#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ami n VAL 2 N 0.00 3.30 0.00 8.89 0.24 -1.26 -4.62 118.33 124.87 2ami n VAL 2 Ca 0.00 -2.23 0.00 0.00 -2.04 0.00 0.00 64.34 60.07 2ami n VAL 2 Cb 0.00 -2.44 0.00 0.00 -1.47 0.00 0.00 33.84 29.93 2ami n VAL 2 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2ami n GLY 3 N 3.86 1.24 3.68 7.63 0.00 -1.26 -4.82 105.19 115.53 2ami n GLY 3 Ca 0.60 -0.01 -0.42 0.00 0.00 0.00 0.00 46.02 46.19 2ami n GLY 3 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ami s LEU 4 N 0.00 4.35 0.90 0.99 1.43 -1.26 -5.00 118.68 120.09 2ami s LEU 4 Ca 0.00 2.38 -0.11 0.00 -1.03 0.00 0.00 54.13 55.37 2ami s LEU 4 Cb 0.00 -3.55 0.13 0.00 0.03 0.00 0.00 46.19 42.80 2ami s LEU 4 CO 0.00 -0.89 1.10 0.42 0.23 0.00 0.00 176.35 177.21 2ami s THR 5 N 3.14 2.57 0.24 5.49 -4.23 -1.26 -0.62 115.64 120.96 2ami s THR 5 Ca 0.73 0.18 -0.05 0.00 -1.18 0.00 0.00 61.69 61.38 2ami s THR 5 Cb -0.37 -2.45 0.21 0.00 1.34 0.00 0.00 72.50 71.22 2ami s THR 5 CO 0.31 -0.24 1.81 -0.33 -0.54 0.00 0.00 174.62 175.63 2ami h GLU 6 N -1.68 0.74 -0.07 3.99 3.07 -1.95 0.12 114.58 118.81 2ami h GLU 6 Ca -0.47 -0.04 0.04 0.00 -0.50 0.00 0.00 59.36 58.38 2ami h GLU 6 Cb 1.27 -0.17 -0.06 0.00 -0.84 0.00 0.00 28.75 28.95 2ami h GLU 6 CO 0.48 0.49 -0.43 0.93 -1.40 0.00 0.00 179.01 179.09 2ami h GLU 7 N 0.77 -0.52 -0.27 2.33 3.07 -1.99 0.17 114.58 118.14 2ami h GLU 7 Ca 0.39 0.04 0.04 0.00 -0.50 0.00 0.00 59.36 59.33 2ami h GLU 7 Cb 0.36 0.12 -0.04 0.00 -0.84 0.00 0.00 28.75 28.35 2ami h GLU 7 CO -0.25 -0.35 0.01 1.96 -1.40 0.00 0.00 179.01 178.99 2ami h GLN 8 N -0.54 0.09 -0.90 2.33 4.20 -1.75 0.65 115.11 119.19 2ami h GLN 8 Ca 0.06 -0.01 0.00 0.00 0.06 0.00 0.00 58.65 58.77 2ami h GLN 8 Cb 0.65 -0.02 -0.04 0.00 0.30 0.00 0.00 27.48 28.36 2ami h GLN 8 CO -0.36 0.06 0.57 0.87 -0.67 0.00 0.00 178.83 179.31 2ami h LYS 9 N 0.10 1.20 0.11 1.46 1.57 -0.58 0.13 116.57 120.55 2ami h LYS 9 Ca 0.13 -0.09 0.01 0.00 -1.87 0.00 0.00 60.65 58.83 2ami h LYS 9 Cb 0.16 -0.26 -0.01 0.00 0.08 0.00 0.00 32.23 32.20 2ami h LYS 9 CO -0.21 0.81 -0.12 1.96 -0.57 0.00 0.00 179.45 181.33 2ami h GLN 10 N 1.23 -0.24 -0.49 3.15 1.08 -0.15 0.12 115.11 119.80 2ami h GLN 10 Ca 0.33 0.02 0.10 0.00 -1.45 0.00 0.00 58.65 57.64 2ami h GLN 10 Cb -0.10 0.06 -0.09 0.00 -0.05 0.00 0.00 27.48 27.29 2ami h GLN 10 CO -0.07 -0.16 -0.08 0.93 -0.95 0.00 0.00 178.83 178.50 2ami h GLU 11 N -0.25 0.04 -0.52 1.46 5.08 -0.22 0.26 114.58 120.43 2ami h GLU 11 Ca 0.01 -0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.38 2ami h GLU 11 Cb 0.25 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.46 2ami h GLU 11 CO -0.04 0.02 0.32 0.82 -1.00 0.00 0.00 179.01 179.14 2ami h ILE 12 N 0.04 1.09 -0.85 3.13 2.04 -0.73 0.74 117.51 122.96 2ami h ILE 12 Ca 0.24 -0.22 -0.01 0.00 1.00 0.00 0.00 64.86 65.87 2ami h ILE 12 Cb 0.37 0.38 -0.04 0.00 -0.74 0.00 0.00 36.82 36.79 2ami h ILE 12 CO -0.47 0.12 0.50 -0.09 0.00 0.00 0.00 178.15 178.21 2ami h ARG 13 N 0.65 1.16 -0.22 2.37 1.12 0.67 0.12 114.38 120.23 2ami h ARG 13 Ca 0.20 -0.11 -0.09 0.00 -1.11 0.00 0.00 59.98 58.87 2ami h ARG 13 Cb -0.02 -0.24 -0.00 0.00 -0.01 0.00 0.00 29.97 29.70 2ami h ARG 13 CO -0.07 0.82 -0.21 0.93 -3.11 0.00 0.00 179.97 178.33 2ami h GLU 14 N 1.17 0.54 -0.29 0.20 3.07 -0.20 0.51 114.58 119.58 2ami h GLU 14 Ca 0.30 -0.28 0.05 0.00 -0.50 0.00 0.00 59.36 58.94 2ami h GLU 14 Cb -0.03 0.01 -0.05 0.00 -0.84 0.00 0.00 28.75 27.84 2ami h GLU 14 CO -0.06 0.86 -0.02 0.00 -1.40 0.00 0.00 179.01 178.40 2ami h ALA 15 N 0.67 0.24 -0.29 3.43 0.00 -0.63 0.60 119.26 123.28 2ami h ALA 15 Ca 0.04 0.09 0.07 0.00 0.00 0.00 0.00 54.91 55.10 2ami h ALA 15 Cb 0.75 0.16 -0.07 0.00 0.00 0.00 0.00 17.79 18.63 2ami h ALA 15 CO 0.05 -0.42 -0.16 0.35 0.00 0.00 0.00 179.25 179.07 2ami h PHE 16 N 0.06 -0.39 -0.15 0.00 3.57 -0.64 0.31 116.94 119.71 2ami h PHE 16 Ca 0.14 0.03 0.05 0.00 3.53 0.00 0.00 57.97 61.72 2ami h PHE 16 Cb 0.19 0.22 -0.06 0.00 2.79 0.00 0.00 35.95 39.09 2ami h PHE 16 CO -0.23 -0.23 -0.23 0.22 -2.23 0.00 0.00 178.31 175.61 2ami h ASP 17 N -0.12 -0.71 -0.04 0.41 3.58 -0.21 0.11 116.42 119.45 2ami h ASP 17 Ca 0.15 0.12 0.04 0.00 0.42 0.00 0.00 57.03 57.76 2ami h ASP 17 Cb 0.35 0.32 -0.05 0.00 1.72 0.00 0.00 39.33 41.68 2ami h ASP 17 CO -0.37 -0.28 -0.25 0.25 -2.88 0.00 0.00 179.24 175.72 2ami h LEU 18 N -0.28 -0.74 -1.09 2.28 5.85 -0.37 -2.44 115.31 118.52 2ami h LEU 18 Ca 0.11 0.11 0.02 0.00 0.84 0.00 0.00 57.88 58.95 2ami h LEU 18 Cb 0.44 0.31 -0.05 0.00 0.37 0.00 0.00 40.66 41.73 2ami h LEU 18 CO -0.31 -0.31 0.62 -0.26 -0.34 0.00 0.00 178.44 177.84 2ami h PHE 19 N -0.36 1.16 0.00 1.25 0.04 -0.54 -2.71 116.94 115.78 2ami h PHE 19 Ca 0.07 0.03 -0.47 0.00 2.80 0.00 0.00 57.97 60.40 2ami h PHE 19 Cb 0.46 -0.39 0.02 0.00 2.20 0.00 0.00 35.95 38.24 2ami h PHE 19 CO -0.30 0.71 2.92 -3.47 -0.60 0.00 0.00 178.31 177.58 2ami n ASP 20 N -4.41 5.78 -0.31 2.17 2.03 0.36 -4.68 116.55 117.50 2ami n ASP 20 Ca 0.11 -2.41 0.09 0.00 0.52 0.00 0.00 54.79 53.11 2ami