#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1y3b s LYS 21 N nan 4.26 0.00 0.00 2.20 -1.26 -4.91 119.74 nan 1y3b s LYS 21 Ca nan 1.97 0.00 0.00 -0.36 0.00 0.00 55.97 nan 1y3b s LYS 21 Cb nan -3.65 0.00 0.00 -1.51 0.00 0.00 37.83 nan 1y3b s LYS 21 CO nan -0.63 0.57 0.25 -0.36 0.00 0.00 175.35 nan 1y3b n THR 22 N 4.86 0.28 -3.94 3.43 -2.24 -1.26 -5.00 114.28 110.41 1y3b n THR 22 Ca 0.14 -0.53 -0.10 0.00 -2.27 0.00 0.00 64.05 61.29 1y3b n THR 22 Cb 0.44 1.00 -0.11 0.00 -2.10 0.00 0.00 70.33 69.56 1y3b n THR 22 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1y3b s GLU 23 N -0.28 0.31 -0.50 -0.78 2.02 -1.26 -1.21 118.70 117.01 1y3b s GLU 23 Ca 0.00 -0.48 0.08 0.00 0.02 0.00 0.00 54.97 54.59 1y3b s GLU 23 Cb 0.00 0.12 0.28 0.00 0.10 0.00 0.00 34.13 34.63 1y3b s GLU 23 CO 0.00 -0.06 0.69 0.91 0.02 0.00 0.00 175.26 176.82 1y3b n TRP 24 N 1.76 1.69 0.29 1.61 8.01 -0.16 -4.94 117.44 125.70 1y3b n TRP 24 Ca -0.22 -3.86 0.16 0.00 -1.31 0.00 0.00 57.50 52.26 1y3b n TRP 24 Cb 0.56 -0.45 0.90 0.00 -2.01 0.00 0.00 31.31 30.31 1y3b n TRP 24 CO 0.00 0.00 0.00 -1.00 -1.01 0.00 0.00 177.69 175.68 1y3b h PRO 25 N 3.76 0.00 0.00 -0.99 0.13 -1.94 -1.17 132.00 131.78 1y3b h PRO 25 Ca 0.13 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.26 1y3b h PRO 25 Cb 0.77 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.90 1y3b h PRO 25 CO 0.64 0.04 0.00 -0.85 -0.23 0.00 0.00 178.00 177.61 1y3b n GLU 26 N -3.58 0.15 0.00 0.86 0.00 -1.26 -2.58 120.64 114.22 1y3b n GLU 26 Ca -0.02 0.43 0.12 0.00 0.00 0.00 0.00 57.16 57.69 1y3b n GLU 26 Cb 0.15 -1.80 0.32 0.00 0.00 0.00 0.00 31.44 30.10 1y3b n GLU 26 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.13 178.41 1y3b n LEU 27 N -2.08 0.51 -4.74 -1.84 4.77 -0.44 -4.83 117.00 108.34 1y3b n LEU 27 Ca 0.02 0.02 -0.42 0.00 -0.03 0.00 0.00 56.01 55.60 1y3b n LEU 27 Cb 0.18 -0.26 -0.02 0.00 -2.33 0.00 0.00 43.42 40.99 1y3b n LEU 27 CO 0.16 0.12 1.20 -0.69 -1.33 0.00 0.00 177.39 176.85 1y3b s VAL 28 N -2.92 2.44 0.00 4.08 1.01 -1.06 -1.41 120.40 122.53 1y3b s VAL 28 Ca 0.14 0.35 0.00 0.00 0.00 0.00 0.00 61.98 62.46 1y3b s VAL 28 Cb 0.18 -3.22 0.00 0.00 0.00 0.00 0.00 36.38 33.34 1y3b s VAL 28 CO 0.65 0.05 0.00 0.61 0.00 0.00 0.00 175.10 176.41 1y3b n GLY 29 N 2.72 1.63 3.92 4.51 0.00 0.03 -4.97 105.19 113.03 1y3b n GLY 29 Ca 0.10 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.85 1y3b n GLY 29 