#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1bnd n GLN 9 N 0.00 0.69 -3.64 1.61 6.02 -1.26 -5.15 117.38 115.65 1bnd n GLN 9 Ca 0.00 -0.70 -0.06 0.00 -0.01 0.00 0.00 57.00 56.23 1bnd n GLN 9 Cb 0.00 -0.11 -0.07 0.00 1.02 0.00 0.00 30.24 31.09 1bnd n GLN 9 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 177.06 174.88 1bnd s LEU 10 N 0.00 -0.49 0.46 1.08 2.96 -1.26 -5.16 118.68 116.27 1bnd s LEU 10 Ca 0.15 0.87 -0.23 0.00 -0.22 0.00 0.00 54.13 54.70 1bnd s LEU 10 Cb -0.01 1.85 -0.07 0.00 0.50 0.00 0.00 46.19 48.45 1bnd s LEU 10 CO 0.10 -0.14 1.17 -0.94 -1.32 0.00 0.00 176.35 175.21 1bnd s SER 11 N 0.71 6.15 0.36 3.68 1.04 -1.26 -4.94 113.70 119.44 1bnd s SER 11 Ca -0.02 2.32 0.18 0.00 0.48 0.00 0.00 55.95 58.91 1bnd s SER 11 Cb -0.04 -2.60 0.57 0.00 0.10 0.00 0.00 66.02 64.04 1bnd s SER 11 CO -0.10 -0.93 1.68 0.58 0.98 0.00 0.00 173.24 175.44 1bnd h VAL 12 N 1.86 0.86 -3.83 5.02 2.07 -1.97 -3.44 116.25 116.82 1bnd h VAL 12 Ca -0.49 -1.65 -0.38 0.00 0.82 0.00 0.00 66.70 64.99 1bnd h VAL 12 Cb 1.25 2.03 -0.30 0.00 -1.52 0.00 0.00 31.29 32.74 1bnd h VAL 12 CO 0.60 0.39 -0.77 0.00 0.02 0.00 0.00 177.57 177.81 1bnd s ASP 14 N 0.14 7.06 0.25 0.00 1.01 -1.26 -5.00 116.67 118.87 1bnd s ASP 14 Ca -0.02 1.31 0.08 0.00 0.71 0.00 0.00 52.55 54.64 1bnd s ASP 14 Cb -0.07 -2.50 -0.05 0.00 1.01 0.00 0.00 42.92 41.31 1bnd s ASP 14 CO -0.00 -0.48 -0.12 -0.94 0.21 0.00 0.00 175.17 173.85 1bnd s SER 15 N 1.16 2.83 -0.01 0.27 1.04 -1.26 0.44 113.70 118.18 1bnd s SER 15 Ca 0.42 -1.10 0.01 0.00 0.48 0.00 0.00 55.95 55.76 1bnd s SER 15 Cb -0.17 -0.18 0.00 0.00 0.10 0.00 0.00 66.02 65.78 1bnd s SER 15 CO 0.12 -0.21 -0.02 0.27 0.98 0.00 0.00 173.24 174.38 1bnd s ILE 16 N -2.91 0.21 0.28 -1.02 -4.36 -0.44 -4.67 121.20 108.29 1bnd s ILE 16 Ca 0.27 -0.09 0.07 0.00 -0.26 0.00 0.00 60.65 60.64 1bnd s ILE 16 Cb 0.01 -0.20 -0.03 0.00 1.25 0.00 0.00 42.46 43.48 1bnd s ILE 16 CO 0.10 0.07 0.24 -0.44 0.24 0.00 0.00 174.94 175.16 1bnd s SER 17 N 0.09 5.52 -0.16 4.36 0.01 -1.26 -1.52 113.70 120.74 1bnd s SER 17 Ca -0.01 -0.30 -0.28 0.00 1.31 0.00 0.00 55.95 56.67 1bnd s SER 17 Cb -0.03 -1.30 0.09 0.00 0.21 0.00 0.00 66.02 64.98 1bnd s SER 17 CO -0.00 -0.14 0.80 -0.70 0.41 0.00 0.00 173.24 173.60 1bnd s GLU 18 N -3.91 0.84 -0.08 12.44 2.12 0.14 -4.97 118.70 125.28 1bnd s GLU 18 Ca 0.36 0.49 -0.23 0.00 0.36 0.00 0.00 54.97 55.95 1bnd s GLU 18 Cb -0.07 0.40 -0.03 0.00 0.26 0.00 0.00 34.13 34.68 1bnd s GLU 18 CO 0.26 -0.20 0.70 -1.58 -0.54 0.00 0.00 175.26 173.89 1bnd s TRP 19 N -0.54 3.56 -0.10 5.30 0.52 -1.26 -0.59 118.94 125.83 1bnd s TRP 19 Ca -0.04 1.22 0.01 0.00 0.02 0.00 0.00 56.10 57.31 1bnd s TRP 19 Cb -0.02 -2.81 0.02 0.00 -1.15 0.00 0.00 33.47 29.51 1bnd s TRP 19 CO 0.04 0.06 -0.11 0.08 0.02 0.00 0.00 176.95 177.03 1bnd s VAL 20 N 0.93 1.20 0.43 4.03 1.01 0.87 -4.96 120.40 123.91 1bnd s VAL 20 Ca 0.37 -0.46 -0.02 0.00 0.00 0.00 0.00 61.98 61.86 1bnd s VAL 20 Cb -0.17 -1.14 -0.03 0.00 0.00 0.00 0.00 36.38 35.04 1bnd s VAL 20 CO 0.17 0.38 0.69 0.42 0.00 0.00 0.00 175.10 176.76 1bnd s THR 21 N 1.15 4.84 0.57 3.92 -4.23 -1.26 -0.16 115.64 120.47 1bnd s THR 21 Ca -0.05 -0.14 0.28 0.00 -1.18 0.00 0.00 61.69 60.60 1bnd s THR 21 Cb -0.14 -3.81 0.34 0.00 1.34 0.00 0.00 72.50 70.23 1bnd s THR 21 CO -0.03 -0.67 2.23 0.00 -0.54 0.00 0.00 174.62 175.62 1bnd h ALA 22 N 0.43 1.57 -0.44 3.99 0.00 -1.59 -0.13 119.26 123.08 1bnd h