#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1lko s SER 3 N 0.00 5.22 0.15 -5.58 0.15 -1.26 -4.96 113.70 107.42 1lko s SER 3 Ca 0.00 2.31 0.22 0.00 0.70 0.00 0.00 55.95 59.19 1lko s SER 3 Cb 0.00 -2.59 -0.06 0.00 -1.71 0.00 0.00 66.02 61.66 1lko s SER 3 CO 0.00 -1.57 0.94 0.18 1.20 0.00 0.00 173.24 173.99 1lko n LEU 4 N -1.68 0.67 -4.69 3.45 4.77 -1.26 -4.93 117.00 113.33 1lko n LEU 4 Ca 0.13 0.25 -0.66 0.00 -0.03 0.00 0.00 56.01 55.70 1lko n LEU 4 Cb 0.50 -0.05 -0.09 0.00 -2.33 0.00 0.00 43.42 41.44 1lko n LEU 4 CO 0.44 -0.14 1.01 0.29 -1.33 0.00 0.00 177.39 177.67 1lko n LYS 5 N -2.55 0.02 -0.20 3.23 4.76 -1.26 -0.92 118.16 121.24 1lko n LYS 5 Ca -0.01 0.01 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 1lko n LYS 5 Cb 0.55 -1.51 0.00 0.00 -1.84 0.00 0.00 35.03 32.22 1lko n LYS 5 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1lko n GLY 6 N 3.39 2.49 3.87 0.72 0.00 -1.26 -5.02 105.19 109.38 1lko n GLY 6 Ca 0.28 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 46.00 1lko n GLY 6 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1lko s SER 7 N -3.73 5.69 0.25 1.61 1.04 -0.10 -4.96 113.70 113.52 1lko s SER 7 Ca 0.00 1.29 0.06 0.00 0.48 0.00 0.00 55.95 57.79 1lko s SER 7 Cb 0.00 -2.19 0.30 0.00 0.10 0.00 0.00 66.02 64.23 1lko s SER 7 CO 0.00 -1.20 1.59 0.03 0.98 0.00 0.00 173.24 174.64 1lko h ARG 8 N -0.55 0.18 -0.66 4.02 3.08 -1.95 -3.00 114.38 115.50 1lko h ARG 8 Ca -0.45 -0.12 -0.02 0.00 0.07 0.00 0.00 59.98 59.47 1lko h ARG 8 Cb 1.23 0.02 -0.03 0.00 0.08 0.00 0.00 29.97 31.26 1lko h ARG 8 CO 0.62 0.71 0.34 1.15 -1.07 0.00 0.00 179.97 181.72 1lko h THR 9 N 0.13 1.20 -0.28 2.04 2.02 -1.90 0.29 112.91 116.42 1lko h THR 9 Ca -0.00 -0.54 0.01 0.00 0.77 0.00 0.00 66.41 66.64 1lko h THR 9 Cb 1.07 0.34 -0.02 0.00 -1.74 0.00 0.00 68.15 67.80 1lko h THR 9 CO 0.09 0.23 0.17 -0.08 0.37 0.00 0.00 175.52 176.30 1lko h GLU 10 N 0.92 0.34 -0.61 6.66 4.81 -1.73 0.94 114.58 125.91 1lko h GLU 10 Ca 0.23 -0.02 -0.03 0.00 -0.13 0.00 0.00 59.36 59.41 1lko h GLU 10 Cb 0.06 -0.08 -0.03 0.00 0.63 0.00 0.00 28.75 29.33 1lko h GLU 10 CO -0.03 0.22 0.27 0.87 -0.73 0.00 0.00 179.01 179.61 1lko h LYS 11 N 0.35 0.89 -0.71 1.92 1.79 -1.43 -2.42 116.57 116.96 1lko h LYS 11 Ca 0.11 -0.14 -0.03 0.00 -2.18 0.00 0.00 60.65 58.40 1lko h LYS 11 Cb -0.01 -0.15 -0.03 0.00 -1.58 0.00 0.00 32.23 30.45 1lko h LYS 11 CO -0.04 0.73 0.31 -0.91 -1.08 0.00 0.00 179.45 178.46 1lko h ASN 12 N 0.84 0.94 -0.41 0.86 2.35 -0.42 0.16 115.58 119.90 1lko h ASN 12 Ca 0.21 -0.12 -0.02 0.00 -0.55 0.00 0.00 56.30 55.81 1lko h ASN 12 Cb 0.16 