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1y3b s LYS 30 N -0.46 2.88 0.64 1.61 -0.14 -0.50 -4.73 119.74 119.05 1y3b s LYS 30 Ca 0.00 -0.07 -0.17 0.00 -1.36 0.00 0.00 55.97 54.37 1y3b s LYS 30 Cb 0.00 -2.29 -0.01 0.00 -1.68 0.00 0.00 37.83 33.85 1y3b s LYS 30 CO 0.00 -0.70 1.22 -1.54 -0.76 0.00 0.00 175.35 173.57 1y3b s SER 31 N -4.31 4.80 0.43 2.83 1.04 -1.26 -0.30 113.70 116.91 1y3b s SER 31 Ca 0.54 2.41 0.10 0.00 0.48 0.00 0.00 55.95 59.48 1y3b s SER 31 Cb -0.10 -2.60 0.95 0.00 0.10 0.00 0.00 66.02 64.36 1y3b s SER 31 CO 0.44 -1.86 2.03 1.62 0.98 0.00 0.00 173.24 176.46 1y3b h VAL 32 N 0.46 1.02 -0.25 5.02 3.04 -1.39 -1.77 116.25 122.39 1y3b h VAL 32 Ca -0.50 -0.16 -0.01 0.00 -1.01 0.00 0.00 66.70 65.02 1y3b h VAL 32 Cb 1.30 0.51 -0.01 0.00 -2.01 0.00 0.00 31.29 31.08 1y3b h VAL 32 CO 0.53 0.09 0.12 -0.33 -1.01 0.00 0.00 177.57 176.96 1y3b h GLU 33 N 0.47 0.36 -0.43 4.17 3.07 -1.91 -1.19 114.58 119.12 1y3b h GLU 33 Ca 0.19 -0.06 -0.13 0.00 -0.50 0.00 0.00 59.36 58.86 1y3b h GLU 33 Cb 0.17 -0.06 -0.01 0.00 -0.84 0.00 0.00 28.75 28.00 1y3b h GLU 33 CO -0.05 0.37 -0.26 1.49 -1.40 0.00 0.00 179.01 179.17 1y3b h GLU 34 N 0.27 0.92 -0.47 2.33 4.81 -1.85 -2.26 114.58 118.34 1y3b h GLU 34 Ca 0.09 -0.41 0.04 0.00 -0.13 0.00 0.00 59.36 58.95 1y3b h GLU 34 Cb 0.13 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.45 1y3b h GLU 34 CO -0.01 1.06 0.22 0.00 -0.73 0.00 0.00 179.01 179.56 1y3b h ALA 35 N 0.91 0.59 -0.79 2.92 0.00 -1.14 -0.63 119.26 121.12 1y3b h ALA 35 Ca 0.09 0.03 0.02 0.00 0.00 0.00 0.00 54.91 55.05 1y3b h ALA 35 Cb 0.82 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 18.52 1y3b h ALA 35 CO 0.07 -0.14 0.52 0.87 0.00 0.00 0.00 179.25 180.57 1y3b h LYS 36 N 0.44 1.01 -0.16 0.00 1.57 -1.04 -0.37 116.57 118.02 1y3b h LYS 36 Ca 0.21 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.92 1y3b h LYS 36 Cb 0.13 -0.23 -0.01 0.00 0.08 0.00 0.00 32.23 32.21 1y3b h LYS 36 CO -0.16 0.67 0.07 -0.22 -0.57 0.00 0.00 179.45 179.23 1y3b h LYS 37 N 1.04 0.23 -0.29 3.15 3.64 -0.85 -1.31 116.57 122.18 1y3b h LYS 37 Ca 0.30 -0.04 -0.01 0.00 -1.27 0.00 0.00 60.65 59.63 1y3b h LYS 37 Cb -0.07 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 31.70 1y3b h LYS 37 CO -0.08 0.31 0.13 0.28 -2.27 0.00 0.00 179.45 177.81 1y3b h VAL 38 N 0.10 1.16 -0.66 2.00 2.07 -0.91 -2.13 116.25 117.89 1y3b h VAL 38 Ca 0.05 -0.48 -0.08 0.00 0.82 0.00 0.00 66.70 67.01 1y3b h VAL 38 Cb 