 0.28 0.00 0.43 0.00 0.00 52.55 52.42 1d4m s ASP 49 Cb -0.05 -0.09 1.15 0.00 -0.30 0.00 0.00 42.92 43.63 1d4m s ASP 49 CO -0.08 -0.38 1.81 -2.65 -0.17 0.00 0.00 175.17 173.70 1d4m n PRO 50 N 5.28 0.81 0.21 4.34 -0.02 -1.26 -4.42 135.00 139.94 1d4m n PRO 50 Ca -0.06 -0.33 0.15 0.00 -2.02 0.00 0.00 63.50 61.24 1d4m n PRO 50 Cb 0.46 -1.49 0.59 0.00 -0.02 0.00 0.00 33.50 33.04 1d4m n PRO 50 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1d4m h SER 51 N 0.81 0.00 -0.26 2.55 4.64 -1.95 0.55 113.55 119.90 1d4m h SER 51 Ca 0.00 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.27 1d4m h SER 51 Cb 0.38 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.45 1d4m h SER 51 CO 0.00 0.00 0.01 0.11 -0.87 0.00 0.00 176.83 176.08 1d4m h LYS 52 N 0.00 0.57 0.02 4.77 1.57 -1.87 -2.17 116.57 119.47 1d4m h LYS 52 Ca 0.00 -0.12 -0.35 0.00 -1.87 0.00 0.00 60.65 58.30 1d4m h LYS 52 Cb 0.48 -0.08 -0.05 0.00 0.08 0.00 0.00 32.23 32.66 1d4m h LYS 52 CO 0.00 0.59 -1.97 1.19 -0.57 0.00 0.00 179.45 178.69 1d4m n PHE 53 N -4.27 0.61 0.18 -1.35 3.72 -1.09 -4.19 117.46 111.07 1d4m n PHE 53 Ca 0.02 0.21 0.06 0.00 -0.05 0.00 0.00 57.45 57.69 1d4m n PHE 53 Cb 0.25 -1.07 0.26 0.00 -0.94 0.00 0.00 39.48 37.98 1d4m n PHE 53 CO 0.00 0.00 0.00 1.79 -0.05 0.00 0.00 176.76 178.50 1d4m h THR 54 N -0.66 0.73 -0.93 4.37 1.35 -0.97 -3.40 112.91 113.39 1d4m h THR 54 Ca -0.51 -1.62 -0.38 0.00 -0.55 0.00 0.00 66.41 63.35 1d4m h THR 54 Cb 1.62 2.06 -0.26 0.00 -1.73 0.00 0.00 68.15 69.84 1d4m h THR 54 CO -0.21 0.35 -0.78 -1.84 -0.25 0.00 0.00 175.52 172.79 1d4m n GLU 55 N -3.35 0.76 -0.21 4.72 0.28 -0.82 -4.99 120.64 117.03 1d4m n GLU 55 Ca 0.01 -2.43 -0.02 0.00 -0.16 0.00 0.00 57.16 54.56 1d4m n GLU 55 Cb 0.57 -1.35 0.05 0.00 1.43 0.00 0.00 31.44 32.14 1d4m n GLU 55 CO 0.00 0.00 0.00 -0.35 -0.16 0.00 0.00 177.13 176.62 1d4m n PRO 56 N 1.50 1.42 -2.84 3.44 -0.05 -1.23 -4.80 135.00 132.44 1d4m n PRO 56 Ca 0.15 -0.58 -0.41 0.00 -0.05 0.00 0.00 63.50 62.61 1d4m n PRO 56 Cb 0.59 -1.38 -0.04 0.00 -0.05 0.00 0.00 33.50 32.62 1d4m n PRO 56 CO 0.00 0.00 0.00 0.14 -0.05 0.00 0.00 175.50 175.59 1d4m s VAL 57 N -0.88 4.88 0.19 0.52 -7.23 -1.26 -4.98 120.40 111.65 1d4m s VAL 57 Ca 0.11 1.83 -0.16 0.00 -1.81 0.00 0.00 61.98 61.95 1d4m s VAL 57 Cb 0.09 -4.21 0.18 0.00 0.56 0.00 0.00 36.38 32.99 1d4m s VAL 57 CO 0.02 0.22 1.63 0.50 -0.31 0.00 0.00 175.10 177.17 1d4m h LYS 58 N 6.57 -0.04 -5.18 4.82 3.64 -2.05 -3.37 116.57 120.96 1d4m h LYS 58 Ca -0.41 0.00 -0.63 0.00 -1.27 0.00 0.00 60.65 58.34 1d4m h LYS 58 Cb 1.21 0.01 -0.14 0.00 -0.41 0.00 0.00 32.23 32.89 1d4m h LYS 58 CO 0.74 -0.02 -0.20 -0.51 -2.27 0.00 0.00 179.45 177.19 1d4m s ASP 59 N -5.21 6.28 0.34 