ALA 22 Ca -0.48 -0.01 -0.12 0.00 0.00 0.00 0.00 54.91 54.30 1bnd h ALA 22 Cb 1.22 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 1bnd h ALA 22 CO 0.61 0.01 -0.22 0.00 0.00 0.00 0.00 179.25 179.66 1bnd h ALA 23 N 1.99 0.78 -0.05 0.00 0.00 -1.87 0.11 119.26 120.21 1bnd h ALA 23 Ca -0.00 -0.38 -0.23 0.00 0.00 0.00 0.00 54.91 54.30 1bnd h ALA 23 Cb 0.03 -0.16 0.01 0.00 0.00 0.00 0.00 17.79 17.66 1bnd h ALA 23 CO 0.00 0.66 -0.89 -0.44 0.00 0.00 0.00 179.25 178.57 1bnd h ASP 24 N 0.78 0.74 0.54 0.00 3.32 -1.45 -3.38 116.42 116.98 1bnd h ASP 24 Ca 0.10 -0.55 -0.03 0.00 0.02 0.00 0.00 57.03 56.58 1bnd h ASP 24 Cb 0.77 -0.22 0.01 0.00 0.22 0.00 0.00 39.33 40.10 1bnd h ASP 24 CO 0.06 1.34 -0.26 0.50 -1.72 0.00 0.00 179.24 179.16 1bnd h LYS 25 N 0.37 -0.70 0.00 3.56 3.64 -0.97 -3.48 116.57 118.98 1bnd h LYS 25 Ca -0.08 0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1bnd h LYS 25 Cb 1.52 0.16 0.00 0.00 -0.41 0.00 0.00 32.23 33.50 1bnd h LYS 25 CO 0.17 -0.47 0.00 1.63 -2.27 0.00 0.00 179.45 178.51 1bnd n LYS 26 N -5.26 0.00 -4.44 1.90 4.76 0.36 -4.85 118.16 110.64 1bnd n LYS 26 Ca -0.09 0.00 -0.22 0.00 -2.87 0.00 0.00 58.31 55.13 1bnd n LYS 26 Cb 0.29 0.00 -0.10 0.00 -1.84 0.00 0.00 35.03 33.38 1bnd n LYS 26 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 1bnd s THR 27 N 0.00 1.98 0.24 -0.18 -4.23 -1.26 -0.75 115.64 111.44 1bnd s THR 27 Ca 0.00 -2.23 -0.22 0.00 -1.18 0.00 0.00 61.69 58.06 1bnd s THR 27 Cb 0.00 -2.35 0.03 0.00 1.34 0.00 0.00 72.50 71.52 1bnd s THR 27 CO 0.00 -0.38 0.73 0.00 -0.54 0.00 0.00 174.62 174.43 1bnd s ALA 28 N -2.81 -1.34 -0.15 3.99 0.00 -0.33 -4.88 121.76 116.24 1bnd s ALA 28 Ca 0.28 -0.11 -0.04 0.00 0.00 0.00 0.00 51.96 52.09 1bnd s ALA 28 Cb 0.00 0.83 -0.03 0.00 0.00 0.00 0.00 23.12 23.92 1bnd s ALA 28 CO 0.12 -0.99 0.00 0.14 0.00 0.00 0.00 175.76 175.04 1bnd s VAL 29 N -3.81 4.28 0.68 0.00 -7.23 -1.26 0.35 120.40 113.41 1bnd s VAL 29 Ca 0.09 -0.23 -0.07 0.00 -1.81 0.00 0.00 61.98 59.97 1bnd s VAL 29 Cb -0.05 -2.88 0.15 0.00 0.56 0.00 0.00 36.38 34.16 1bnd s VAL 29 CO 0.03 0.51 0.92 -0.90 -0.31 0.00 0.00 175.10 175.36 1bnd n ASP 30 N 3.19 0.58 0.00 4.85 5.75 0.54 -1.92 116.55 129.55 1bnd n ASP 30 Ca -0.17 -1.65 0.06 0.00 -0.01 0.00 0.00 54.79 53.01 1bnd n ASP 30 Cb 0.53 -0.66 0.33 0.00 -1.03 0.00 0.00 41.12 40.29 1bnd n ASP 30 CO 0.00 0.00 0.00 0.80 -0.11 0.00 0.00 177.20 177.89 1bnd n MET 31 N -2.85 0.38 -0.00 0.11 0.00 -0.40 -1.95 117.12 112.40 1bnd n MET 31 Ca 0.13 0.00 0.04 0.00 -0.00 0.00 0.00 57.70 57.87 1bnd n MET 31 Cb 0.46 -1.46 -0.05 0.00 0.00 0.00 0.00 33.22 32.17 1bnd n MET 31 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 175.97 176.40 1bnd n SER 32 N -0.96 0.55 0.00 6.12 7.64 -1.26 -4.99 113.62 120.71 1bnd n SER 32 Ca 0.08 -0.66 0.00 0.00 1.01 0.00 0.00 58.87 59.30 1bnd n SER 32 Cb 0.04 1.02 0.00 0.00 -1.01 0.00 0.00 64.21 64.26 1bnd n SER 32 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1bnd n GLY 33 N 1.25 2.20 3.77 0.23 0.00 -0.82 -5.07 105.19 106.75 1bnd n GLY 33 Ca 0.01 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.65 1bnd n GLY 33 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1bnd s GLY 34 N -2.38 2.94 0.01 -0.02 0.00 -1.26 -4.74 107.32 101.87 1bnd s GLY 34 Ca 0.00 0.77 -0.29 0.00 0.00 0.00 0.00 44.72 45.20 1bnd s GLY 34 CO 0.00 1.30 0.95 -1.59 0.00 0.00 0.00 173.10 173.76 1bnd s THR 35 N -1.36 4.83 0.02 0.90 