0.16 0.94 -0.03 0.00 -1.52 0.00 0.00 31.29 30.85 1y3b h VAL 38 CO -0.00 0.17 0.10 0.40 0.02 0.00 0.00 177.57 178.26 1y3b h ILE 39 N 0.33 1.26 0.00 4.57 2.04 -0.96 -1.84 117.51 122.91 1y3b h ILE 39 Ca 0.10 -1.04 -0.01 0.00 1.00 0.00 0.00 64.86 64.90 1y3b h ILE 39 Cb 0.15 0.64 -0.00 0.00 -0.74 0.00 0.00 36.82 36.86 1y3b h ILE 39 CO -0.01 0.39 -0.07 -0.07 0.00 0.00 0.00 178.15 178.39 1y3b h LEU 40 N 1.03 0.00 -0.21 1.44 3.38 -1.12 0.47 115.31 120.30 1y3b h LEU 40 Ca 0.20 0.00 -0.19 0.00 0.09 0.00 0.00 57.88 57.98 1y3b h LEU 40 Cb 0.45 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.20 1y3b h LEU 40 CO 0.01 0.07 -0.61 1.56 0.09 0.00 0.00 178.44 179.56 1y3b h GLN 41 N 0.00 0.78 0.00 1.13 4.20 -0.66 -2.77 115.11 117.79 1y3b h GLN 41 Ca -0.00 -0.56 -0.19 0.00 0.06 0.00 0.00 58.65 57.95 1y3b h GLN 41 Cb 0.41 0.09 -0.03 0.00 0.30 0.00 0.00 27.48 28.26 1y3b h GLN 41 CO 0.01 1.18 -0.92 -0.44 -0.67 0.00 0.00 178.83 177.99 1y3b h ASP 42 N 0.52 0.01 -1.81 1.46 3.32 -0.73 -3.41 116.42 115.79 1y3b h ASP 42 Ca -0.02 -0.01 -0.50 0.00 0.02 0.00 0.00 57.03 56.52 1y3b h ASP 42 Cb 1.23 -0.00 -0.34 0.00 0.22 0.00 0.00 39.33 40.43 1y3b h ASP 42 CO 0.13 0.92 -0.95 1.17 -1.72 0.00 0.00 179.24 178.80 1y3b n LYS 43 N -3.46 0.53 0.28 3.56 4.81 0.16 -4.96 118.16 119.08 1y3b n LYS 43 Ca -0.00 -2.94 0.16 0.00 -0.87 0.00 0.00 58.31 54.66 1y3b n LYS 43 Cb 0.87 -1.41 0.93 0.00 0.02 0.00 0.00 35.03 35.43 1y3b n LYS 43 CO 0.00 0.00 0.00 -1.35 1.17 0.00 0.00 177.40 177.22 1y3b h PRO 44 N 4.62 0.00 -0.29 1.64 0.11 -1.69 -0.78 132.00 135.61 1y3b h PRO 44 Ca 0.11 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.22 1y3b h PRO 44 Cb 0.93 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.04 1y3b h PRO 44 CO 0.38 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.17 1y3b n ALA 45 N -2.29 2.47 -1.75 -0.75 0.00 -1.26 -4.98 120.51 111.95 1y3b n ALA 45 Ca -0.02 -0.66 -0.42 0.00 0.00 0.00 0.00 53.44 52.35 1y3b n ALA 45 Cb 0.15 -1.01 -0.00 0.00 0.00 0.00 0.00 19.45 18.58 1y3b n ALA 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1y3b n ALA 46 N 0.61 2.11 -2.96 0.00 0.00 -0.30 -4.96 120.51 115.01 1y3b n ALA 46 Ca 0.16 0.35 -0.45 0.00 0.00 0.00 0.00 53.44 53.50 1y3b n ALA 46 Cb 0.37 -2.38 -0.06 0.00 0.00 0.00 0.00 19.45 17.37 1y3b n ALA 46 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.50 176.85 1y3b s GLN 47 N -1.82 3.03 -0.12 0.00 -0.21 0.03 -4.97 119.66 115.59 1y3b s