#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s5l h THR 2 N 0.00 1.00 -0.80 1.12 2.02 -2.03 -2.85 112.91 111.38 1s5l h THR 2 Ca 0.00 -0.01 -0.05 0.00 0.77 0.00 0.00 66.41 67.12 1s5l h THR 2 Cb 0.00 1.01 -0.04 0.00 -1.74 0.00 0.00 68.15 67.38 1s5l h THR 2 CO 0.00 0.00 0.31 0.40 0.37 0.00 0.00 175.52 176.61 1s5l h ILE 3 N 0.00 1.26 -0.36 3.11 2.04 -2.05 -1.07 117.51 120.43 1s5l h ILE 3 Ca 0.00 -0.84 -0.11 0.00 1.00 0.00 0.00 64.86 64.91 1s5l h ILE 3 Cb 0.01 0.31 -0.01 0.00 -0.74 0.00 0.00 36.82 36.39 1s5l h ILE 3 CO 0.00 0.34 -0.19 -0.07 0.00 0.00 0.00 178.15 178.23 1s5l h LEU 4 N 1.17 0.80 -0.71 1.44 3.38 -1.93 -2.29 115.31 117.16 1s5l h LEU 4 Ca 0.27 -0.41 -0.13 0.00 0.09 0.00 0.00 57.88 57.69 1s5l h LEU 4 Cb 0.23 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 1s5l h LEU 4 CO -0.02 1.03 -0.44 0.15 0.09 0.00 0.00 178.44 179.25 1s5l h PHE 5 N 0.56 0.56 0.00 1.13 -0.00 -1.58 1.40 116.94 119.01 1s5l h PHE 5 Ca 0.08 -0.17 0.00 0.00 -0.00 0.00 0.00 57.97 57.88 1s5l h PHE 5 Cb 0.74 -0.12 0.00 0.00 -0.00 0.00 0.00 35.95 36.57 1s5l h PHE 5 CO 0.06 0.83 0.00 1.96 -0.00 0.00 0.00 178.31 181.16 1s5l h GLN 6 N 0.38 0.00 0.00 1.11 4.20 -1.07 -0.93 115.11 118.80 1s5l h GLN 6 Ca 0.03 0.00 -0.24 0.00 0.06 0.00 0.00 58.65 58.49 1s5l h GLN 6 Cb 0.93 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.66 1s5l h GLN 6 CO 0.08 0.00 -1.92 1.28 -0.67 0.00 0.00 178.83 177.60 1s5l n LEU 7 N -2.33 1.05 -0.03 1.46 4.77 -0.84 -3.63 117.00 117.45 1s5l n LEU 7 Ca 0.02 -0.03 -0.11 0.00 -0.03 0.00 0.00 56.01 55.85 1s5l n LEU 7 Cb 0.22 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.25 1s5l n LEU 7 CO 0.20 0.49 0.83 0.00 -1.33 0.00 0.00 177.39 177.57 1s5l h ALA 8 N 0.42 0.15 0.45 -1.18 0.00 0.20 0.62 119.26 119.92 1s5l h ALA 8 Ca -0.36 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.42 1s5l h ALA 8 Cb 1.73 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.48 1s5l h ALA 8 CO -0.01 -0.25 -0.22 1.25 0.00 0.00 0.00 179.25 180.02 1s5l h LEU 9 N 0.03 -0.51 -1.69 0.00 5.85 -1.37 0.20 115.31 117.83 1s5l h LEU 9 Ca 0.04 0.02 0.15 0.00 0.84 0.00 0.00 57.88 58.92 1s5l h LEU 9 Cb 0.18 0.13 -0.02 0.00 0.37 0.00 0.00 40.66 41.32 1s5l h LEU 9 CO -0.00 -0.34 0.65 0.00 -0.34 0.00 0.00 178.44 178.40 1s5l h ALA 10 N -1.68 2.24 0.17 1.25 0.00 -1.62 0.83 119.26 120.45 1s5l h ALA 10 Ca -0.06 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 1s5l h ALA 10 Cb 0.46 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.29 1s5l h ALA 10 CO 0.10 -0.91 -0.08 0.00 0.00 0.00 0.00 179.25 178.36 1s5l h