2.01 -1.26 -0.34 115.64 120.44 1bnd s THR 35 Ca 0.49 2.01 0.04 0.00 0.31 0.00 0.00 61.69 64.54 1bnd s THR 35 Cb -0.27 -4.30 -0.02 0.00 0.01 0.00 0.00 72.50 67.93 1bnd s THR 35 CO 0.34 0.19 -0.13 0.54 -0.69 0.00 0.00 174.62 174.88 1bnd s VAL 36 N 0.82 1.02 -0.09 3.82 0.11 0.16 -4.34 120.40 121.89 1bnd s VAL 36 Ca 0.50 -0.84 -0.17 0.00 -2.93 0.00 0.00 61.98 58.55 1bnd s VAL 36 Cb -0.21 -0.91 -0.05 0.00 -1.53 0.00 0.00 36.38 33.68 1bnd s VAL 36 CO 0.27 0.07 0.43 0.42 -3.33 0.00 0.00 175.10 172.97 1bnd s THR 37 N -0.68 5.16 -0.26 5.04 -4.23 -0.04 -1.19 115.64 119.43 1bnd s THR 37 Ca 0.02 0.87 -0.22 0.00 -1.18 0.00 0.00 61.69 61.18 1bnd s THR 37 Cb -0.07 -3.76 -0.01 0.00 1.34 0.00 0.00 72.50 69.99 1bnd s THR 37 CO 0.01 0.40 0.69 -0.69 -0.54 0.00 0.00 174.62 174.49 1bnd s VAL 38 N 0.15 4.93 0.30 2.29 1.01 0.07 -1.15 120.40 128.00 1bnd s VAL 38 Ca 0.24 1.20 -0.29 0.00 0.00 0.00 0.00 61.98 63.13 1bnd s VAL 38 Cb -0.15 -4.00 -0.10 0.00 0.00 0.00 0.00 36.38 32.12 1bnd s VAL 38 CO 0.10 -0.04 1.28 -0.76 0.00 0.00 0.00 175.10 175.68 1bnd s LEU 39 N 2.64 4.44 0.26 3.92 1.02 -1.13 -4.71 118.68 125.12 1bnd s LEU 39 Ca 0.29 2.59 0.04 0.00 0.02 0.00 0.00 54.13 57.07 1bnd s LEU 39 Cb -0.15 -3.64 0.33 0.00 0.02 0.00 0.00 46.19 42.74 1bnd s LEU 39 CO 0.09 -0.48 1.62 -0.33 0.02 0.00 0.00 176.35 177.27 1bnd h GLU 40 N 3.77 0.31 -4.22 1.70 5.08 -1.91 -3.42 114.58 115.88 1bnd h GLU 40 Ca -0.48 -0.17 -0.28 0.00 -1.00 0.00 0.00 59.36 57.43 1bnd h GLU 40 Cb 1.22 0.01 -0.26 0.00 0.50 0.00 0.00 28.75 30.22 1bnd h GLU 40 CO 0.68 0.73 -0.74 0.15 -1.00 0.00 0.00 179.01 178.83 1bnd s LYS 41 N -4.01 0.35 -0.12 2.33 1.02 -1.26 -0.05 119.74 117.99 1bnd s LYS 41 Ca -0.05 -0.31 0.01 0.00 0.02 0.00 0.00 55.97 55.64 1bnd s LYS 41 Cb 0.13 -0.26 -0.01 0.00 -0.52 0.00 0.00 37.83 37.17 1bnd s LYS 41 CO 0.79 0.06 -0.16 0.54 -0.92 0.00 0.00 175.35 175.66 1bnd s VAL 42 N -0.49 2.75 -0.08 3.17 0.11 -0.27 -4.88 120.40 120.71 1bnd s VAL 42 Ca -0.03 -0.77 -0.30 0.00 -2.93 0.00 0.00 61.98 57.96 1bnd s VAL 42 Cb -0.04 -2.13 -0.04 0.00 -1.53 0.00 0.00 36.38 32.63 1bnd s VAL 42 CO -0.00 0.53 1.56 -2.84 -3.33 0.00 0.00 175.10 171.02 1bnd s PRO 43 N 0.38 4.19 0.00 1.54 0.02 -1.26 -1.49 135.00 138.39 1bnd s PRO 43 Ca -0.13 2.05 0.00 0.00 0.02 0.00 0.00 61.00 62.95 1bnd s PRO 43 Cb -0.16 -3.93 0.00 0.00 0.02 0.00 0.00 34.50 30.42 1bnd s PRO 43 CO 0.06 -0.82 0.00 1.33 -0.33 0.00 0.00 177.00 177.24 1bnd n VAL 44 N 5.47 0.00 0.12 3.83 0.24 0.82 -4.99 118.33 123.82 1bnd n VAL 44 Ca 0.16 0.00 -0.05 0.00 -2.04 0.00 0.00 64.34 62.41 1bnd n VAL 44 Cb 0.43 -0.16 -0.03 0.00 -1.47 0.00 0.00 33.84 32.61 1bnd n VAL 44 CO 0.00 0.00 0.00 0.77 -2.14 0.00 0.00 176.83 175.46 1bnd h SER 45 N 0.00 -0.33 0.00 -1.34 4.64 -1.98 -3.37 113.55 111.17 1bnd h SER 45 Ca 0.00 0.02 0.00 0.00 -0.47 0.00 0.00 61.79 61.34 1bnd h SER 45 Cb 0.00 0.09 0.00 0.00 -0.31 0.00 0.00 62.40 62.18 1bnd h SER 45 CO 0.00 -0.20 0.00 1.17 -0.87 0.00 0.00 176.83 176.93 1bnd n LYS 46 N -3.02 0.00 0.00 4.77 0.00 -1.26 -5.00 118.16 113.65 1bnd n LYS 46 Ca -0.04 0.48 0.00 0.00 0.00 0.00 0.00 58.31 58.75 1bnd n LYS 46 Cb 0.14 -1.41 0.00 0.00 0.00 0.00 0.00 35.03 33.76 1bnd n LYS 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1bnd n GLY 47 N -0.56 4.44 3.90 3.14 0.00 -1.26 -5.16 105.19 109.69 1bnd n GLY 47 Ca 0.00 -0.56 -0.21 0.00 0.00 0.00 0.00 46.02 45.25 1bnd n GLY 47 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1bnd