n ASP 20 Cb 0.04 -1.22 0.25 0.00 -0.72 0.00 0.00 41.12 39.47 2ami n ASP 20 CO 0.00 0.00 0.00 0.71 -1.92 0.00 0.00 177.20 175.99 2ami h THR 21 N 3.38 0.68 0.00 5.18 1.35 -1.61 0.16 112.91 122.06 2ami h THR 21 Ca 0.59 -0.21 -0.01 0.00 -0.55 0.00 0.00 66.41 66.23 2ami h THR 21 Cb 0.22 0.02 -0.00 0.00 -1.73 0.00 0.00 68.15 66.66 2ami h THR 21 CO 1.56 0.11 -0.06 -0.78 -0.25 0.00 0.00 175.52 176.10 2ami h ASP 22 N 0.60 0.00 -2.71 5.36 3.58 -1.90 -3.47 116.42 117.89 2ami h ASP 22 Ca 0.50 0.00 -0.21 0.00 0.42 0.00 0.00 57.03 57.74 2ami h ASP 22 Cb 0.77 0.00 0.04 0.00 1.72 0.00 0.00 39.33 41.86 2ami h ASP 22 CO -0.40 0.06 -0.32 0.61 -2.88 0.00 0.00 179.24 176.32 2ami n GLY 23 N -0.22 0.08 0.15 -0.78 0.00 0.57 -4.93 105.19 100.06 2ami n GLY 23 Ca -0.00 -0.29 0.13 0.00 0.00 0.00 0.00 46.02 45.85 2ami n GLY 23 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2ami h SER 24 N -0.84 0.00 0.00 1.61 0.02 -1.91 -3.46 113.55 108.97 2ami h SER 24 Ca -0.28 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.67 2ami h SER 24 Cb 1.19 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.73 2ami h SER 24 CO 0.29 0.00 0.00 0.61 -1.14 0.00 0.00 176.83 176.59 2ami n GLY 25 N 0.27 2.87 3.43 -3.77 0.00 -1.26 -4.99 105.19 101.75 2ami n GLY 25 Ca 0.03 -0.78 -0.32 0.00 0.00 0.00 0.00 46.02 44.96 2ami n GLY 25 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2ami s THR 26 N -0.87 2.74 -0.06 2.61 -4.23 -1.26 -4.52 115.64 110.04 2ami s THR 26 Ca 0.00 -1.00 -0.30 0.00 -1.18 0.00 0.00 61.69 59.21 2ami s THR 26 Cb 0.00 -2.09 -0.03 0.00 1.34 0.00 0.00 72.50 71.72 2ami s THR 26 CO 0.00 0.48 1.26 -0.63 -0.54 0.00 0.00 174.62 175.19 2ami s ILE 27 N -0.79 4.14 0.46 2.99 1.01 0.35 -4.74 121.20 124.61 2ami s ILE 27 Ca 0.13 1.47 -0.22 0.00 0.00 0.00 0.00 60.65 62.02 2ami s ILE 27 Cb -0.10 -3.94 -0.08 0.00 0.01 0.00 0.00 42.46 38.35 2ami s ILE 27 CO 0.02 -0.03 1.12 -0.62 0.00 0.00 0.00 174.94 175.44 2ami s ASP 28 N 1.68 6.27 0.24 3.58 -1.08 -1.26 0.04 116.67 126.14 2ami s ASP 28 Ca 0.57 2.19 -0.05 0.00 -0.52 0.00 0.00 52.55 54.74 2ami s ASP 28 Cb -0.26 -2.59 0.44 0.00 -1.46 0.00 0.00 42.92 39.05 2ami s ASP 28 CO 0.22 -0.84 1.33 0.00 0.52 0.00 0.00 175.17 176.39 2ami n ALA 29 N -0.53 0.24 -0.14 3.66 0.00 -1.13 -0.16 120.51 122.45 2ami n ALA 29 Ca 0.07 0.93 -0.06 0.00 0.00 0.00 0.00 53.44 54.38 2ami n ALA 29 Cb 0.49 -0.58 0.02 0.00 0.00 0.00 0.00 19.45 19.39 2ami n ALA 29 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2ami h LYS 30 N 0.00 0.47 -0.79 0.00 