#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dll n LYS 3 N 0.00 3.66 -0.00 0.00 4.01 -1.26 -4.97 118.16 119.60 3dll n LYS 3 Ca 0.00 -4.50 -0.00 0.00 -0.51 0.00 0.00 58.31 53.29 3dll n LYS 3 Cb 0.00 -2.50 -0.00 0.00 -0.51 0.00 0.00 35.03 32.01 3dll n LYS 3 CO 0.00 0.00 0.00 0.72 -1.11 0.00 0.00 177.40 177.01 3dll n HIS 4 N 2.11 -0.00 -4.27 2.13 8.25 -1.26 -4.26 115.22 117.91 3dll n HIS 4 Ca 0.25 0.01 -0.27 0.00 -0.26 0.00 0.00 57.72 57.45 3dll n HIS 4 Cb 0.37 -0.21 -0.06 0.00 1.12 0.00 0.00 29.99 31.21 3dll n HIS 4 CO 0.00 0.00 0.00 -2.14 0.64 0.00 0.00 176.34 174.84 3dll s PRO 5 N -3.81 2.20 -0.14 -0.41 0.02 -1.26 -5.12 135.00 126.48 3dll s PRO 5 Ca -0.00 -2.04 -0.34 0.00 0.02 0.00 0.00 61.00 58.64 3dll s PRO 5 Cb 0.00 -1.87 0.13 0.00 0.02 0.00 0.00 34.50 32.78 3dll s PRO 5 CO 0.01 -0.28 1.25 0.54 -0.33 0.00 0.00 177.00 178.18 3dll s VAL 6 N -2.71 0.00 0.76 3.83 0.11 -1.26 -5.19 120.40 115.93 3dll s VAL 6 Ca 0.31 -0.07 -0.11 0.00 -2.93 0.00 0.00 61.98 59.18 3dll s VAL 6 Cb 0.03 -1.32 0.06 0.00 -1.53 0.00 0.00 36.38 33.61 3dll s VAL 6 CO 0.17 0.00 1.12 -2.16 -3.33 0.00 0.00 175.10 170.91 3dll s PRO 7 N -2.39 2.29 0.00 1.54 0.04 -1.26 -5.09 135.00 130.13 3dll s PRO 7 Ca 0.11 0.16 0.05 0.00 0.04 0.00 0.00 61.00 61.36 3dll s PRO 7 Cb 0.01 -2.01 -0.02 0.00 0.04 0.00 0.00 34.50 32.52 3dll s PRO 7 CO -0.04 -1.35 0.38 1.17 0.04 0.00 0.00 177.00 177.19 3dll n LYS 8 N -3.15 3.39 -3.25 4.56 4.81 -1.26 -5.01 118.16 118.26 3dll n LYS 8 Ca 0.08 -0.29 0.04 0.00 -0.87 0.00 0.00 58.31 57.26 3dll n LYS 8 Cb 0.60 -0.87 -0.02 0.00 0.02 0.00 0.00 35.03 34.75 3dll n LYS 8 CO 0.00 0.00 0.00 0.15 1.17 0.00 0.00 177.40 178.72 3dll s LYS 9 N -1.13 0.28 -0.39 1.64 -0.14 -1.26 -5.08 119.74 113.66 3dll s LYS 9 Ca 0.04 0.59 -0.35 0.00 -1.36 0.00 0.00 55.97 54.89 3dll s LYS 9 Cb 0.04 0.34 -0.15 0.00 -1.68 0.00 0.00 37.83 36.38 3dll s LYS 9 CO 0.16 -0.23 1.55 1.17 -0.76 0.00 0.00 175.35 177.25 3dll n LYS 10 N 5.27 0.00 -1.57 1.68 4.81 -1.26 -4.57 118.16 122.52 3dll n LYS 10 Ca -0.07 0.00 -0.46 0.00 -0.87 0.00 0.00 58.31 56.91 3dll n LYS 10 Cb 0.53 -1.16 -0.05 0.00 0.02 0.00 0.00 35.03 34.37 3dll n LYS 10 CO 0.00 0.00 0.00 0.25 1.17 0.00 0.00 177.40 178.82 3dll n THR 11 N 4.55 0.37 -0.66 3.15 -2.24 -1.26 -4.87 114.28 113.31 3dll n THR 11 Ca 0.38 -0.31 -0.25 0.00 -2.27 0.00 0.00 64.05 61.59 3dll n THR 11 