GLN 47 Ca 0.55 -1.30 -0.15 0.00 0.02 0.00 0.00 55.36 54.49 1y3b s GLN 47 Cb -0.50 -4.18 -0.05 0.00 1.00 0.00 0.00 33.01 29.28 1y3b s GLN 47 CO 0.61 -1.21 0.34 0.42 -2.12 0.00 0.00 175.29 173.33 1y3b s ILE 48 N 2.05 5.25 -0.09 1.08 1.01 -1.26 -1.35 121.20 127.89 1y3b s ILE 48 Ca 0.08 0.66 0.02 0.00 0.00 0.00 0.00 60.65 61.41 1y3b s ILE 48 Cb -0.24 -3.67 0.01 0.00 0.01 0.00 0.00 42.46 38.57 1y3b s ILE 48 CO 0.07 0.42 -0.15 -0.63 0.00 0.00 0.00 174.94 174.65 1y3b s ILE 49 N 0.18 1.37 -0.21 2.92 1.09 -0.63 -4.98 121.20 120.95 1y3b s ILE 49 Ca 0.20 -0.59 -0.12 0.00 -1.10 0.00 0.00 60.65 59.03 1y3b s ILE 49 Cb -0.14 -1.24 -0.05 0.00 -1.06 0.00 0.00 42.46 39.97 1y3b s ILE 49 CO 0.07 0.41 0.24 -0.69 -0.10 0.00 0.00 174.94 174.87 1y3b s VAL 50 N 0.78 5.31 0.08 2.92 1.01 -1.26 -0.46 120.40 128.78 1y3b s VAL 50 Ca -0.12 0.38 0.03 0.00 0.00 0.00 0.00 61.98 62.28 1y3b s VAL 50 Cb -0.16 -3.58 -0.03 0.00 0.00 0.00 0.00 36.38 32.61 1y3b s VAL 50 CO 0.02 0.34 -0.10 -0.76 0.00 0.00 0.00 175.10 174.60 1y3b s LEU 51 N 0.93 2.35 0.19 3.92 1.43 -0.38 -4.95 118.68 122.17 1y3b s LEU 51 Ca 0.12 -0.72 -0.30 0.00 -1.03 0.00 0.00 54.13 52.20 1y3b s LEU 51 Cb -0.13 -0.28 -0.09 0.00 0.03 0.00 0.00 46.19 45.72 1y3b s LEU 51 CO 0.04 -0.23 1.28 -2.84 0.23 0.00 0.00 176.35 174.83 1y3b s PRO 52 N -2.34 4.41 0.65 1.29 0.02 -1.26 -1.08 135.00 136.68 1y3b s PRO 52 Ca 0.00 2.01 -0.18 0.00 0.02 0.00 0.00 61.00 62.85 1y3b s PRO 52 Cb -0.05 -3.21 -0.02 0.00 0.02 0.00 0.00 34.50 31.24 1y3b s PRO 52 CO 0.00 -0.21 1.22 1.55 -0.33 0.00 0.00 177.00 179.23 1y3b n VAL 53 N 2.60 4.69 -1.04 3.83 3.14 -0.02 -2.97 118.33 128.56 1y3b n VAL 53 Ca 0.06 -0.49 -0.01 0.00 -2.96 0.00 0.00 64.34 60.93 1y3b n VAL 53 Cb 0.43 -1.42 -0.01 0.00 -1.06 0.00 0.00 33.84 31.79 1y3b n VAL 53 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1y3b n GLY 54 N 1.00 0.50 3.97 7.55 0.00 -1.26 -4.97 105.19 111.97 1y3b n GLY 54 Ca 0.16 -0.76 -0.19 0.00 0.00 0.00 0.00 46.02 45.23 1y3b n GLY 54 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1y3b s THR 55 N -2.03 3.45 -0.07 2.61 -4.23 -1.16 -5.12 115.64 109.09 1y3b s THR 55 Ca 0.00 -1.09 -0.06 0.00 -1.18 0.00 0.00 61.69 59.36 1y3b s THR 55 Cb 0.00 -3.18 -0.04 0.00 1.34 0.00 0.00 72.50 70.62 1y3b s THR 55 CO 0.00 -0.08 0.18 -0.63 -0.54 0.00 0.00 174.62 173.55 1y3b s ILE 56 N -2.29 5.43 0.18 2.99 -1.09 -1.26 -5.10 121.20 120.06 1y3b s ILE 56 Ca 0.48 0.15 0.02 0.00 -2.23 0.00 