s GLN 48 N 3.41 3.04 -0.11 1.61 -1.52 -1.26 -0.12 119.66 124.70 1bnd s GLN 48 Ca 0.00 -1.04 -0.02 0.00 -1.95 0.00 0.00 55.36 52.36 1bnd s GLN 48 Cb 0.00 -2.67 0.04 0.00 -0.22 0.00 0.00 33.01 30.16 1bnd s GLN 48 CO 0.00 0.27 0.02 -0.51 -0.25 0.00 0.00 175.29 174.81 1bnd s LEU 49 N -3.98 0.71 0.20 2.90 1.43 -0.55 -4.85 118.68 114.54 1bnd s LEU 49 Ca 0.37 -0.29 -0.31 0.00 -1.03 0.00 0.00 54.13 52.87 1bnd s LEU 49 Cb -0.08 -0.46 -0.10 0.00 0.03 0.00 0.00 46.19 45.58 1bnd s LEU 49 CO 0.27 -0.23 1.50 -0.75 0.23 0.00 0.00 176.35 177.38 1bnd s LYS 50 N 1.96 4.24 -0.33 1.70 2.20 -1.26 -1.11 119.74 127.13 1bnd s LYS 50 Ca 0.03 2.33 -0.21 0.00 -0.36 0.00 0.00 55.97 57.76 1bnd s LYS 50 Cb -0.14 -3.14 -0.00 0.00 -1.51 0.00 0.00 37.83 33.05 1bnd s LYS 50 CO -0.06 -0.52 0.67 -1.14 -0.36 0.00 0.00 175.35 173.95 1bnd s GLN 51 N 0.43 3.80 0.18 4.03 0.74 0.93 -4.91 119.66 124.86 1bnd s GLN 51 Ca 0.65 0.24 -0.02 0.00 0.05 0.00 0.00 55.36 56.27 1bnd s GLN 51 Cb -0.43 -3.77 -0.04 0.00 1.10 0.00 0.00 33.01 29.88 1bnd s GLN 51 CO 0.37 -0.69 0.15 1.52 -0.55 0.00 0.00 175.29 176.08 1bnd s TYR 52 N 2.77 0.98 0.08 1.67 1.13 -1.26 -1.54 117.35 121.17 1bnd s TYR 52 Ca 0.27 -1.26 0.04 0.00 -1.41 0.00 0.00 57.07 54.71 1bnd s TYR 52 Cb -0.14 -0.45 -0.03 0.00 -1.10 0.00 0.00 41.96 40.23 1bnd s TYR 52 CO 0.14 -0.64 -0.11 -0.06 -2.51 0.00 0.00 175.55 172.36 1bnd s PHE 53 N -4.11 1.08 -0.29 -3.49 0.08 0.78 -4.96 117.98 107.07 1bnd s PHE 53 Ca 0.33 -0.56 -0.08 0.00 0.12 0.00 0.00 56.93 56.74 1bnd s PHE 53 Cb 0.06 -0.60 -0.01 0.00 -0.57 0.00 0.00 43.02 41.91 1bnd s PHE 53 CO 0.09 0.02 0.10 -0.47 -0.10 0.00 0.00 175.22 174.86 1bnd s TYR 54 N -1.85 3.14 -0.01 0.36 5.04 -1.26 -0.09 117.35 122.68 1bnd s TYR 54 Ca 0.01 -0.68 0.08 0.00 -2.44 0.00 0.00 57.07 54.04 1bnd s TYR 54 Cb -0.07 -2.29 -0.02 0.00 0.35 0.00 0.00 41.96 39.93 1bnd s TYR 54 CO 0.01 -0.47 -0.25 -1.21 -1.34 0.00 0.00 175.55 172.28 1bnd s GLU 55 N 1.57 2.00 0.01 4.97 2.02 0.24 -4.90 118.70 124.61 1bnd s GLU 55 Ca 0.04 -0.94 0.07 0.00 0.02 0.00 0.00 54.97 54.17 1bnd s GLU 55 Cb -0.17 -1.97 -0.02 0.00 0.10 0.00 0.00 34.13 32.07 1bnd s GLU 55 CO 0.04 0.54 -0.23 0.99 0.02 0.00 0.00 175.26 176.62 1bnd s THR 56 N -0.63 1.81 0.22 3.63 2.01 -0.93 0.23 115.64 121.97 1bnd s THR 56 Ca 0.10 -1.11 -0.14 0.00 0.31 0.00 0.00 61.69 60.86 1bnd s THR 56 Cb -0.10 -1.53 0.00 0.00 0.01 0.00 0.00 72.50 70.89 1bnd s THR 56 CO -0.00 0.39 0.46 -1.59 -0.69 0.00 0.00 174.62 173.19 1bnd s LYS 57 N -0.85 1.43 0.17 4.92 -2.85 -0.57 -2.78 119.74 119.22 1bnd s LYS 57 Ca 0.09 -1.12 -0.32 0.00 -1.00 0.00 0.00 55.97 53.62 1bnd s LYS 57 Cb -0.09 0.47 -0.11 0.00 -2.06 0.00 0.00 37.83 36.05 1bnd s LYS 57 CO 0.00 -0.59 1.63 0.00 0.10 0.00 0.00 175.35 176.50 1bnd s ASN 59 N 1.26 6.06 0.59 0.00 3.84 0.17 -4.77 114.94 122.09 1bnd s ASN 59 Ca 0.72 1.51 0.34 0.00 0.21 0.00 0.00 52.86 55.64 1bnd s ASN 59 Cb -0.46 -2.53 1.86 0.00 -0.55 0.00 0.00 41.25 39.58 1bnd s ASN 59 CO 0.32 -1.54 2.22 1.55 -2.79 0.00 0.00 177.10 176.85 1bnd h PRO 60 N 12.17 0.00 -0.57 0.43 0.13 -1.90 -2.54 132.00 139.72 1bnd h PRO 60 Ca -0.35 0.00 -0.39 0.00 -0.87 0.00 0.00 66.00 64.39 1bnd h PRO 60 Cb 1.17 0.00 -0.27 0.00 0.13 0.00 0.00 31.00 32.03 1bnd h PRO 60 CO 1.01 0.04 -0.38 -1.33 -0.23 0.00 0.00 178.00 177.11 1bnd n MET 61 N -3.49 2.75 -2.80 0.86 2.81 -1.26 -4.88 117.12 111.12 1bnd n MET 61 Ca -0.02 -3.69 -0.20 0.00 -1.81 0.00 0.00 57.70 51.97 1bnd n MET 61 Cb 0.14 -2.07 0.04 0.00 -0.71 0.00 0.00 33.22 30.63 1bnd n MET 61 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 1bnd s GLY 62 N -3.07 1.84 0.29 3.03 0.00 -0.96 -5.01 107.32 103.44 1bnd s GLY 62 Ca 0.49 -1.61 0.01 0.00 0.00 0.00 0.00 44.72 43.62 1bnd s GLY 62 CO 0.00 -1.29 1.77 -0.97 0.00 0.00 0.00 173.10 172.62 1bnd h TYR 63 N 0.16 0.64 0.00 1.90 -1.99 -1.94 -3.16 116.97 112.57 1bnd h TYR 63 Ca -0.39 -0.10 0.00 0.00 2.00 0.00 0.00 58.73 60.24 1bnd h TYR 63 Cb 1.29 -0.17 0.00 0.00 2.00 0.00 0.00 36.73 39.85 1bnd h TYR 63 CO 0.30 0.68 0.00 0.25 -0.00 0.00 0.00 178.16 179.39 1bnd n THR 64 N -4.19 1.78 0.68 -2.88 -2.24 -1.26 -4.37 114.28 101.79 1bnd n THR 64 Ca 0.01 -0.44 0.13 0.00 -2.27 0.00 0.00 64.05 61.48 1bnd n THR 64 Cb 0.33 -1.43 0.36 0.00 -2.10 0.00 0.00 70.33 67.49 1bnd n THR 64 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 1bnd n LYS 65 N 1.50 0.22 -0.00 -0.78 4.81 -1.20 -4.17 118.16 118.54 1bnd n LYS 65 Ca 0.00 0.14 0.01 0.00 -0.87 0.00 0.00 58.31 57.60 1bnd n LYS 65 Cb 0.45 -1.72 -0.02 0.00 0.02 0.00 0.00 35.03 33.76 1bnd n LYS 65 CO 0.00 0.00 0.00 -0.85 1.17 0.00 0.00 177.40 177.72 1bnd n GLU 66 N -2.09 0.27 -3.59 1.64 0.28 -1.26 -4.96 120.64 110.93 1bnd n GLU 66 Ca 0.05 -0.03 -0.05 0.00 -0.16 0.00 0.00 57.16 56.98 1bnd n GLU 66 Cb 0.42 -1.08 -0.02 0.00 1.43 0.00 0.00 31.44 32.19 1bnd n GLU 66 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 177.13 177.17 1bnd s GLY 67 N -2.42 -0.30 0.80 -1.84 0.00 -1.26 -4.78 107.32 97.52 1bnd s GLY 67 Ca -0.01 1.58 -0.11 0.00 0.00 0.00 0.00 44.72 46.18 1bnd s GLY 67 CO 0.13 0.53 1.10 0.00 0.00 0.00 0.00 173.10 174.86 1bnd s ARG 69 N -5.17 4.33 0.00 0.00 3.52 -0.35 -4.05 118.95 117.23 1bnd s ARG 69 Ca 0.61 0.62 0.00 0.00 -0.13 0.00 0.00 55.73 56.83 1bnd s ARG 69 Cb -0.14 -3.40 0.00 0.00 -1.56 0.00 0.00 34.95 29.85 1bnd s ARG 69 CO 0.54 0.24 0.00 0.41 -0.81 0.00 0.00 175.30 175.68 1bnd n GLY 70 N 2.89 0.64 3.70 8.12 0.00 -1.26 -4.70 105.19 114.59 1bnd n GLY 70 Ca -0.06 -0.68 -0.39 0.00 0.00 0.00 0.00 46.02 44.89 1bnd n GLY 70 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1bnd s ILE 71 N -2.00 5.09 -1.12 -0.61 -1.09 -1.26 -4.97 121.20 115.24 1bnd s ILE 71 Ca 0.00 1.19 -0.24 0.00 -2.23 0.00 0.00 60.65 59.37 1bnd s ILE 71 Cb 0.00 -3.93 -0.13 0.00 -1.58 0.00 0.00 42.46 36.81 1bnd s ILE 71 CO 0.00 0.24 2.01 -0.62 -1.23 0.00 0.00 174.94 175.34 1bnd s ASP 72 N 0.85 4.46 0.34 3.58 -1.08 -1.26 -4.74 116.67 118.83 1bnd s ASP 72 Ca 0.31 -1.31 0.17 0.00 -0.52 0.00 0.00 52.55 51.19 1bnd s ASP 72 Cb -0.16 -2.59 0.90 0.00 -1.46 0.00 0.00 42.92 39.61 1bnd s ASP 72 CO 0.13 -3.65 1.44 0.11 0.52 0.00 0.00 175.17 173.72 1bnd h LYS 73 N 10.55 0.00 0.79 4.34 1.57 -1.94 -1.59 116.57 130.29 1bnd h LYS 73 Ca 0.13 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.88 1bnd h LYS 73 Cb 0.96 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.28 1bnd h LYS 73 CO 1.15 0.00 -0.38 0.00 -0.57 0.00 0.00 179.45 179.65 1bnd h ARG 74 N 0.00 -1.02 -0.01 3.15 3.08 -2.04 -3.32 114.38 114.22 1bnd h ARG 74 Ca 0.00 0.07 0.00 0.00 0.07 0.00 0.00 59.98 60.12 1bnd h ARG 74 Cb 0.43 0.23 0.00 0.00 0.08 0.00 0.00 29.97 30.71 1bnd h ARG 74 CO 0.00 -0.67 -0.31 0.72 -1.07 0.00 0.00 179.97 178.64 1bnd n HIS 75 N -5.48 0.00 -4.21 3.04 8.25 -0.96 -4.88 115.22 110.98 1bnd n HIS 75 Ca -0.13 0.00 -0.16 0.00 -0.26 0.00 0.00 57.72 57.16 