Cb -0.03 -2.15 0.02 0.00 -2.10 0.00 0.00 70.33 66.07 3dll n THR 11 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 3dll n SER 12 N 9.95 -2.40 -0.24 3.42 3.41 -1.26 -4.52 113.62 121.98 3dll n SER 12 Ca 0.31 0.02 0.14 0.00 -0.26 0.00 0.00 58.87 59.09 3dll n SER 12 Cb 0.35 -0.37 0.58 0.00 -0.26 0.00 0.00 64.21 64.52 3dll n SER 12 CO 0.00 0.00 0.00 2.29 -0.16 0.00 0.00 175.04 177.17 3dll n LYS 13 N 1.66 1.06 -0.00 4.33 2.85 -1.26 -2.56 118.16 124.22 3dll n LYS 13 Ca -0.01 -0.47 -0.00 0.00 -1.05 0.00 0.00 58.31 56.77 3dll n LYS 13 Cb 0.48 -1.49 -0.00 0.00 -0.65 0.00 0.00 35.03 33.37 3dll n LYS 13 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 177.40 178.38 3dll h SER 14 N 1.16 0.00 -0.99 -5.58 0.87 -1.99 -3.23 113.55 103.78 3dll h SER 14 Ca 0.00 0.00 0.13 0.00 -1.23 0.00 0.00 61.79 60.69 3dll h SER 14 Cb 0.38 0.00 -0.14 0.00 -0.44 0.00 0.00 62.40 62.20 3dll h SER 14 CO 0.00 0.02 -0.46 1.17 -0.53 0.00 0.00 176.83 177.02 3dll n LYS 15 N -2.11 -0.31 0.03 2.24 3.00 -1.25 0.21 118.16 119.97 3dll n LYS 15 Ca -0.00 1.51 0.21 0.00 -0.00 0.00 0.00 58.31 60.03 3dll n LYS 15 Cb 0.00 -2.24 0.55 0.00 0.00 0.00 0.00 35.03 33.35 3dll n LYS 15 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.40 177.31 3dll h ARG 16 N 0.00 0.00 0.05 1.64 1.12 -1.66 0.40 114.38 115.93 3dll h ARG 16 Ca 0.27 0.00 -0.38 0.00 -1.11 0.00 0.00 59.98 58.76 3dll h ARG 16 Cb 0.52 0.00 -0.05 0.00 -0.01 0.00 0.00 29.97 30.43 3dll h ARG 16 CO -0.96 0.00 -2.28 -0.25 -3.11 0.00 0.00 179.97 173.37 3dll n ASP 17 N -3.29 2.04 0.00 -3.80 9.92 0.56 -3.99 116.55 117.99 3dll n ASP 17 Ca 0.12 0.02 0.03 0.00 -0.53 0.00 0.00 54.79 54.42 3dll n ASP 17 Cb 0.99 -0.61 0.19 0.00 -0.64 0.00 0.00 41.12 41.05 3dll n ASP 17 CO 0.00 0.00 0.00 1.15 0.13 0.00 0.00 177.20 178.48 3dll n MET 18 N -3.39 0.50 -0.05 -1.24 0.00 0.13 -0.80 117.12 112.27 3dll n MET 18 Ca -0.40 0.00 -0.21 0.00 0.00 0.00 0.00 57.70 57.09 3dll n MET 18 Cb 1.01 -1.20 -0.13 0.00 0.00 0.00 0.00 33.22 32.90 3dll n MET 18 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 175.97 175.88 3dll h ARG 19 N 0.00 0.11 0.00 3.17 2.43 -1.38 -3.36 114.38 115.35 3dll h ARG 19 Ca 0.00 -0.19 0.00 0.00 -0.81 0.00 0.00 59.98 58.98 3dll h ARG 19 Cb 0.00 0.07 0.00 0.00 -0.42 0.00 0.00 29.97 29.62 3dll h ARG 19 CO 0.00 1.09 0.00 0.54 -1.51 0.00 0.00 179.97 180.09 3dll n ARG 20 N -4.16 