1.57 -1.92 0.89 116.57 116.79 2ami h LYS 30 Ca 0.43 -0.03 -0.03 0.00 -1.87 0.00 0.00 60.65 59.14 2ami h LYS 30 Cb 0.70 -0.11 -0.04 0.00 0.08 0.00 0.00 32.23 32.87 2ami h LYS 30 CO -0.86 0.31 0.36 0.93 -0.57 0.00 0.00 179.45 179.62 2ami h GLU 31 N 0.48 1.15 -0.50 3.15 5.08 -0.88 0.38 114.58 123.45 2ami h GLU 31 Ca 0.18 -0.18 -0.01 0.00 -1.00 0.00 0.00 59.36 58.35 2ami h GLU 31 Cb 0.04 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.07 2ami h GLU 31 CO -0.10 0.90 0.26 1.25 -1.00 0.00 0.00 179.01 180.32 2ami h LEU 32 N 1.14 0.64 -0.37 1.33 5.85 -0.22 0.73 115.31 124.41 2ami h LEU 32 Ca 0.27 -0.11 0.02 0.00 0.84 0.00 0.00 57.88 58.90 2ami h LEU 32 Cb 0.14 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 40.98 2ami h LEU 32 CO -0.03 0.57 0.20 0.50 -0.34 0.00 0.00 178.44 179.34 2ami h LYS 33 N 0.67 0.39 -0.24 1.25 3.64 -0.28 0.94 116.57 122.93 2ami h LYS 33 Ca 0.17 -0.02 0.06 0.00 -1.27 0.00 0.00 60.65 59.59 2ami h LYS 33 Cb 0.09 -0.09 -0.06 0.00 -0.41 0.00 0.00 32.23 31.76 2ami h LYS 33 CO -0.02 0.26 -0.17 0.28 -2.27 0.00 0.00 179.45 177.52 2ami h VAL 34 N 0.40 0.51 -0.09 2.00 2.07 -0.66 0.88 116.25 121.36 2ami h VAL 34 Ca 0.15 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.71 2ami h VAL 34 Cb 0.04 0.51 -0.05 0.00 -1.52 0.00 0.00 31.29 30.27 2ami h VAL 34 CO -0.09 0.00 -0.26 0.00 0.02 0.00 0.00 177.57 177.24 2ami h ALA 35 N 0.98 -0.28 -0.84 1.67 0.00 -0.19 0.71 119.26 121.31 2ami h ALA 35 Ca 0.14 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.07 2ami h ALA 35 Cb 0.37 0.48 -0.04 0.00 0.00 0.00 0.00 17.79 18.60 2ami h ALA 35 CO -0.34 -0.73 0.53 0.52 0.00 0.00 0.00 179.25 179.23 2ami h MET 36 N -0.34 1.12 -0.26 0.00 2.07 -0.55 0.23 114.93 117.20 2ami h MET 36 Ca 0.09 -0.09 0.03 0.00 -2.07 0.00 0.00 59.70 57.66 2ami h MET 36 Cb 0.48 -0.24 -0.03 0.00 -1.87 0.00 0.00 31.60 29.93 2ami h MET 36 CO -0.29 0.77 0.08 -0.09 1.07 0.00 0.00 176.91 178.45 2ami h ARG 37 N 1.14 0.19 -0.79 1.72 9.65 -0.30 0.81 114.38 126.80 2ami h ARG 37 Ca 0.30 -0.01 0.00 0.00 -1.10 0.00 0.00 59.98 59.18 2ami h ARG 37 Cb -0.09 -0.04 -0.04 0.00 -1.39 0.00 0.00 29.97 28.41 2ami h ARG 37 CO -0.06 0.13 0.51 0.00 2.80 0.00 0.00 179.97 183.35 2ami h ALA 38 N 1.17 1.41 0.00 2.80 0.00 -0.01 0.13 119.26 124.76 2ami h ALA 38 Ca 0.12 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2ami h ALA 38 Cb 0.09 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.56 2ami h ALA 38 CO -0.13 0.54 0.00 1.28 0.00 0.00 0.00 179.25 180.94 2ami n LEU 39 N -4.40 