1bnd n HIS 75 Cb 0.42 -0.06 -0.13 0.00 1.12 0.00 0.00 29.99 31.34 1bnd n HIS 75 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 1bnd s TRP 76 N -2.43 0.78 0.04 4.41 0.52 -0.64 -2.55 118.94 119.07 1bnd s TRP 76 Ca 0.23 -0.30 0.02 0.00 0.02 0.00 0.00 56.10 56.08 1bnd s TRP 76 Cb 0.19 -0.48 -0.04 0.00 -1.15 0.00 0.00 33.47 31.99 1bnd s TRP 76 CO 0.51 -0.02 0.03 -0.80 0.02 0.00 0.00 176.95 176.69 1bnd s ASN 77 N -0.87 5.29 0.24 2.95 0.01 -0.76 -4.37 114.94 117.44 1bnd s ASN 77 Ca -0.02 -0.02 -0.04 0.00 -0.71 0.00 0.00 52.86 52.07 1bnd s ASN 77 Cb -0.06 -1.39 -0.02 0.00 0.41 0.00 0.00 41.25 40.18 1bnd s ASN 77 CO 0.00 0.23 0.30 -0.94 -1.51 0.00 0.00 177.10 175.19 1bnd s SER 78 N -1.94 0.29 -0.29 -1.22 1.04 -1.26 -1.82 113.70 108.50 1bnd s SER 78 Ca 0.24 -1.28 -0.23 0.00 0.48 0.00 0.00 55.95 55.16 1bnd s SER 78 Cb -0.12 0.50 0.16 0.00 0.10 0.00 0.00 66.02 66.66 1bnd s SER 78 CO 0.15 -1.01 1.19 -1.58 0.98 0.00 0.00 173.24 172.96 1bnd s GLN 79 N -3.92 0.29 -0.05 4.02 0.74 -0.09 -4.46 119.66 116.19 1bnd s GLN 79 Ca 0.33 0.38 -0.17 0.00 0.05 0.00 0.00 55.36 55.94 1bnd s GLN 79 Cb 0.03 0.12 -0.05 0.00 1.10 0.00 0.00 33.01 34.21 1bnd s GLN 79 CO 0.13 -0.04 0.46 0.00 -0.55 0.00 0.00 175.29 175.29 1bnd s ARG 81 N -0.27 0.30 -0.06 0.00 3.03 -0.13 -4.94 118.95 116.88 1bnd s ARG 81 Ca 0.25 -0.56 -0.29 0.00 2.03 0.00 0.00 55.73 57.16 1bnd s ARG 81 Cb -0.16 0.05 -0.02 0.00 -1.03 0.00 0.00 34.95 33.79 1bnd s ARG 81 CO 0.13 -0.03 0.97 0.99 -1.13 0.00 0.00 175.30 176.23 1bnd s THR 82 N -1.28 4.84 0.15 4.99 2.01 -1.26 0.43 115.64 125.52 1bnd s THR 82 Ca -0.14 2.01 0.07 0.00 0.31 0.00 0.00 61.69 63.95 1bnd s THR 82 Cb -0.09 -4.30 -0.04 0.00 0.01 0.00 0.00 72.50 68.08 1bnd s THR 82 CO -0.01 0.09 -0.06 0.42 -0.69 0.00 0.00 174.62 174.38 1bnd s THR 83 N 1.48 3.49 0.34 -0.82 -4.23 0.15 -4.94 115.64 111.11 1bnd s THR 83 Ca 0.49 -1.41 0.08 0.00 -1.18 0.00 0.00 61.69 59.67 1bnd s THR 83 Cb -0.19 -2.71 -0.04 0.00 1.34 0.00 0.00 72.50 70.90 1bnd s THR 83 CO 0.23 -0.03 0.16 -1.10 -0.54 0.00 0.00 174.62 173.34 1bnd s GLN 84 N -2.66 2.44 0.20 3.99 -0.21 -1.26 -1.98 119.66 120.18 1bnd s GLN 84 Ca 0.25 -1.50 -0.00 0.00 0.02 0.00 0.00 55.36 54.13 1bnd s GLN 84 Cb -0.10 -2.23 -0.04 0.00 1.00 0.00 0.00 33.01 31.64 1bnd s GLN 84 CO 0.16 0.12 0.10 0.45 -2.12 0.00 0.00 175.29 174.00 1bnd s SER 85 N -3.87 0.56 -0.28 5.90 0.15 0.17 -4.84 113.70 111.49 1bnd s SER 85 Ca 0.38 -1.34 -0.11 0.00 0.70 0.00 0.00 55.95 55.58 1bnd s SER 85 Cb -0.03 0.28 -0.05 0.00 -1.71 0.00 0.00 66.02 64.51 1bnd s SER 85 CO 0.23 -0.77 0.18 -0.31 1.20 0.00 0.00 173.24 173.77 1bnd s TYR 86 N -3.99 3.21 0.06 3.44 2.02 -1.26 -1.06 117.35 119.77 1bnd s TYR 86 Ca 0.35 0.08 0.09 0.00 -0.37 0.00 0.00 57.07 57.23 1bnd s TYR 86 Cb 0.07 -2.37 -0.03 0.00 -0.40 0.00 0.00 41.96 39.24 1bnd s TYR 86 CO 0.10 -0.17 -0.25 0.14 -1.57 0.00 0.00 175.55 173.80 1bnd s VAL 87 N 1.73 2.04 0.33 0.71 -7.23 -0.24 -4.89 120.40 112.84 1bnd s VAL 87 Ca 0.07 -1.41 -0.26 0.00 -1.81 0.00 0.00 61.98 58.57 1bnd s VAL 87 Cb -0.16 -1.76 -0.10 0.00 0.56 0.00 0.00 36.38 34.92 1bnd s VAL 87 CO 0.10 0.27 0.96 -0.60 -0.31 0.00 0.00 175.10 175.52 1bnd s ARG 88 N -1.37 4.55 -0.03 4.82 3.52 -1.26 -0.96 118.95 128.22 1bnd s ARG 88 Ca 0.11 1.35 -0.20 0.00 -0.13 0.00 0.00 55.73 56.86 1bnd s ARG 88 Cb -0.10 -2.79 0.04 0.00 -1.56 0.00 0.00 34.95 30.55 1bnd s ARG 88 CO 0.03 0.25 0.43 0.00 -0.81 0.00 0.00 175.30 