0.42 -0.00 0.20 1.74 0.02 -4.26 116.66 110.62 3dll n ARG 20 Ca -0.28 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.80 3dll n ARG 20 Cb 0.78 -1.31 0.00 0.00 -1.02 0.00 0.00 32.46 30.91 3dll n ARG 20 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 3dll n SER 21 N -0.81 1.47 0.00 0.55 3.41 -1.23 -1.66 113.62 115.35 3dll n SER 21 Ca 0.06 -0.98 0.00 0.00 -0.26 0.00 0.00 58.87 57.69 3dll n SER 21 Cb 0.03 -0.25 0.00 0.00 -0.26 0.00 0.00 64.21 63.73 3dll n SER 21 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 3dll n HIS 22 N 0.76 0.00 0.58 7.33 8.25 -1.26 -4.87 115.22 126.01 3dll n HIS 22 Ca 0.00 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.59 3dll n HIS 22 Cb 0.24 0.01 0.39 0.00 1.12 0.00 0.00 29.99 31.75 3dll n HIS 22 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 3dll h HIS 23 N 0.00 0.00 -1.25 4.41 -0.00 -1.65 -3.47 115.15 113.20 3dll h HIS 23 Ca 0.00 0.00 -0.80 0.00 -0.00 0.00 0.00 60.37 59.57 3dll h HIS 23 Cb 0.50 0.00 0.02 0.00 -0.00 0.00 0.00 27.41 27.93 3dll h HIS 23 CO 0.00 0.00 0.60 0.00 -0.00 0.00 0.00 177.93 178.53 3dll n ALA 24 N -1.81 -1.41 -1.52 2.45 0.00 -1.26 -4.92 120.51 112.03 3dll n ALA 24 Ca 0.05 0.49 -0.32 0.00 0.00 0.00 0.00 53.44 53.66 3dll n ALA 24 Cb 0.43 -2.00 0.04 0.00 0.00 0.00 0.00 19.45 17.93 3dll n ALA 24 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 3dll s LEU 25 N 2.25 3.32 -0.15 0.00 2.96 -1.26 -5.03 118.68 120.77 3dll s LEU 25 Ca 0.98 1.85 -0.06 0.00 -0.22 0.00 0.00 54.13 56.68 3dll s LEU 25 Cb -1.26 -4.53 -0.04 0.00 0.50 0.00 0.00 46.19 40.86 3dll s LEU 25 CO 0.68 -1.54 0.04 0.42 -1.32 0.00 0.00 176.35 174.63 3dll s THR 26 N -2.59 4.64 0.17 3.68 -4.23 -1.26 -5.08 115.64 110.97 3dll s THR 26 Ca 0.63 -0.10 -0.31 0.00 -1.18 0.00 0.00 61.69 60.73 3dll s THR 26 Cb -0.18 -3.05 -0.10 0.00 1.34 0.00 0.00 72.50 70.52 3dll s THR 26 CO 0.45 0.51 1.54 0.00 -0.54 0.00 0.00 174.62 176.58 3dll s ALA 27 N -0.02 3.75 0.61 3.99 0.00 -1.26 -4.93 121.76 123.89 3dll s ALA 27 Ca 0.05 1.34 -0.19 0.00 0.00 0.00 0.00 51.96 53.16 3dll s ALA 27 Cb -0.12 -3.61 -0.04 0.00 0.00 0.00 0.00 23.12 19.35 3dll s ALA 27 CO 0.01 -0.76 1.07 -2.30 0.00 0.00 0.00 175.76 173.79 3dll n PRO 28 N 3.84 1.01 -2.88 0.00 -0.02 -1.26 -4.86 135.00 130.83 3dll n PRO 28 Ca 0.13 0.39 -0.44 0.00 -2.02 0.00 0.00 63.50 61.56 3dll n PRO 28 Cb 0.39 -2.28 0.00 0.00 -0.02 