0.00 0.00 0.00 4.77 0.74 -4.85 117.00 113.26 2ami n LEU 39 Ca 0.09 0.07 0.00 0.00 -0.03 0.00 0.00 56.01 56.13 2ami n LEU 39 Cb 0.04 -0.07 0.00 0.00 -2.33 0.00 0.00 43.42 41.06 2ami n LEU 39 CO 0.37 -0.03 0.00 0.61 -1.33 0.00 0.00 177.39 177.00 2ami n GLY 40 N -0.05 0.71 3.80 -0.72 0.00 0.44 -5.04 105.19 104.32 2ami n GLY 40 Ca 0.10 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.82 2ami n GLY 40 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2ami s PHE 41 N -2.22 2.84 -0.71 1.61 0.40 0.20 -4.98 117.98 115.12 2ami s PHE 41 Ca 0.00 1.30 -0.10 0.00 -0.60 0.00 0.00 56.93 57.53 2ami s PHE 41 Cb 0.00 -3.04 0.19 0.00 0.51 0.00 0.00 43.02 40.68 2ami s PHE 41 CO 0.00 -1.66 0.60 -1.21 0.70 0.00 0.00 175.22 173.65 2ami s GLU 42 N -5.06 3.12 -1.08 0.44 2.02 -1.26 -4.41 118.70 112.47 2ami s GLU 42 Ca 0.60 -2.37 -0.21 0.00 0.02 0.00 0.00 54.97 53.01 2ami s GLU 42 Cb -0.15 -4.15 -0.08 0.00 0.10 0.00 0.00 34.13 29.85 2ami s GLU 42 CO 0.55 -1.25 1.93 -0.35 0.02 0.00 0.00 175.26 176.16 2ami n PRO 43 N 3.98 1.90 -1.92 0.39 -0.04 -1.26 -4.92 135.00 133.12 2ami n PRO 43 Ca 0.08 -2.37 -0.42 0.00 -0.04 0.00 0.00 63.50 60.75 2ami n PRO 43 Cb 0.43 -3.37 -0.03 0.00 -0.04 0.00 0.00 33.50 30.50 2ami n PRO 43 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 2ami s LYS 44 N 5.33 4.19 0.16 0.54 -0.14 -1.26 -4.88 119.74 123.68 2ami s LYS 44 Ca 0.61 2.32 -0.30 0.00 -1.36 0.00 0.00 55.97 57.24 2ami s LYS 44 Cb 0.07 -3.77 -0.04 0.00 -1.68 0.00 0.00 37.83 32.40 2ami s LYS 44 CO 0.10 -0.79 1.55 0.87 -0.76 0.00 0.00 175.35 176.32 2ami h LYS 45 N 8.92 -0.13 -0.01 1.68 1.57 -1.98 0.02 116.57 126.63 2ami h LYS 45 Ca -0.42 0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.36 2ami h LYS 45 Cb 1.20 0.03 -0.00 0.00 0.08 0.00 0.00 32.23 33.54 2ami h LYS 45 CO 0.94 -0.09 0.01 0.93 -0.57 0.00 0.00 179.45 180.67 2ami h GLU 46 N -0.14 0.02 -0.35 3.15 3.07 -1.99 0.13 114.58 118.47 2ami h GLU 46 Ca 0.15 -0.00 0.03 0.00 -0.50 0.00 0.00 59.36 59.04 2ami h GLU 46 Cb 0.49 -0.00 -0.03 0.00 -0.84 0.00 0.00 28.75 28.37 2ami h GLU 46 CO -0.82 0.07 0.16 0.93 -1.40 0.00 0.00 179.01 177.95 2ami h GLU 47 N -0.05 0.32 -0.29 2.33 3.07 -1.85 -0.09 114.58 118.03 2ami h GLU 47 Ca 0.00 -0.02 -0.01 0.00 -0.50 0.00 0.00 59.36 58.84 2ami h GLU 47 Cb 0.06 -0.07 -0.01 0.00 -0.84 0.00 0.00 28.75 27.89 2ami h GLU 47 CO -0.00 0.21 0.15 0.82 -1.40 0.00 0.00 179.01 178.80 2ami h ILE 48 N 0.33 1.14 -0.28 3.13 1.08 -0.64 0.66 117.51 122.93 2ami h ILE 48 Ca 0.15 -0.38 0.04 0.00 -0.39 