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 38.26 1lko h ASN 12 CO -0.02 0.83 0.16 0.40 -1.65 0.00 0.00 177.43 177.15 1lko h ILE 13 N 1.02 1.20 -0.45 2.81 2.04 -0.54 0.13 117.51 123.72 1lko h ILE 13 Ca 0.24 -0.61 -0.09 0.00 1.00 0.00 0.00 64.86 65.40 1lko h ILE 13 Cb 0.16 0.84 -0.02 0.00 -0.74 0.00 0.00 36.82 37.06 1lko h ILE 13 CO -0.03 0.22 -0.10 0.25 0.00 0.00 0.00 178.15 178.50 1lko h LEU 14 N 0.52 0.79 -0.57 1.44 5.85 -1.06 0.10 115.31 122.39 1lko h LEU 14 Ca 0.14 -0.23 -0.03 0.00 0.84 0.00 0.00 57.88 58.59 1lko h LEU 14 Cb 0.19 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 40.98 1lko h LEU 14 CO -0.01 0.92 0.24 0.74 -0.34 0.00 0.00 178.44 179.99 1lko h THR 15 N 0.73 1.22 -0.54 1.05 2.02 -0.61 0.52 112.91 117.30 1lko h THR 15 Ca 0.13 -0.65 -0.07 0.00 0.77 0.00 0.00 66.41 66.59 1lko h THR 15 Cb 0.58 0.59 -0.02 0.00 -1.74 0.00 0.00 68.15 67.56 1lko h THR 15 CO 0.04 0.26 0.09 0.00 0.37 0.00 0.00 175.52 176.27 1lko h ALA 16 N 1.09 0.72 -0.77 6.16 0.00 -0.38 -1.80 119.26 124.28 1lko h ALA 16 Ca 0.19 -0.25 0.01 0.00 0.00 0.00 0.00 54.91 54.87 1lko h ALA 16 Cb 0.17 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.72 1lko h ALA 16 CO -0.02 0.47 0.50 0.35 0.00 0.00 0.00 179.25 180.55 1lko h PHE 17 N 0.79 0.95 -0.41 0.00 3.57 -0.33 0.17 116.94 121.67 1lko h PHE 17 Ca 0.16 0.02 -0.01 0.00 3.53 0.00 0.00 57.97 61.68 1lko h PHE 17 Cb 0.41 -0.32 -0.02 0.00 2.79 0.00 0.00 35.95 38.81 1lko h PHE 17 CO 0.03 0.58 0.21 0.00 -2.23 0.00 0.00 178.31 176.90 1lko h ALA 18 N 1.29 0.52 -0.44 2.41 0.00 -0.58 -0.98 119.26 121.48 1lko h ALA 18 Ca 0.29 -0.09 -0.08 0.00 0.00 0.00 0.00 54.91 55.03 1lko h ALA 18 Cb -0.08 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 1lko h ALA 18 CO -0.08 0.06 -0.02 0.78 0.00 0.00 0.00 179.25 179.99 1lko h GLY 19 N 0.52 0.86 0.90 0.00 0.00 -0.89 -2.27 103.07 102.19 1lko h GLY 19 Ca 0.14 -0.65 0.02 0.00 0.00 0.00 0.00 47.33 46.84 1lko h GLY 19 CO -0.02 0.60 0.38 0.83 0.00 0.00 0.00 176.54 178.32 1lko h GLU 20 N 0.64 0.72 -0.57 4.80 4.39 -0.53 -0.77 114.58 123.26 1lko h GLU 20 Ca 0.12 -0.04 -0.00 0.00 0.34 0.00 0.00 59.36 59.77 1lko h GLU 20 Cb 0.53 -0.16 -0.03 0.00 -0.10 0.00 0.00 28.75 28.99 1lko h GLU 20 CO 0.03 0.48 0.34 0.77 -1.16 0.00 0.00 179.01 179.47 1lko h SER 21 N 0.75 0.69 -0.08 1.42 0.02 -1.03 -1.58 113.55 113.73 1lko h SER 21 Ca 0.24 -0.06 -0.12 0.00 -0.84 0.00 0.00 61.79 61.00 1lko h SER 21 Cb -0.00 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.35 1lko h SER 21 CO -0.09 0.55 -0.35 1.56 -1.14 0.00 0.00 176.83 177.36 1lko h GLN 22 N 0.77 0.58 -0.81 3.45 4.20 -1.10 -2.92 115.11 