0.00 0.00 33.50 31.59 3dll n PRO 28 CO 0.00 0.00 0.00 -1.71 1.98 0.00 0.00 175.50 175.77 3dll n ASN 29 N -1.02 5.29 -4.76 2.55 4.05 -1.26 -5.00 115.26 115.10 3dll n ASN 29 Ca 0.14 -3.03 -0.41 0.00 0.45 0.00 0.00 54.58 51.73 3dll n ASN 29 Cb 0.47 -1.52 -0.03 0.00 1.23 0.00 0.00 39.78 39.93 3dll n ASN 29 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 177.26 173.45 3dll s LEU 30 N 0.70 4.49 -0.00 1.20 1.43 -1.26 -4.49 118.68 120.74 3dll s LEU 30 Ca 0.40 2.43 0.08 0.00 -1.03 0.00 0.00 54.13 56.02 3dll s LEU 30 Cb -0.01 -3.63 -0.02 0.00 0.03 0.00 0.00 46.19 42.56 3dll s LEU 30 CO -0.00 -0.33 -0.26 -0.89 0.23 0.00 0.00 176.35 175.10 3dll s THR 31 N -0.99 2.06 0.15 5.49 2.01 -0.82 -4.97 115.64 118.57 3dll s THR 31 Ca 0.48 -1.17 -0.18 0.00 0.31 0.00 0.00 61.69 61.12 3dll s THR 31 Cb -0.35 -1.72 -0.07 0.00 0.01 0.00 0.00 72.50 70.36 3dll s THR 31 CO 0.45 0.53 0.63 -0.70 -0.69 0.00 0.00 174.62 174.84 3dll s GLU 32 N -0.76 4.18 0.48 4.92 2.12 -1.26 0.47 118.70 128.84 3dll s GLU 32 Ca 0.10 0.74 -0.20 0.00 0.36 0.00 0.00 54.97 55.97 3dll s GLU 32 Cb -0.10 -3.02 -0.09 0.00 0.26 0.00 0.00 34.13 31.18 3dll s GLU 32 CO -0.00 0.50 1.01 0.00 -0.54 0.00 0.00 175.26 176.23 3dll n PRO 34 N -0.95 0.67 0.00 0.00 -0.02 -1.26 -2.66 135.00 130.77 3dll n PRO 34 Ca 0.08 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.56 3dll n PRO 34 Cb 0.53 -1.42 0.00 0.00 -0.02 0.00 0.00 33.50 32.59 3dll n PRO 34 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 3dll n GLN 35 N -0.92 0.00 0.08 -0.52 1.13 -1.26 -4.82 117.38 111.07 3dll n GLN 35 Ca 0.13 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.19 3dll n GLN 35 Cb 0.06 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.41 3dll n GLN 35 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3dll n HIS 37 N -1.25 0.00 -2.79 0.00 8.25 -1.09 -4.89 115.22 113.45 3dll n HIS 37 Ca 0.00 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.05 3dll n HIS 37 Cb 0.56 -1.20 -0.05 0.00 1.12 0.00 0.00 29.99 30.42 3dll n HIS 37 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 3dll s GLY 38 N -1.26 2.99 -0.41 -1.41 0.00 -1.26 -3.80 107.32 102.16 3dll s GLY 38 Ca 0.00 0.53 -0.43 0.00 0.00 0.00 0.00 44.72 44.82 3dll s GLY 38 CO 0.00 1.33 1.81 0.28 0.00 0.00 0.00 173.10 176.52 3dll n LYS 39 N 2.52 0.49 -4.41 2.90 4.76 -1.26 -3.00 118.16 120.15 3dll n LYS 39 