0.00 0.00 64.86 64.28 2ami h ILE 48 Cb 0.09 0.86 -0.04 0.00 -3.07 0.00 0.00 36.82 34.65 2ami h ILE 48 CO -0.12 0.14 0.04 0.11 -0.69 0.00 0.00 178.15 177.63 2ami h LYS 49 N 0.35 0.14 0.40 2.37 1.57 -0.38 0.13 116.57 121.16 2ami h LYS 49 Ca 0.10 -0.01 -0.01 0.00 -1.87 0.00 0.00 60.65 58.87 2ami h LYS 49 Cb 0.09 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.35 2ami h LYS 49 CO -0.01 0.09 -0.33 -0.22 -0.57 0.00 0.00 179.45 178.41 2ami h LYS 50 N 0.14 -0.71 -0.14 3.15 1.63 -0.73 0.34 116.57 120.25 2ami h LYS 50 Ca 0.13 0.05 0.04 0.00 -0.85 0.00 0.00 60.65 60.02 2ami h LYS 50 Cb 0.14 0.16 -0.07 0.00 -0.60 0.00 0.00 32.23 31.87 2ami h LYS 50 CO -0.18 -0.47 -0.45 1.98 -3.45 0.00 0.00 179.45 176.88 2ami h MET 51 N -0.74 -0.49 -0.36 1.90 4.05 -0.67 0.85 114.93 119.47 2ami h MET 51 Ca -0.03 0.03 0.08 0.00 -0.28 0.00 0.00 59.70 59.49 2ami h MET 51 Cb 0.64 0.11 -0.08 0.00 -0.80 0.00 0.00 31.60 31.48 2ami h MET 51 CO -0.02 -0.33 -0.14 0.82 0.23 0.00 0.00 176.91 177.47 2ami h ILE 52 N -0.51 0.53 -0.45 1.77 2.04 -0.65 -0.69 117.51 119.55 2ami h ILE 52 Ca 0.07 0.00 0.03 0.00 1.00 0.00 0.00 64.86 65.96 2ami h ILE 52 Cb 0.64 0.53 -0.04 0.00 -0.74 0.00 0.00 36.82 37.21 2ami h ILE 52 CO -0.41 0.00 0.23 0.28 0.00 0.00 0.00 178.15 178.25 2ami h SER 53 N -0.07 0.35 -0.46 1.72 0.02 -0.10 0.32 113.55 115.31 2ami h SER 53 Ca 0.18 0.02 0.04 0.00 -0.84 0.00 0.00 61.79 61.19 2ami h SER 53 Cb 0.35 -0.05 -0.04 0.00 0.14 0.00 0.00 62.40 62.80 2ami h SER 53 CO -0.41 0.25 0.22 -0.33 -1.14 0.00 0.00 176.83 175.42 2ami h GLU 54 N 0.47 0.43 -0.12 3.45 5.08 -0.15 -2.69 114.58 121.05 2ami h GLU 54 Ca 0.19 -0.03 -0.16 0.00 -1.00 0.00 0.00 59.36 58.37 2ami h GLU 54 Cb 0.08 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.23 2ami h GLU 54 CO -0.13 0.28 -0.59 0.82 -1.00 0.00 0.00 179.01 178.40 2ami h ILE 55 N 0.44 1.35 -0.44 3.13 1.08 -0.60 -3.40 117.51 119.07 2ami h ILE 55 Ca 0.21 -1.90 -0.62 0.00 -0.39 0.00 0.00 64.86 62.15 2ami h ILE 55 Cb 0.13 1.90 -0.05 0.00 -3.07 0.00 0.00 36.82 35.74 2ami h ILE 55 CO -0.15 0.58 2.29 -0.67 -0.69 0.00 0.00 178.15 179.50 2ami n ASP 56 N -3.91 4.01 -0.02 1.72 2.03 0.11 -4.69 116.55 115.79 2ami n ASP 56 Ca -0.03 -2.83 -0.13 0.00 0.52 0.00 0.00 54.79 52.33 2ami n ASP 56 Cb 0.62 -1.64 -0.08 0.00 -0.72 0.00 0.00 41.12 39.30 2ami n ASP 56 CO 0.00 0.00 0.00 0.11 -1.92 0.00 0.00 177.20 175.39 2ami h LYS 57 N 7.54 0.13 0.00 -0.67 1.79 -1.79 -3.42 116.57 120.14 2ami h LYS 57 Ca 0.44 -0.05 0.00 0.00 -2.18 0.00 0.00 60.65 58.86 