ALA 11 N 1.19 -0.23 0.00 0.00 0.00 0.12 -0.93 119.26 119.41 1s5l h ALA 11 Ca 0.24 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 1s5l h ALA 11 Cb 1.53 0.09 -0.00 0.00 0.00 0.00 0.00 17.79 19.41 1s5l h ALA 11 CO -0.00 -0.40 -0.07 1.25 0.00 0.00 0.00 179.25 180.03 1s5l h LEU 12 N -0.69 0.00 0.00 0.00 5.85 0.35 -1.98 115.31 118.84 1s5l h LEU 12 Ca -0.02 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.70 1s5l h LEU 12 Cb 0.49 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.52 1s5l h LEU 12 CO 0.04 0.07 0.00 0.52 -0.34 0.00 0.00 178.44 178.73 1s5l n VAL 13 N -3.29 0.00 -0.34 1.05 0.31 0.19 -2.65 118.33 113.61 1s5l n VAL 13 Ca -0.01 0.86 0.21 0.00 -0.01 0.00 0.00 64.34 65.39 1s5l n VAL 13 Cb 0.27 -1.74 0.43 0.00 -0.91 0.00 0.00 33.84 31.90 1s5l n VAL 13 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 1s5l h ILE 14 N 0.00 0.39 0.04 2.52 2.04 -1.15 0.92 117.51 122.28 1s5l h ILE 14 Ca 0.00 -0.14 0.02 0.00 1.00 0.00 0.00 64.86 65.73 1s5l h ILE 14 Cb 0.00 -0.06 -0.02 0.00 -0.74 0.00 0.00 36.82 35.99 1s5l h ILE 14 CO 0.00 0.08 -0.13 0.25 0.00 0.00 0.00 178.15 178.34 1s5l h LEU 15 N 0.42 -0.37 -0.57 1.44 5.85 -1.45 -2.18 115.31 118.45 1s5l h LEU 15 Ca 0.69 0.05 0.00 0.00 0.84 0.00 0.00 57.88 59.46 1s5l h LEU 15 Cb 1.47 0.15 -0.03 0.00 0.37 0.00 0.00 40.66 42.63 1s5l h LEU 15 CO -0.56 -0.19 0.36 0.28 -0.34 0.00 0.00 178.44 177.99 1s5l h SER 16 N -0.24 0.67 -0.65 1.25 0.02 -0.67 0.40 113.55 114.32 1s5l h SER 16 Ca 0.03 -0.04 0.13 0.00 -0.84 0.00 0.00 61.79 61.07 1s5l h SER 16 Cb 0.28 -0.17 -0.12 0.00 0.14 0.00 0.00 62.40 62.53 1s5l h SER 16 CO -0.10 0.51 -0.21 -0.26 -1.14 0.00 0.00 176.83 175.63 1s5l h PHE 17 N 0.77 -0.49 0.33 3.45 -1.00 -0.60 -1.93 116.94 117.45 1s5l h PHE 17 Ca 0.21 0.06 -0.02 0.00 2.81 0.00 0.00 57.97 61.03 1s5l h PHE 17 Cb -0.05 0.32 0.00 0.00 3.61 0.00 0.00 35.95 39.83 1s5l h PHE 17 CO -0.03 -0.31 -0.16 0.28 -1.61 0.00 0.00 178.31 176.48 1s5l h VAL 18 N -0.04 0.00 -0.49 -0.55 2.07 -0.98 -3.31 116.25 112.95 1s5l h VAL 18 Ca 0.30 -0.14 0.04 0.00 0.82 0.00 0.00 66.70 67.72 1s5l h VAL 18 Cb 0.51 0.00 -0.06 0.00 -1.52 0.00 0.00 31.29 30.22 1s5l h VAL 18 CO -0.69 0.00 -0.29 0.80 0.02 0.00 0.00 177.57 177.41 1s5l n MET 19 N -3.58 -0.22 0.26 1.57 0.00 0.09 0.17 117.12 115.41 1s5l n MET 19 Ca -0.05 0.83 0.15 0.00 0.00 0.00 0.00 57.70 58.63 1s5l n MET 19 Cb 0.17 -1.23 0.79 0.00 0.00 0.00 0.00 33.22 32.96 1s5l n MET 19 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 175.97 176.25 1s5l h VAL 20 N 0.00 0.00 0.00 1.12 2.07 -1.49 0.70 116.25 118.64 1s5l