Ca 0.00 0.17 -0.24 0.00 -2.87 0.00 0.00 58.31 55.37 3dll n LYS 39 Cb 0.49 -1.80 -0.09 0.00 -1.84 0.00 0.00 35.03 31.79 3dll n LYS 39 CO 0.00 0.00 0.00 -1.59 -1.37 0.00 0.00 177.40 174.44 3dll s LYS 40 N 4.08 1.93 0.51 1.97 -2.85 0.18 -4.90 119.74 120.66 3dll s LYS 40 Ca 1.06 -1.72 -0.11 0.00 -1.00 0.00 0.00 55.97 54.20 3dll s LYS 40 Cb -1.30 -1.88 -0.06 0.00 -2.06 0.00 0.00 37.83 32.54 3dll s LYS 40 CO 0.70 0.25 0.90 -1.17 0.10 0.00 0.00 175.35 176.13 3dll s LEU 41 N -3.62 3.57 -0.31 2.77 2.96 -1.26 -1.95 118.68 120.83 3dll s LEU 41 Ca 0.32 1.28 -0.22 0.00 -0.22 0.00 0.00 54.13 55.30 3dll s LEU 41 Cb -0.03 -4.24 -0.00 0.00 0.50 0.00 0.00 46.19 42.42 3dll s LEU 41 CO 0.17 -0.62 0.70 -0.55 -1.32 0.00 0.00 176.35 174.74 3dll s SER 42 N -3.62 6.56 0.00 3.68 0.15 -1.26 -3.90 113.70 115.31 3dll s SER 42 Ca 0.53 0.49 0.00 0.00 0.70 0.00 0.00 55.95 57.68 3dll s SER 42 Cb -0.10 -2.36 0.00 0.00 -1.71 0.00 0.00 66.02 61.84 3dll s SER 42 CO 0.40 -0.55 0.00 1.41 1.20 0.00 0.00 173.24 175.70 3dll n HIS 43 N 6.04 0.00 -3.64 3.44 8.25 -1.26 -5.07 115.22 122.98 3dll n HIS 43 Ca 0.01 0.00 -0.22 0.00 -0.26 0.00 0.00 57.72 57.25 3dll n HIS 43 Cb 0.48 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.58 3dll n HIS 43 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 3dll s HIS 44 N -2.00 2.29 0.17 4.41 3.76 -1.25 -5.08 115.29 117.59 3dll s HIS 44 Ca 0.00 -0.62 -0.30 0.00 -0.15 0.00 0.00 55.06 53.99 3dll s HIS 44 Cb 0.00 -2.09 -0.08 0.00 1.11 0.00 0.00 32.58 31.52 3dll s HIS 44 CO 0.00 -0.29 1.11 0.42 -0.85 0.00 0.00 174.74 175.13 3dll s ILE 45 N -2.58 3.87 -0.12 0.60 1.01 -1.26 -4.88 121.20 117.83 3dll s ILE 45 Ca 0.45 1.60 -0.29 0.00 0.00 0.00 0.00 60.65 62.40 3dll s ILE 45 Cb -0.03 -4.02 -0.06 0.00 0.01 0.00 0.00 42.46 38.37 3dll s ILE 45 CO 0.27 0.27 1.88 0.00 0.00 0.00 0.00 174.94 177.35 3dll h PRO 47 N 11.60 -0.24 -0.06 0.00 0.13 -1.91 0.21 132.00 141.73 3dll h PRO 47 Ca -0.41 0.02 0.01 0.00 -0.87 0.00 0.00 66.00 64.74 3dll h PRO 47 Cb 1.20 0.05 -0.01 0.00 0.13 0.00 0.00 31.00 32.38 3dll h PRO 47 CO 0.97 -0.16 -0.06 -0.91 -0.23 0.00 0.00 178.00 177.61 3dll h ASN 48 N -0.25 -0.20 1.14 1.44 2.35 -1.91 -3.04 115.58 115.12 3dll h ASN 48 Ca 0.05 0.03 0.00 0.00 -0.55 0.00 0.00 56.30 55.83 3dll h ASN 48 Cb 0.38 0.08 0.00 0.00 0.05 0.00 0.00 38.32 38.84 3dll h ASN 48 CO -0.40 -0.03 -0.57 0.00 -1.65 