2ami h LYS 57 Cb 0.79 -0.01 0.00 0.00 -1.58 0.00 0.00 32.23 31.44 2ami h LYS 57 CO 1.60 0.48 -0.58 -0.40 -1.08 0.00 0.00 179.45 179.48 2ami n ASP 58 N -4.80 2.89 0.24 0.86 5.68 -1.26 -4.84 116.55 115.32 2ami n ASP 58 Ca -0.07 0.00 0.16 0.00 -0.50 0.00 0.00 54.79 54.38 2ami n ASP 58 Cb 0.24 0.37 0.86 0.00 -1.14 0.00 0.00 41.12 41.45 2ami n ASP 58 CO 0.00 0.00 0.00 1.23 -1.33 0.00 0.00 177.20 177.10 2ami h GLY 59 N 0.00 0.00 -6.21 6.12 0.00 -1.82 -3.47 103.07 97.69 2ami h GLY 59 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 47.33 46.93 2ami h GLY 59 CO 0.00 0.00 -0.87 1.44 0.00 0.00 0.00 176.54 177.11 2ami n SER 60 N -2.64 -5.52 0.00 0.19 7.64 -1.26 -1.28 113.62 110.75 2ami n SER 60 Ca -0.02 -0.93 0.00 0.00 1.01 0.00 0.00 58.87 58.93 2ami n SER 60 Cb 0.07 -3.35 0.00 0.00 -1.01 0.00 0.00 64.21 59.92 2ami n SER 60 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2ami n GLY 61 N -1.69 2.94 3.98 0.23 0.00 -1.26 -5.02 105.19 104.37 2ami n GLY 61 Ca -0.11 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.71 2ami n GLY 61 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2ami s THR 62 N -2.60 2.29 -0.15 2.61 -4.23 -0.40 -2.84 115.64 110.31 2ami s THR 62 Ca 0.00 -1.14 0.00 0.00 -1.18 0.00 0.00 61.69 59.37 2ami s THR 62 Cb 0.00 -2.43 0.03 0.00 1.34 0.00 0.00 72.50 71.44 2ami s THR 62 CO 0.00 0.00 -0.12 -0.63 -0.54 0.00 0.00 174.62 173.33 2ami s ILE 63 N -2.60 1.47 0.69 2.99 -1.09 0.11 -4.12 121.20 118.65 2ami s ILE 63 Ca 0.53 -0.66 -0.12 0.00 -2.23 0.00 0.00 60.65 58.18 2ami s ILE 63 Cb -0.06 -1.45 0.01 0.00 -1.58 0.00 0.00 42.46 39.39 2ami s ILE 63 CO 0.33 0.36 1.07 -0.62 -1.23 0.00 0.00 174.94 174.85 2ami s ASP 64 N 1.51 5.24 0.22 3.58 2.15 -1.26 -0.50 116.67 127.62 2ami s ASP 64 Ca 0.03 1.71 -0.10 0.00 0.43 0.00 0.00 52.55 54.62 2ami s ASP 64 Cb -0.14 -2.51 0.31 0.00 -0.30 0.00 0.00 42.92 40.29 2ami s ASP 64 CO -0.10 -1.53 1.66 0.15 -0.17 0.00 0.00 175.17 175.18 2ami h PHE 65 N -0.58 -0.06 -0.18 -5.34 3.57 -1.99 0.93 116.94 113.30 2ami h PHE 65 Ca -0.44 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.11 2ami h PHE 65 Cb 1.22 0.12 -0.01 0.00 2.79 0.00 0.00 35.95 40.07 2ami h PHE 65 CO 0.60 -0.18 0.11 0.93 -2.23 0.00 0.00 178.31 177.54 2ami h GLU 66 N 0.11 0.22 -0.35 1.11 5.08 -1.98 0.15 114.58 118.92 2ami h GLU 66 Ca 0.34 -0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.71 2ami h GLU 66 Cb 0.55 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 29.72 2ami h GLU 66 CO -0.56 0.15 0.16 0.93 -1.00 0.00 