4.20 1.01 -1.26 -5.06 116.67 116.98 1d4m s ASP 59 Ca -0.14 0.30 -0.29 0.00 0.71 0.00 0.00 52.55 53.13 1d4m s ASP 59 Cb 0.17 -2.22 -0.11 0.00 1.01 0.00 0.00 42.92 41.77 1d4m s ASP 59 CO 0.72 -0.21 1.50 0.68 0.21 0.00 0.00 175.17 178.07 1d4m s VAL 60 N 2.11 2.13 -0.26 -1.27 -7.23 -1.26 -5.02 120.40 109.60 1d4m s VAL 60 Ca 0.16 0.12 0.03 0.00 -1.81 0.00 0.00 61.98 60.48 1d4m s VAL 60 Cb -0.16 -3.08 0.06 0.00 0.56 0.00 0.00 36.38 33.77 1d4m s VAL 60 CO 0.10 0.03 -0.08 0.00 -0.31 0.00 0.00 175.10 174.84 1d4m s MET 61 N -1.54 2.02 0.13 4.82 0.23 -1.26 -5.11 119.30 118.59 1d4m s MET 61 Ca 0.56 -1.32 -0.30 0.00 -1.03 0.00 0.00 55.69 53.59 1d4m s MET 61 Cb -0.46 -2.85 -0.07 0.00 -1.53 0.00 0.00 34.83 29.92 1d4m s MET 61 CO 0.57 -0.62 1.26 0.42 -2.03 0.00 0.00 175.02 174.63 1d4m s ILE 62 N 1.15 3.60 0.23 3.16 1.01 -1.26 -4.98 121.20 124.11 1d4m s ILE 62 Ca -0.06 1.22 -0.06 0.00 0.00 0.00 0.00 60.65 61.75 1d4m s ILE 62 Cb -0.20 -3.78 0.19 0.00 0.01 0.00 0.00 42.46 38.68 1d4m s ILE 62 CO -0.06 0.13 1.75 0.11 0.00 0.00 0.00 174.94 176.87 1d4m h LYS 63 N 6.18 0.47 -0.61 2.79 1.57 -1.99 -3.19 116.57 121.79 1d4m h LYS 63 Ca -0.43 -0.03 0.06 0.00 -1.87 0.00 0.00 60.65 58.38 1d4m h LYS 63 Cb 1.21 -0.11 -0.05 0.00 0.08 0.00 0.00 32.23 33.36 1d4m h LYS 63 CO 0.80 0.31 0.32 0.66 -0.57 0.00 0.00 179.45 180.97 1d4m h SER 64 N 0.49 0.46 -4.04 0.86 4.64 -2.07 -3.44 113.55 110.45 1d4m h SER 64 Ca 0.37 0.03 -0.47 0.00 -0.47 0.00 0.00 61.79 61.25 1d4m h SER 64 Cb 0.50 -0.05 0.02 0.00 -0.31 0.00 0.00 62.40 62.55 1d4m h SER 64 CO -0.34 0.30 0.39 -0.76 -0.87 0.00 0.00 176.83 175.55 1d4m s LEU 65 N -10.27 3.95 0.68 5.97 1.02 -1.21 -5.04 118.68 113.77 1d4m s LEU 65 Ca -0.13 1.94 -0.16 0.00 0.02 0.00 0.00 54.13 55.80 1d4m s LEU 65 Cb 0.15 -4.44 0.01 0.00 0.02 0.00 0.00 46.19 41.93 1d4m s LEU 65 CO 0.75 -0.65 1.21 -2.84 0.02 0.00 0.00 176.35 174.83 1d4m s PRO 66 N -3.00 2.46 -0.02 1.29 0.02 -1.26 -4.89 135.00 129.60 1d4m s PRO 66 Ca 0.64 1.78 -0.23 0.00 0.02 0.00 0.00 61.00 63.20 1d4m s PRO 66 Cb -0.17 -1.87 -0.20 0.00 0.02 0.00 0.00 34.50 32.28 1d4m s PRO 66 CO 0.22 -1.60 1.18 0.00 -0.33 0.00 0.00 177.00 176.47 1d4m h ALA 67 N 0.13 0.08 -2.89 -1.55 0.00 -1.94 -3.45 119.26 109.64 1d4m h ALA 67 Ca -0.49 -0.38 -0.67 0.00 0.00 0.00 0.00 54.91 53.38 1d4m h ALA 67 Cb 1.30 -0.01 -0.10 0.00 0.00 0.00 0.00 17.79 18.98 1d4m h ALA 67 CO 0.52 0.02 -0.53 -0.51 0.00 0.00 0.00 179.25 178.75 1d4m s LEU 68 N -8.85 4.12 0.00 0.00 1.43 -1.26 -5.16 118.68 108.96 1d4m s LEU 68 Ca -0.15 0.35 0.00 0.00 -1.03 0.00 0.00 54.13 53.30 1d4m s LEU 68 Cb 0.02 -1.99 0.00 0.00 0.03 0.00 0.00 46.19 44.25 1d4m s LEU 68 CO 0.73 0.39 0.00 -0.46 0.23 0.00 0.00 176.35 177.24