0.00 0.00 177.43 174.77 3dll n GLY 50 N 1.25 0.48 3.83 0.00 0.00 0.74 -4.72 105.19 106.77 3dll n GLY 50 Ca 0.03 -0.56 -0.38 0.00 0.00 0.00 0.00 46.02 45.11 3dll n GLY 50 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3dll s TYR 51 N -2.00 3.74 -0.40 1.61 1.51 -1.24 -0.93 117.35 119.64 3dll s TYR 51 Ca 0.00 1.06 0.09 0.00 -1.01 0.00 0.00 57.07 57.21 3dll s TYR 51 Cb 0.00 -2.34 0.29 0.00 -0.11 0.00 0.00 41.96 39.79 3dll s TYR 51 CO 0.00 0.62 0.68 0.98 -1.11 0.00 0.00 175.55 176.72 3dll n TYR 52 N 1.72 -0.78 0.00 2.71 9.36 -1.26 -2.96 117.16 125.95 3dll n TYR 52 Ca -0.13 -3.30 0.00 0.00 3.32 0.00 0.00 57.90 57.80 3dll n TYR 52 Cb 0.52 0.03 0.00 0.00 -0.63 0.00 0.00 39.34 39.26 3dll n TYR 52 CO 0.00 0.00 0.00 -0.25 0.22 0.00 0.00 176.86 176.83 3dll n ASP 53 N 1.01 0.00 0.00 2.98 9.92 -1.26 -4.81 116.55 124.38 3dll n ASP 53 Ca 0.20 0.00 0.00 0.00 -0.53 0.00 0.00 54.79 54.46 3dll n ASP 53 Cb 0.60 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 41.08 3dll n ASP 53 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3dll n GLY 54 N 0.00 5.33 2.84 0.44 0.00 -1.26 -5.14 105.19 107.40 3dll n GLY 54 Ca 0.00 -0.92 -0.28 0.00 0.00 0.00 0.00 46.02 44.82 3dll n GLY 54 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3dll s ARG 55 N 3.57 1.13 0.00 1.61 3.52 -1.26 -3.85 118.95 123.67 3dll s ARG 55 Ca 0.00 -0.47 0.00 0.00 -0.13 0.00 0.00 55.73 55.13 3dll s ARG 55 Cb 0.00 -1.98 0.00 0.00 -1.56 0.00 0.00 34.95 31.41 3dll s ARG 55 CO 0.00 -0.50 0.00 1.04 -0.81 0.00 0.00 175.30 175.03 3dll n GLN 56 N 4.94 0.00 -2.31 5.12 3.00 -0.11 -4.94 117.38 123.08 3dll n GLN 56 Ca -0.10 0.00 -0.33 0.00 -0.01 0.00 0.00 57.00 56.56 3dll n GLN 56 Cb 0.47 -0.23 -0.02 0.00 0.00 0.00 0.00 30.24 30.46 3dll n GLN 56 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 177.06 177.20 3dll s VAL 57 N 0.00 4.04 0.74 5.09 -7.23 -1.18 -5.00 120.40 116.86 3dll s VAL 57 Ca 0.00 1.06 -0.16 0.00 -1.81 0.00 0.00 61.98 61.07 3dll s VAL 57 Cb 0.00 -3.50 -0.05 0.00 0.56 0.00 0.00 36.38 33.39 3dll s VAL 57 CO 0.00 -0.48 0.40 0.18 -0.31 0.00 0.00 175.10 174.88 3dll n LEU 58 N -1.57 0.03 0.00 1.32 4.32 -1.26 -4.52 117.00 115.32 3dll n LEU 58 Ca 0.08 0.55 0.00 0.00 -0.02 0.00 0.00 56.01 56.62 3dll n LEU 58 Cb 0.53 -1.16 0.00 0.00 -1.62 0.00 0.00 43.42 41.17 3dll n LEU 58 CO 0.44 -3.44 0.00 0.00 -1.22 0.00 0.00 177.39 173.17