175.19 1bnd s ALA 89 N -1.61 -1.10 -0.06 6.12 0.00 -0.29 -4.94 121.76 119.88 1bnd s ALA 89 Ca 0.51 0.66 -0.26 0.00 0.00 0.00 0.00 51.96 52.87 1bnd s ALA 89 Cb -0.19 0.03 -0.03 0.00 0.00 0.00 0.00 23.12 22.93 1bnd s ALA 89 CO 0.24 -0.29 0.82 -1.17 0.00 0.00 0.00 175.76 175.36 1bnd s LEU 90 N -1.24 4.32 0.32 0.00 2.96 -1.26 -1.33 118.68 122.45 1bnd s LEU 90 Ca -0.12 1.36 0.01 0.00 -0.22 0.00 0.00 54.13 55.15 1bnd s LEU 90 Cb -0.04 -3.28 -0.01 0.00 0.50 0.00 0.00 46.19 43.36 1bnd s LEU 90 CO 0.06 -0.20 0.37 0.42 -1.32 0.00 0.00 176.35 175.68 1bnd s THR 91 N 1.04 0.00 -0.02 3.68 -4.23 0.62 -2.85 115.64 113.88 1bnd s THR 91 Ca 0.43 -1.78 0.00 0.00 -1.18 0.00 0.00 61.69 59.16 1bnd s THR 91 Cb -0.19 -2.56 0.03 0.00 1.34 0.00 0.00 72.50 71.12 1bnd s THR 91 CO 0.21 0.00 0.03 -0.32 -0.54 0.00 0.00 174.62 174.00 1bnd s MET 92 N -3.31 -0.03 0.00 3.99 1.75 -0.30 0.11 119.30 121.50 1bnd s MET 92 Ca 0.35 0.17 0.00 0.00 -1.25 0.00 0.00 55.69 54.96 1bnd s MET 92 Cb 0.01 -0.22 0.00 0.00 2.84 0.00 0.00 34.83 37.46 1bnd s MET 92 CO 0.22 -0.15 0.00 -0.40 -0.65 0.00 0.00 175.02 174.04 1bnd n ASP 93 N 4.07 0.00 0.13 1.11 5.68 -0.16 -0.86 116.55 126.52 1bnd n ASP 93 Ca -0.26 -0.03 0.01 0.00 -0.50 0.00 0.00 54.79 54.00 1bnd n ASP 93 Cb 0.51 0.00 0.09 0.00 -1.14 0.00 0.00 41.12 40.58 1bnd n ASP 93 CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 1bnd h SER 94 N 0.00 0.00 -0.69 -1.12 4.64 -1.91 -2.99 113.55 111.48 1bnd h SER 94 Ca 0.00 0.00 -0.35 0.00 -0.47 0.00 0.00 61.79 60.97 1bnd h SER 94 Cb 0.00 0.00 -0.21 0.00 -0.31 0.00 0.00 62.40 61.88 1bnd h SER 94 CO 0.00 0.60 0.45 0.29 -0.87 0.00 0.00 176.83 177.30 1bnd n LYS 95 N -3.40 1.96 -3.20 4.77 5.02 -1.26 -4.90 118.16 117.16 1bnd n LYS 95 Ca 0.01 -2.13 -0.20 0.00 -2.02 0.00 0.00 58.31 53.97 1bnd n LYS 95 Cb 0.71 -1.84 -0.01 0.00 -0.02 0.00 0.00 35.03 33.87 1bnd n LYS 95 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1bnd n LYS 96 N -0.62 -2.92 -3.62 1.97 4.76 -1.13 -4.95 118.16 111.65 1bnd n LYS 96 Ca 0.41 0.39 -0.37 0.00 -2.87 0.00 0.00 58.31 55.88 1bnd n LYS 96 Cb 1.31 -5.04 -0.07 0.00 -1.84 0.00 0.00 35.03 29.39 1bnd n LYS 96 CO 0.00 0.00 0.00 1.03 -1.37 0.00 0.00 177.40 177.06 1bnd s ARG 97 N -5.82 4.00 -0.15 1.97 0.52 -1.26 -4.81 118.95 113.41 1bnd s ARG 97 Ca 0.32 0.08 -0.11 0.00 -0.52 0.00 0.00 55.73 55.50 1bnd s ARG 97 Cb -0.17 -3.33 -0.05 0.00 0.52 0.00 0.00 34.95 31.92 1bnd s ARG 97 CO 0.39 0.45 0.22 0.42 0.02 0.00 0.00 175.30 176.81 1bnd s ILE 98 N -0.18 5.35 -0.10 1.52 1.01 -1.26 -0.99 121.20 126.55 1bnd s ILE 98 Ca 0.17 0.39 -0.33 0.00 0.00 0.00 0.00 60.65 60.88 1bnd s ILE 98 Cb -0.13 -3.54 0.14 0.00 0.01 0.00 0.00 42.46 38.93 1bnd s ILE 98 CO 0.05 0.47 1.33 -0.83 0.00 0.00 0.00 174.94 175.96 1bnd s GLY 99 N -0.02 -0.39 -0.04 6.18 0.00 0.12 -4.98 107.32 108.19 1bnd s GLY 99 Ca 0.14 1.08 -0.30 0.00 0.00 0.00 0.00 44.72 45.64 1bnd s GLY 99 CO 0.03 0.27 1.13 -0.98 0.00 0.00 0.00 173.10 173.55 1bnd s TRP 100 N -2.26 3.37 0.08 1.90 0.52 -1.26 -0.28 118.94 121.01 1bnd s TRP 100 Ca 0.13 1.38 -0.02 0.00 0.02 0.00 0.00 56.10 57.61 1bnd s TRP 100 Cb 0.04 -3.33 -0.04 0.00 -1.15 0.00 0.00 33.47 28.99 1bnd s TRP 100 CO -0.05 -0.89 0.02 1.03 0.02 0.00 0.00 176.95 177.09 1bnd s ARG 101 N 1.80 0.74 -0.18 4.98 0.52 -0.44 -4.93 118.95 121.44 1bnd s ARG 101 Ca 0.54 -1.26 -0.15 0.00 -0.52 0.00 0.00 55.73 54.34 1bnd s ARG 101 Cb -0.24 0.23 -0.04 0.00 0.52 0.00 0.00 