0.00 60.65 59.07 1y3b s ILE 56 Cb -0.08 -3.48 -0.05 0.00 -1.58 0.00 0.00 42.46 37.27 1y3b s ILE 56 CO 0.31 0.51 0.02 0.68 -1.23 0.00 0.00 174.94 175.22 1y3b s VAL 57 N -1.14 0.63 0.72 2.92 -7.23 -1.26 -5.14 120.40 109.90 1y3b s VAL 57 Ca 0.20 -1.98 -0.15 0.00 -1.81 0.00 0.00 61.98 58.24 1y3b s VAL 57 Cb -0.13 -2.17 0.03 0.00 0.56 0.00 0.00 36.38 34.68 1y3b s VAL 57 CO 0.10 -0.42 1.21 0.42 -0.31 0.00 0.00 175.10 176.10 1y3b s THR 58 N -3.69 2.31 -0.42 5.32 -4.23 -1.26 -4.95 115.64 108.73 1y3b s THR 58 Ca 0.25 0.16 0.05 0.00 -1.18 0.00 0.00 61.69 60.97 1y3b s THR 58 Cb 0.06 -2.77 0.52 0.00 1.34 0.00 0.00 72.50 71.66 1y3b s THR 58 CO 0.05 -0.08 1.66 0.23 -0.54 0.00 0.00 174.62 175.94 1y3b n MET 59 N -2.61 2.44 -1.89 3.99 2.81 -1.26 -4.97 117.12 115.63 1y3b n MET 59 Ca 0.14 -3.35 -0.32 0.00 -1.81 0.00 0.00 57.70 52.36 1y3b n MET 59 Cb 0.50 -2.09 0.02 0.00 -0.71 0.00 0.00 33.22 30.94 1y3b n MET 59 CO 0.00 0.00 0.00 -1.54 1.51 0.00 0.00 175.97 175.94 1y3b s SER 60 N -2.28 5.76 -0.21 7.83 1.04 -1.26 -5.05 113.70 119.52 1y3b s SER 60 Ca 0.54 1.68 -0.00 0.00 0.48 0.00 0.00 55.95 58.64 1y3b s SER 60 Cb 0.45 -2.51 0.02 0.00 0.10 0.00 0.00 66.02 64.08 1y3b s SER 60 CO 0.03 -1.19 -0.13 -0.47 0.98 0.00 0.00 173.24 172.46 1y3b s TYR 61 N -2.76 2.91 -0.19 5.02 5.04 -1.26 -5.01 117.35 121.11 1y3b s TYR 61 Ca 0.60 -1.52 0.00 0.00 -2.44 0.00 0.00 57.07 53.71 1y3b s TYR 61 Cb -0.14 -1.99 0.05 0.00 0.35 0.00 0.00 41.96 40.23 1y3b s TYR 61 CO 0.44 -0.74 -0.06 1.03 -1.34 0.00 0.00 175.55 174.88 1y3b s ARG 62 N 1.33 1.62 0.57 4.97 0.52 -0.07 -5.00 118.95 122.89 1y3b s ARG 62 Ca 0.03 -0.69 0.37 0.00 -0.52 0.00 0.00 55.73 54.92 1y3b s ARG 62 Cb -0.14 -2.23 1.71 0.00 0.52 0.00 0.00 34.95 34.80 1y3b s ARG 62 CO -0.09 -0.46 2.10 -0.84 0.02 0.00 0.00 175.30 176.03 1y3b h ILE 63 N 6.43 0.00 0.00 1.52 3.07 -1.94 -1.86 117.51 124.73 1y3b h ILE 63 Ca -0.24 -0.32 0.00 0.00 1.55 0.00 0.00 64.86 65.85 1y3b h ILE 63 Cb 1.10 1.30 0.00 0.00 -0.27 0.00 0.00 36.82 38.95 1y3b h ILE 63 CO 0.42 0.00 -0.41 0.47 -1.05 0.00 0.00 178.15 177.59 1y3b n ASP 64 N -3.03 0.42 -4.88 2.16 8.00 -1.26 -4.67 116.55 113.28 1y3b n ASP 64 Ca -0.01 -0.06 -0.35 0.00 0.71 0.00 0.00 54.79 55.08 1y3b n ASP 64 Cb 0.22 0.09 -0.06 0.00 -0.02 0.00 0.00 41.12 41.35 1y3b n ASP 64 CO 0.00 0.00 0.00 -0.60 -0.39 0.00 0.00 177.20 176.21 1y3b s ARG 65 N -3.02 3.42 -0.19 -1.24 3.52 -0.72 -0.79 118.95 119.93 1y3b s ARG 65 Ca 