h VAL 20 Ca 0.08 0.00 -0.35 0.00 0.82 0.00 0.00 66.70 67.25 1s5l h VAL 20 Cb 0.20 0.64 -0.06 0.00 -1.52 0.00 0.00 31.29 30.55 1s5l h VAL 20 CO -0.46 0.00 -2.32 -0.38 0.02 0.00 0.00 177.57 174.43 1s5l n ILE 21 N -2.63 1.32 0.02 4.57 5.41 0.44 -4.62 119.36 123.87 1s5l n ILE 21 Ca -0.02 -0.66 -0.02 0.00 1.00 0.00 0.00 62.75 63.06 1s5l n ILE 21 Cb 0.20 -0.92 -0.01 0.00 -0.71 0.00 0.00 39.64 38.19 1s5l n ILE 21 CO 0.00 0.00 0.00 1.23 0.00 0.00 0.00 176.55 177.78 1s5l h GLY 22 N 2.76 -0.12 -0.52 7.39 0.00 0.21 -3.33 103.07 109.46 1s5l h GLY 22 Ca -0.52 0.04 0.18 0.00 0.00 0.00 0.00 47.33 47.03 1s5l h GLY 22 CO -0.03 -0.04 0.13 -0.62 0.00 0.00 0.00 176.54 175.98 1s5l n VAL 23 N -3.93 -0.22 -0.05 4.60 0.31 0.16 0.42 118.33 119.61 1s5l n VAL 23 Ca -0.01 1.10 -0.13 0.00 -0.01 0.00 0.00 64.34 65.28 1s5l n VAL 23 Cb 0.05 -1.69 -0.07 0.00 -0.91 0.00 0.00 33.84 31.22 1s5l n VAL 23 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 1s5l h PRO 24 N 0.00 0.36 -0.09 5.55 0.11 -1.79 -3.16 132.00 132.99 1s5l h PRO 24 Ca 0.37 -0.21 -0.05 0.00 0.11 0.00 0.00 66.00 66.23 1s5l h PRO 24 Cb 0.89 0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.00 1s5l h PRO 24 CO -0.45 0.78 -0.16 0.28 -0.21 0.00 0.00 178.00 178.24 1s5l h VAL 25 N -0.03 1.16 -0.10 3.15 2.07 -0.15 -1.72 116.25 120.64 1s5l h VAL 25 Ca 0.02 -0.74 0.03 0.00 0.82 0.00 0.00 66.70 66.83 1s5l h VAL 25 Cb 0.73 1.28 -0.00 0.00 -1.52 0.00 0.00 31.29 31.77 1s5l h VAL 25 CO 0.04 0.22 0.09 0.00 0.02 0.00 0.00 177.57 177.95 1s5l h ALA 26 N 1.72 1.80 -0.55 1.67 0.00 -1.18 -1.41 119.26 121.30 1s5l h ALA 26 Ca 0.03 -0.00 -0.36 0.00 0.00 0.00 0.00 54.91 54.57 1s5l h ALA 26 Cb 0.36 0.01 -0.16 0.00 0.00 0.00 0.00 17.79 18.00 1s5l h ALA 26 CO 0.02 -0.14 0.47 0.66 0.00 0.00 0.00 179.25 180.26 1s5l n TYR 27 N -4.04 1.78 -3.32 0.00 4.02 -0.65 -4.53 117.16 110.43 1s5l n TYR 27 Ca -0.01 -2.01 -0.33 0.00 -0.01 0.00 0.00 57.90 55.55 1s5l n TYR 27 Cb 0.20 -0.98 -0.05 0.00 -0.02 0.00 0.00 39.34 38.49 1s5l n TYR 27 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1s5l n ALA 28 N 0.08 4.39 0.00 -0.72 0.00 -0.53 -4.99 120.51 118.74 1s5l n ALA 28 Ca 0.35 -4.76 0.00 0.00 0.00 0.00 0.00 53.44 49.02 1s5l n ALA 28 Cb 0.67 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 18.66 1s5l n ALA 28 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1s5l n SER 29 N 1.18 0.00 -0.06 0.00 2.88 -1.26 -0.32 113.62 116.03 1s5l n SER 29 Ca 0.28 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.82 1s5l n SER 29 Cb 0.38 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.84 