0.00 179.01 178.69 2ami h GLU 67 N 0.23 0.33 -0.15 2.33 5.08 -1.71 0.53 114.58 121.22 2ami h GLU 67 Ca 0.07 -0.02 0.02 0.00 -1.00 0.00 0.00 59.36 58.43 2ami h GLU 67 Cb -0.02 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.14 2ami h GLU 67 CO -0.02 0.22 0.02 0.35 -1.00 0.00 0.00 179.01 178.58 2ami h PHE 68 N 0.34 0.03 -0.40 4.33 3.57 -0.47 0.62 116.94 124.96 2ami h PHE 68 Ca 0.15 0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.71 2ami h PHE 68 Cb 0.07 0.01 -0.04 0.00 2.79 0.00 0.00 35.95 38.78 2ami h PHE 68 CO -0.11 0.00 0.14 1.25 -2.23 0.00 0.00 178.31 177.36 2ami h LEU 69 N 0.08 0.15 0.05 0.59 6.46 -0.33 0.10 115.31 122.40 2ami h LEU 69 Ca 0.07 0.05 0.02 0.00 -0.12 0.00 0.00 57.88 57.89 2ami h LEU 69 Cb 0.07 0.03 -0.02 0.00 -0.73 0.00 0.00 40.66 40.01 2ami h LEU 69 CO -0.10 0.12 -0.14 0.74 -0.62 0.00 0.00 178.44 178.44 2ami h THR 70 N 0.30 0.67 -0.11 1.05 2.02 -0.53 0.59 112.91 116.90 2ami h THR 70 Ca 0.19 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.41 2ami h THR 70 Cb 0.17 0.67 -0.06 0.00 -1.74 0.00 0.00 68.15 67.20 2ami h THR 70 CO -0.19 0.00 -0.27 -0.03 0.37 0.00 0.00 175.52 175.40 2ami h MET 71 N -0.25 -0.33 0.04 6.66 1.85 -0.37 0.12 114.93 122.65 2ami h MET 71 Ca 0.03 0.02 0.03 0.00 -0.61 0.00 0.00 59.70 59.17 2ami h MET 71 Cb 0.29 0.08 -0.04 0.00 0.43 0.00 0.00 31.60 32.35 2ami h MET 71 CO -0.10 -0.22 -0.25 1.98 -0.40 0.00 0.00 176.91 177.91 2ami h MET 72 N -0.35 -0.40 -0.44 0.39 -1.53 -0.57 -2.08 114.93 109.94 2ami h MET 72 Ca 0.09 0.03 0.08 0.00 -3.44 0.00 0.00 59.70 56.46 2ami h MET 72 Cb 0.49 0.09 -0.07 0.00 -0.55 0.00 0.00 31.60 31.56 2ami h MET 72 CO -0.31 -0.27 0.03 1.15 0.14 0.00 0.00 176.91 177.65 2ami h THR 73 N -0.42 0.69 0.00 -0.77 2.02 -0.55 -1.67 112.91 112.21 2ami h THR 73 Ca 0.05 -0.05 0.00 0.00 0.77 0.00 0.00 66.41 67.18 2ami h THR 73 Cb 0.48 0.53 0.00 0.00 -1.74 0.00 0.00 68.15 67.42 2ami h THR 73 CO -0.20 0.03 0.00 0.00 0.37 0.00 0.00 175.52 175.72 2ami n ALA 74 N -2.57 1.07 0.22 6.16 0.00 0.40 -1.08 120.51 124.72 2ami n ALA 74 Ca 0.04 0.10 0.07 0.00 0.00 0.00 0.00 53.44 53.65 2ami n ALA 74 Cb 0.23 -1.18 0.59 0.00 0.00 0.00 0.00 19.45 19.09 2ami n ALA 74 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 2ami h LYS 75 N 0.00 0.08 -0.02 0.00 1.57 -0.99 -3.51 116.57 113.69 2ami h LYS 75 Ca 0.00 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 2ami h LYS 75 Cb 0.02 -0.02 0.00 0.00 0.08 0.00 0.00 32.23 32.32 2ami h LYS 75 CO 0.00 0.07 0.00 0.00 -0.57 0.00 0.00 179.45 178.95