34.95 35.43 1bnd s ARG 101 CO 0.23 -0.17 0.33 -0.06 0.02 0.00 0.00 175.30 175.65 1bnd s PHE 102 N -3.95 3.42 0.22 -0.53 0.08 -1.26 -1.14 117.98 114.82 1bnd s PHE 102 Ca 0.12 0.60 0.10 0.00 0.12 0.00 0.00 56.93 57.87 1bnd s PHE 102 Cb 0.07 -2.42 -0.05 0.00 -0.57 0.00 0.00 43.02 40.06 1bnd s PHE 102 CO -0.06 0.13 -0.19 0.96 -0.10 0.00 0.00 175.22 175.95 1bnd s ILE 103 N 0.83 2.15 -0.09 0.64 -4.36 -0.14 -1.28 121.20 118.96 1bnd s ILE 103 Ca 0.17 -2.18 -0.17 0.00 -0.26 0.00 0.00 60.65 58.22 1bnd s ILE 103 Cb -0.14 -2.10 -0.05 0.00 1.25 0.00 0.00 42.46 41.42 1bnd s ILE 103 CO 0.06 -0.36 0.46 -0.13 0.24 0.00 0.00 174.94 175.21 1bnd s ARG 104 N -3.19 4.25 0.04 0.37 0.52 -0.81 -1.08 118.95 119.05 1bnd s ARG 104 Ca 0.23 0.44 0.02 0.00 -0.52 0.00 0.00 55.73 55.90 1bnd s ARG 104 Cb -0.05 -3.38 -0.02 0.00 0.52 0.00 0.00 34.95 32.01 1bnd s ARG 104 CO 0.10 0.29 -0.08 0.96 0.02 0.00 0.00 175.30 176.60 1bnd s ILE 105 N 0.20 0.52 0.14 1.52 -4.36 -0.23 -4.69 121.20 114.30 1bnd s ILE 105 Ca 0.25 -1.04 -0.31 0.00 -0.26 0.00 0.00 60.65 59.29 1bnd s ILE 105 Cb -0.16 -0.59 -0.09 0.00 1.25 0.00 0.00 42.46 42.88 1bnd s ILE 105 CO 0.11 -0.37 1.53 -1.81 0.24 0.00 0.00 174.94 174.64 1bnd s ASP 106 N -1.52 6.65 0.00 4.36 1.01 -1.26 -0.66 116.67 125.25 1bnd s ASP 106 Ca -0.10 2.52 0.00 0.00 0.71 0.00 0.00 52.55 55.69 1bnd s ASP 106 Cb -0.10 -2.59 0.00 0.00 1.01 0.00 0.00 42.92 41.24 1bnd s ASP 106 CO 0.00 -0.79 0.19 0.35 0.21 0.00 0.00 175.17 175.14 1bnd n THR 107 N 4.05 0.00 -3.72 -1.27 -2.24 -0.84 -2.20 114.28 108.06 1bnd n THR 107 Ca 0.13 -0.19 -0.04 0.00 -2.27 0.00 0.00 64.05 61.68 1bnd n THR 107 Cb 0.40 1.61 -0.01 0.00 -2.10 0.00 0.00 70.33 70.22 1bnd n THR 107 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1bnd s SER 108 N -0.00 -0.21 -0.23 3.42 0.15 -1.12 -4.54 113.70 111.16 1bnd s SER 108 Ca 0.00 -0.36 -0.02 0.00 0.70 0.00 0.00 55.95 56.27 1bnd s SER 108 Cb 0.00 0.50 0.07 0.00 -1.71 0.00 0.00 66.02 64.88 1bnd s SER 108 CO 0.00 -0.90 0.03 0.00 1.20 0.00 0.00 173.24 173.57 1bnd s VAL 110 N 1.70 3.01 -0.16 0.00 -7.23 0.17 -4.77 120.40 113.11 1bnd s VAL 110 Ca 0.01 -2.10 -0.14 0.00 -1.81 0.00 0.00 61.98 57.94 1bnd s VAL 110 Cb -0.17 -2.59 -0.05 0.00 0.56 0.00 0.00 36.38 34.13 1bnd s VAL 110 CO -0.12 -0.36 0.29 0.00 -0.31 0.00 0.00 175.10 174.60 1bnd s THR 112 N 0.41 2.45 0.05 0.00 2.01 -0.14 -4.95 115.64 115.47 1bnd s THR 112 Ca 0.16 -0.92 0.04 0.00 0.31 0.00 0.00 61.69 61.29 1bnd s THR 112 Cb -0.13 -1.93 -0.04 0.00 0.01 0.00 0.00 72.50 70.41 1bnd s THR 112 CO 0.04 0.57 -0.05 -0.76 -0.69 0.00 0.00 174.62 173.72 1bnd s LEU 113 N -0.19 3.25 -0.02 4.42 1.43 -1.26 -0.91 118.68 125.41 1bnd s LEU 113 Ca -0.02 -0.20 0.03 0.00 -1.03 0.00 0.00 54.13 52.92 1bnd s LEU 113 Cb -0.14 -1.94 -0.00 0.00 0.03 0.00 0.00 46.19 44.14 1bnd s LEU 113 CO 0.03 0.23 -0.11 0.42 0.23 0.00 0.00 176.35 177.16 1bnd s THR 114 N -1.14 0.87 0.04 5.49 -4.23 -0.76 -4.98 115.64 110.93 1bnd s THR 114 Ca 0.21 -0.45 -0.31 0.00 -1.18 0.00 0.00 61.69 59.96 1bnd s THR 114 Cb -0.11 -0.74 -0.07 0.00 1.34 0.00 0.00 72.50 72.92 1bnd s THR 114 CO 0.12 0.25 1.44 -0.63 -0.54 0.00 0.00 174.62 175.26 1bnd s ILE 115 N -0.11 3.49 -2.00 2.99 1.09 -1.26 -1.83 121.20 123.57 1bnd s ILE 115 Ca 0.02 0.96 0.12 0.00 -1.10 0.00 0.00 60.65 60.65 1bnd s ILE 115 Cb -0.06 -3.61 0.35 0.00 -1.06 0.00 0.00 42.46 38.08 1bnd s ILE 115 CO -0.00 0.02 1.17 1.17 -0.10 0.00 0.00 174.94 177.20