1s5l n SER 29 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1s5l n PRO 30 N -3.20 0.84 -3.94 -1.46 -0.04 -1.26 -4.31 135.00 121.62 1s5l n PRO 30 Ca 0.00 0.00 -0.31 0.00 -0.04 0.00 0.00 63.50 63.15 1s5l n PRO 30 Cb 0.00 -1.05 -0.15 0.00 -0.04 0.00 0.00 33.50 32.26 1s5l n PRO 30 CO 0.00 0.00 0.00 -1.14 -0.04 0.00 0.00 175.50 174.32 1s5l s GLN 31 N -1.88 1.40 0.00 0.54 0.74 0.56 -5.06 119.66 115.96 1s5l s GLN 31 Ca 0.00 -1.48 0.00 0.00 0.05 0.00 0.00 55.36 53.93 1s5l s GLN 31 Cb 0.00 -2.78 0.00 0.00 1.10 0.00 0.00 33.01 31.33 1s5l s GLN 31 CO 0.00 -0.85 0.00 -0.25 -0.55 0.00 0.00 175.29 173.64 1s5l n ASP 32 N 4.48 0.00 0.08 6.67 8.00 -1.26 -4.78 116.55 129.75 1s5l n ASP 32 Ca -0.02 0.00 0.04 0.00 0.71 0.00 0.00 54.79 55.52 1s5l n ASP 32 Cb 0.42 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.50 1s5l n ASP 32 CO 0.00 0.00 0.00 4.11 -0.39 0.00 0.00 177.20 180.92 1s5l h TRP 33 N 0.00 0.00 -0.00 1.24 5.08 -1.87 -3.29 115.95 117.11 1s5l h TRP 33 Ca 0.00 0.00 0.03 0.00 1.08 0.00 0.00 58.89 60.00 1s5l h TRP 33 Cb 0.00 0.00 -0.05 0.00 -3.00 0.00 0.00 29.16 26.11 1s5l h TRP 33 CO 0.00 0.39 -0.26 -0.44 -1.28 0.00 0.00 178.44 176.85 1s5l h ASP 34 N 0.00 -0.77 -0.19 0.11 5.19 -1.98 0.65 116.42 119.43 1s5l h ASP 34 Ca -0.08 0.11 -0.05 0.00 -0.62 0.00 0.00 57.03 56.38 1s5l h ASP 34 Cb 1.37 0.32 -0.01 0.00 0.18 0.00 0.00 39.33 41.19 1s5l h ASP 34 CO 0.04 -0.33 -0.08 0.03 -3.12 0.00 0.00 179.24 175.78 1s5l h ARG 35 N -0.40 0.40 -0.44 3.56 3.08 -1.96 -3.16 114.38 115.45 1s5l h ARG 35 Ca 0.06 -0.17 -0.10 0.00 0.07 0.00 0.00 59.98 59.85 1s5l h ARG 35 Cb 0.49 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.51 1s5l h ARG 35 CO -0.23 0.68 -0.11 0.77 -1.07 0.00 0.00 179.97 180.01 1s5l h SER 36 N 0.10 0.86 0.34 7.04 0.02 -1.59 -3.18 113.55 117.14 1s5l h SER 36 Ca 0.04 -0.36 -0.05 0.00 -0.84 0.00 0.00 61.79 60.59 1s5l h SER 36 Cb 0.56 -0.24 -0.01 0.00 0.14 0.00 0.00 62.40 62.85 1s5l h SER 36 CO 0.03 1.03 -0.22 0.11 -1.14 0.00 0.00 176.83 176.63 1s5l h LYS 37 N 0.69 0.00 0.21 3.45 6.56 0.24 -2.94 116.57 124.78 1s5l h LYS 37 Ca 0.11 0.00 -0.01 0.00 -1.06 0.00 0.00 60.65 59.69 1s5l h LYS 37 Cb 0.65 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 32.30 1s5l h LYS 37 CO 0.04 0.22 -0.18 1.96 -2.06 0.00 0.00 179.45 179.44 1s5l h GLN 38 N 0.00 -0.37 -1.06 3.15 4.20 -1.52 -2.52 115.11 117.00 1s5l h GLN 38 Ca -0.00 0.03 0.31 0.00 0.06 0.00 0.00 58.65 59.04 1s5l h GLN 38 Cb 0.45 0.08 -0.04 0.00 0.30 0.00 0.00 27.48 28.28 1s5l h GLN 38 CO 0.03 -0.24 0.94 -0.07 -0.67 0.00 0.00 