0.11 -0.22 -0.02 0.00 -0.13 0.00 0.00 55.73 55.47 1y3b s ARG 65 Cb 0.17 -3.14 0.06 0.00 -1.56 0.00 0.00 34.95 30.48 1y3b s ARG 65 CO 0.67 0.73 0.00 0.08 -0.81 0.00 0.00 175.30 175.97 1y3b s VAL 66 N -1.15 0.81 0.13 7.11 1.01 -0.46 -0.98 120.40 126.87 1y3b s VAL 66 Ca 0.20 -0.67 -0.26 0.00 0.00 0.00 0.00 61.98 61.26 1y3b s VAL 66 Cb -0.12 -1.20 -0.07 0.00 0.00 0.00 0.00 36.38 34.99 1y3b s VAL 66 CO 0.10 -0.11 0.79 -0.13 0.00 0.00 0.00 175.10 175.75 1y3b s ARG 67 N 1.73 4.56 -0.23 2.72 0.52 -1.26 -1.60 118.95 125.39 1y3b s ARG 67 Ca -0.01 1.15 -0.01 0.00 -0.52 0.00 0.00 55.73 56.34 1y3b s ARG 67 Cb -0.17 -3.30 0.02 0.00 0.52 0.00 0.00 34.95 32.02 1y3b s ARG 67 CO -0.07 0.46 -0.09 -0.51 0.02 0.00 0.00 175.30 175.11 1y3b s LEU 68 N -0.75 2.96 -0.32 2.53 1.43 0.39 -4.45 118.68 120.48 1y3b s LEU 68 Ca 0.37 -0.82 -0.17 0.00 -1.03 0.00 0.00 54.13 52.48 1y3b s LEU 68 Cb -0.22 -1.62 -0.02 0.00 0.03 0.00 0.00 46.19 44.36 1y3b s LEU 68 CO 0.26 -0.09 0.47 -0.36 0.23 0.00 0.00 176.35 176.85 1y3b s PHE 69 N 1.31 3.21 0.07 0.29 0.08 -1.26 -1.25 117.98 120.43 1y3b s PHE 69 Ca 0.01 0.29 0.04 0.00 0.12 0.00 0.00 56.93 57.39 1y3b s PHE 69 Cb -0.16 -2.79 -0.04 0.00 -0.57 0.00 0.00 43.02 39.47 1y3b s PHE 69 CO -0.06 -0.42 -0.02 0.14 -0.10 0.00 0.00 175.22 174.76 1y3b s VAL 70 N 2.27 3.92 0.82 -0.44 -7.23 -0.24 -0.63 120.40 118.86 1y3b s VAL 70 Ca 0.18 -0.93 -0.14 0.00 -1.81 0.00 0.00 61.98 59.28 1y3b s VAL 70 Cb -0.16 -2.82 0.19 0.00 0.56 0.00 0.00 36.38 34.15 1y3b s VAL 70 CO 0.12 0.20 1.12 -0.90 -0.31 0.00 0.00 175.10 175.32 1y3b n ASP 71 N 0.85 0.09 0.03 4.85 5.68 -0.33 -0.84 116.55 126.87 1y3b n ASP 71 Ca -0.12 -1.41 0.07 0.00 -0.50 0.00 0.00 54.79 52.83 1y3b n ASP 71 Cb 0.52 -0.85 0.30 0.00 -1.14 0.00 0.00 41.12 39.95 1y3b n ASP 71 CO 0.00 0.00 0.00 -2.11 -1.33 0.00 0.00 177.20 173.76 1y3b n ARG 72 N -3.36 0.04 -0.07 0.11 1.85 -1.26 -1.86 116.66 112.11 1y3b n ARG 72 Ca 0.14 0.34 0.12 0.00 -1.00 0.00 0.00 57.85 57.45 1y3b n ARG 72 Cb 0.49 -1.58 0.25 0.00 -1.05 0.00 0.00 32.46 30.56 1y3b n ARG 72 CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 177.63 178.90 1y3b n LEU 73 N -1.65 2.69 -1.34 2.89 4.77 -1.26 -4.96 117.00 118.14 1y3b n LEU 73 Ca 0.02 -1.01 -0.12 0.00 -0.03 0.00 0.00 56.01 54.88 1y3b n LEU 73 Cb 0.14 -0.09 -0.01 0.00 -2.33 0.00 0.00 43.42 41.14 1y3b n LEU 73 CO 0.12 0.51 -0.15 0.47 -1.33 0.00 0.00 177.39 177.00 1y3b n ASP 74 N 1.04 -3.81 -4.88 -1.43 