178.83 178.81 1s5l h LEU 39 N -0.38 0.00 0.55 1.46 3.38 -1.63 -2.37 115.31 116.32 1s5l h LEU 39 Ca -0.03 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.92 1s5l h LEU 39 Cb 0.32 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.08 1s5l h LEU 39 CO -0.01 0.00 -0.26 0.40 0.09 0.00 0.00 178.44 178.66 1s5l h ILE 40 N 0.00 0.00 0.00 1.22 2.04 -1.27 0.46 117.51 119.96 1s5l h ILE 40 Ca 0.50 -0.20 0.00 0.00 1.00 0.00 0.00 64.86 66.17 1s5l h ILE 40 Cb 2.37 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 38.45 1s5l h ILE 40 CO -0.01 0.00 0.04 0.49 0.00 0.00 0.00 178.15 178.68 1s5l n PHE 41 N -4.52 0.65 -0.06 1.37 3.01 -0.91 -0.87 117.46 116.13 1s5l n PHE 41 Ca -0.09 0.34 -0.08 0.00 1.01 0.00 0.00 57.45 58.63 1s5l n PHE 41 Cb 0.29 -1.02 -0.07 0.00 -0.01 0.00 0.00 39.48 38.67 1s5l n PHE 41 CO 0.00 0.00 0.00 1.25 1.01 0.00 0.00 176.76 179.02 1s5l h LEU 42 N 0.00 0.00 -0.95 4.37 5.85 -1.27 1.00 115.31 124.31 1s5l h LEU 42 Ca 0.00 -0.56 0.01 0.00 0.84 0.00 0.00 57.88 58.17 1s5l h LEU 42 Cb 0.08 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.06 1s5l h LEU 42 CO 0.00 0.79 0.63 1.23 -0.34 0.00 0.00 178.44 180.75 1s5l h GLY 43 N -1.00 1.34 0.93 3.75 0.00 0.17 0.84 103.07 109.09 1s5l h GLY 43 Ca -0.00 -0.50 -0.08 0.00 0.00 0.00 0.00 47.33 46.75 1s5l h GLY 43 CO -0.00 0.48 -0.12 1.76 0.00 0.00 0.00 176.54 178.66 1s5l h SER 44 N 1.28 0.68 0.16 0.19 0.02 -1.12 0.93 113.55 115.68 1s5l h SER 44 Ca 0.35 -0.39 -0.01 0.00 -0.84 0.00 0.00 61.79 60.90 1s5l h SER 44 Cb -0.14 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 62.22 1s5l h SER 44 CO -0.08 0.91 -0.08 1.23 -1.14 0.00 0.00 176.83 177.68 1s5l h GLY 45 N 0.44 -0.22 0.68 -3.77 0.00 -0.43 -2.16 103.07 97.61 1s5l h GLY 45 Ca 0.08 0.08 0.04 0.00 0.00 0.00 0.00 47.33 47.53 1s5l h GLY 45 CO 0.04 -0.08 0.13 -2.00 0.00 0.00 0.00 176.54 174.63 1s5l h LEU 46 N -0.55 0.14 0.27 3.11 5.85 0.74 -2.84 115.31 122.04 1s5l h LEU 46 Ca -0.02 0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.73 1s5l h LEU 46 Cb 0.42 0.03 -0.00 0.00 0.37 0.00 0.00 40.66 41.47 1s5l h LEU 46 CO 0.04 0.12 -0.16 -0.25 -0.34 0.00 0.00 178.44 177.84 1s5l h TRP 47 N 0.28 -0.43 -0.26 1.25 2.91 0.91 -0.97 115.95 119.64 1s5l h TRP 47 Ca 0.17 -0.01 0.08 0.00 1.13 0.00 0.00 58.89 60.26 1s5l h TRP 47 Cb 0.14 0.15 -0.01 0.00 -0.51 0.00 0.00 29.16 28.94 1s5l h TRP 47 CO -0.14 -0.25 0.54 0.97 -1.03 0.00 0.00 178.44 178.53 1s5l h ILE 48 N -0.41 0.14 0.00 2.65 2.10 -1.43 0.46 117.51 121.02 1s5l h ILE 48 Ca -0.04 0.00 -0.02 0.00 1.08 0.00 0.00 64.86 65.88 1s5l h ILE 48 Cb 0.32 0.52 0.00 0.00 -1.09 0.00 0.00 36.82 36.57 1s5l h ILE 48 CO 0.04 0.00 -0.08 0.00 -1.08 0.00 0.00 178.15 177.03 1s5l h ALA 49 N 1.17 0.01 -0.91 0.18 0.00 -1.21 -2.92 119.26 115.57 1s5l h ALA 49 Ca 0.12 -0.44 0.07 0.00 0.00 0.00 0.00 54.91 54.66 1s5l h ALA 49 Cb 1.20 0.01 -0.07 0.00 0.00 0.00 0.00 17.79 18.93 1s5l h ALA 49 CO -0.00 -0.02 0.57 -0.07 0.00 0.00 0.00 179.25 179.72 1s5l h LEU 50 N -0.75 0.88 -0.94 0.00 3.38 0.11 0.14 115.31 118.12 1s5l h LEU 50 Ca -0.01 0.02 0.15 0.00 0.09 0.00 0.00 57.88 58.13 1s5l h LEU 50 Cb 0.91 -0.16 -0.09 0.00 0.09 0.00 0.00 40.66 41.40 1s5l h LEU 50 CO 0.02 0.54 0.56 0.58 0.09 0.00 0.00 178.44 180.23 1s5l h VAL 51 N 1.00 0.80 0.00 1.22 2.07 -0.51 -1.00 116.25 119.83 1s5l h VAL 51 Ca 0.41 -0.28 -0.11 0.00 0.82 0.00 0.00 66.70 67.54 1s5l h VAL 51 Cb 0.23 -0.07 -0.02 0.00 -1.52 0.00 0.00 31.29 29.91 1s5l h VAL 51 CO -0.19 0.15 -0.55 -0.07 0.02 0.00 0.00 177.57 176.92 1s5l h LEU 52 N 0.80 0.00 0.49 2.57 3.38 -0.59 -2.99 115.31 118.98 1s5l h LEU 52 Ca 0.50 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.45 1s5l h LEU 52 Cb 0.64 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.40 1s5l h LEU 52 CO -0.33 0.53 -0.24 0.58 0.09 0.00 0.00 178.44 179.07 1s5l h VAL 53 N 0.00 0.00 -0.76 1.22 2.07 0.05 -1.90 116.25 116.93 1s5l h VAL 53 Ca -0.01 -0.32 0.08 0.00 0.82 0.00 0.00 66.70 67.27 1s5l h VAL 53 Cb 1.41 0.00 -0.11 0.00 -1.52 0.00 0.00 31.29 31.07 1s5l h VAL 53 CO 0.07 0.00 -0.55 0.58 0.02 0.00 0.00 177.57 177.69 1s5l h VAL 54 N -0.98 0.01 -0.47 2.57 2.07 -1.36 -0.30 116.25 117.78 1s5l h VAL 54 Ca -0.07 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.53 1s5l h VAL 54 Cb 0.51 0.01 -0.10 0.00 -1.52 0.00 0.00 31.29 30.19 1s5l h VAL 54 CO 0.11 0.00 -0.43 1.23 0.02 0.00 0.00 177.57 178.50 1s5l h GLY 55 N -0.16 -0.53 1.99 2.17 0.00 -1.56 0.15 103.07 105.13 1s5l h GLY 55 Ca 0.15 0.56 0.00 0.00 0.00 0.00 0.00 47.33 48.03 1s5l h GLY 55 CO -0.80 -0.17 0.00 -2.08 0.00 0.00 0.00 176.54 173.49 1s5l h VAL 56 N -0.29 0.26 -0.01 4.60 2.07 -0.36 -2.20 116.25 120.31 1s5l h VAL 56 Ca 0.15 0.00 -0.15 0.00 0.82 0.00 0.00 66.70 67.52 1s5l h VAL 56 Cb 0.57 1.00 -0.02 0.00 -1.52 0.00 0.00 31.29 31.32 1s5l h VAL 56 CO -0.62 0.00 -0.70 -0.07 0.02 0.00 0.00 177.57 176.20 1s5l h LEU 57 N 0.00 0.06 0.00 2.57 3.38 0.93 -3.51 115.31 118.74 1s5l h LEU 57 Ca 0.00 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.93 1s5l h LEU 57 Cb 0.01 -0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.74 1s5l h LEU 57 CO -0.00 0.74 0.00 0.59 0.09 0.00 0.00 178.44 179.86