9.92 -0.78 -4.99 116.55 111.63 1y3b n ASP 74 Ca 0.17 -0.00 -0.28 0.00 -0.53 0.00 0.00 54.79 54.14 1y3b n ASP 74 Cb 0.52 -3.01 -0.04 0.00 -0.64 0.00 0.00 41.12 37.95 1y3b n ASP 74 CO 0.00 0.00 0.00 0.20 0.13 0.00 0.00 177.20 177.53 1y3b s ASN 75 N -2.48 6.03 0.11 -2.24 0.01 -1.26 -0.98 114.94 114.13 1y3b s ASN 75 Ca 0.00 0.11 -0.31 0.00 -0.71 0.00 0.00 52.86 51.95 1y3b s ASN 75 Cb 0.00 -1.75 -0.08 0.00 0.41 0.00 0.00 41.25 39.83 1y3b s ASN 75 CO 0.00 0.11 1.45 -0.63 -1.51 0.00 0.00 177.10 176.52 1y3b s ILE 76 N -1.61 3.17 -0.62 0.60 -1.09 0.58 -1.19 121.20 121.05 1y3b s ILE 76 Ca 0.33 0.81 0.06 0.00 -2.23 0.00 0.00 60.65 59.61 1y3b s ILE 76 Cb -0.12 -3.52 0.02 0.00 -1.58 0.00 0.00 42.46 37.27 1y3b s ILE 76 CO 0.26 0.05 0.57 0.00 -1.23 0.00 0.00 174.94 174.59 1y3b n ALA 77 N 4.21 2.54 -3.02 9.38 0.00 0.20 -0.79 120.51 133.02 1y3b n ALA 77 Ca 0.12 -0.45 -0.11 0.00 0.00 0.00 0.00 53.44 53.00 1y3b n ALA 77 Cb 0.41 -0.20 -0.09 0.00 0.00 0.00 0.00 19.45 19.58 1y3b n ALA 77 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 177.50 176.36 1y3b s GLN 78 N -0.74 0.62 -0.01 0.00 0.74 -1.25 -4.99 119.66 114.04 1y3b s GLN 78 Ca 0.06 -0.46 -0.30 0.00 0.05 0.00 0.00 55.36 54.71 1y3b s GLN 78 Cb 0.05 0.26 -0.07 0.00 1.10 0.00 0.00 33.01 34.35 1y3b s GLN 78 CO 0.11 -0.17 1.76 0.08 -0.55 0.00 0.00 175.29 176.52 1y3b s VAL 79 N -1.91 3.31 0.35 1.34 1.01 -1.26 -4.73 120.40 118.51 1y3b s VAL 79 Ca -0.10 0.44 -0.28 0.00 0.00 0.00 0.00 61.98 62.04 1y3b s VAL 79 Cb -0.04 -3.29 -0.10 0.00 0.00 0.00 0.00 36.38 32.95 1y3b s VAL 79 CO -0.00 -0.03 1.31 -2.84 0.00 0.00 0.00 175.10 173.54 1y3b s PRO 80 N 3.99 4.25 0.06 2.72 0.02 -1.26 -4.88 135.00 139.89 1y3b s PRO 80 Ca 0.79 2.22 -0.10 0.00 0.02 0.00 0.00 61.00 63.92 1y3b s PRO 80 Cb -0.37 -2.99 0.00 0.00 0.02 0.00 0.00 34.50 31.16 1y3b s PRO 80 CO 0.34 -0.27 0.21 -0.98 -0.33 0.00 0.00 177.00 175.97 1y3b s ARG 81 N -1.92 0.76 0.55 5.54 1.70 -1.26 -0.99 118.95 123.33 1y3b s ARG 81 Ca 0.51 -0.71 -0.20 0.00 -0.47 0.00 0.00 55.73 54.86 1y3b s ARG 81 Cb -0.40 0.31 -0.05 0.00 -0.57 0.00 0.00 34.95 34.25 1y3b s ARG 81 CO 0.52 -0.23 1.23 0.14 -1.08 0.00 0.00 175.30 175.88 1y3b s VAL 82 N -2.95 2.65 0.00 4.99 -7.23 -0.35 -4.14 120.40 113.36 1y3b s VAL 82 Ca -0.02 0.44 0.00 0.00 -1.81 0.00 0.00 61.98 60.59 1y3b s VAL 82 Cb 0.01 -3.20 0.00 0.00 0.56 0.00 0.00 36.38 33.75 1y3b s VAL 82 CO -0.06 -0.05 0.00 0.61 -0.31 0.00 0.00 175.10 175.29