119.29 1lko h GLN 22 Ca 0.21 -0.27 -0.03 0.00 0.06 0.00 0.00 58.65 58.61 1lko h GLN 22 Cb -0.01 -0.01 -0.04 0.00 0.30 0.00 0.00 27.48 27.72 1lko h GLN 22 CO -0.04 0.85 0.39 0.00 -0.67 0.00 0.00 178.83 179.37 1lko h ALA 23 N 1.13 1.05 -0.27 3.87 0.00 -0.76 -0.73 119.26 123.54 1lko h ALA 23 Ca 0.05 -0.16 0.03 0.00 0.00 0.00 0.00 54.91 54.84 1lko h ALA 23 Cb 0.84 -0.32 -0.03 0.00 0.00 0.00 0.00 17.79 18.27 1lko h ALA 23 CO 0.07 0.61 0.07 -0.09 0.00 0.00 0.00 179.25 179.91 1lko h ARG 24 N 1.15 0.18 0.10 0.00 2.43 -1.11 0.22 114.38 117.35 1lko h ARG 24 Ca 0.28 -0.01 -0.00 0.00 -0.81 0.00 0.00 59.98 59.43 1lko h ARG 24 Cb 0.11 -0.04 0.00 0.00 -0.42 0.00 0.00 29.97 29.62 1lko h ARG 24 CO -0.04 0.12 -0.05 -0.91 -1.51 0.00 0.00 179.97 177.59 1lko h ASN 25 N 0.19 -0.11 -0.57 -3.80 -0.26 -1.34 -2.04 115.58 107.64 1lko h ASN 25 Ca 0.12 -0.14 0.08 0.00 -0.56 0.00 0.00 56.30 55.81 1lko h ASN 25 Cb 0.11 0.03 -0.07 0.00 -1.06 0.00 0.00 38.32 37.33 1lko h ASN 25 CO -0.14 0.07 0.20 0.03 -1.06 0.00 0.00 177.43 176.53 1lko h ARG 26 N -0.29 0.37 -0.45 0.81 3.08 -0.92 -1.02 114.38 115.96 1lko h ARG 26 Ca -0.01 -0.02 -0.06 0.00 0.07 0.00 0.00 59.98 59.95 1lko h ARG 26 Cb 0.24 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.19 1lko h ARG 26 CO 0.02 0.24 0.02 1.88 -1.07 0.00 0.00 179.97 181.07 1lko h TYR 27 N 0.38 0.76 -0.52 3.04 0.05 -0.87 -0.22 116.97 119.58 1lko h TYR 27 Ca 0.28 -0.09 -0.10 0.00 0.05 0.00 0.00 58.73 58.87 1lko h TYR 27 Cb 0.34 -0.21 -0.02 0.00 1.01 0.00 0.00 36.73 37.84 1lko h TYR 27 CO -0.17 0.70 -0.08 -0.91 -1.05 0.00 0.00 178.16 176.65 1lko h ASN 28 N 0.68 0.93 -0.46 3.88 -0.26 -0.58 0.29 115.58 120.07 1lko h ASN 28 Ca 0.14 -0.29 -0.07 0.00 -0.56 0.00 0.00 56.30 55.52 1lko h ASN 28 Cb 0.39 -0.25 -0.02 0.00 -1.06 0.00 0.00 38.32 37.38 1lko h ASN 28 CO 0.01 1.04 0.02 1.88 -1.06 0.00 0.00 177.43 179.32 1lko h TYR 29 N 0.85 0.86 -0.19 1.19 0.05 -0.70 -1.82 116.97 117.21 1lko h TYR 29 Ca 0.14 -0.14 -0.05 0.00 0.05 0.00 0.00 58.73 58.73 1lko h TYR 29 Cb 0.62 -0.23 -0.01 0.00 1.01 0.00 0.00 36.73 38.12 1lko h TYR 29 CO 0.04 0.82 -0.09 0.74 -1.05 0.00 0.00 178.16 178.62 1lko h PHE 30 N 0.65 0.30 -0.61 4.88 0.04 -0.84 -1.29 116.94 120.07 1lko h PHE 30 Ca 0.13 -0.03 -0.04 0.00 2.80 0.00 0.00 57.97 60.83 1lko h PHE 30 Cb 0.47 -0.09 -0.03 0.00 2.20 0.00 0.00 35.95 38.50 1lko h PHE 30 CO 0.04 0.39 0.21 0.78 -0.60 0.00 0.00 178.31 179.13 1lko h GLY 31 N 0.73 1.00 1.05 -1.45 0.00 -0.44 0.70 103.07 104.67 1lko h GLY 31 Ca 0.06 -0.57 -0.05 0.00 0.00 0.00 0.00 47.33 46.77 1lko h GLY 31 CO 0.02 0.53 0.28 -1.33 0.00 0.00 0.00 176.54 176.05 1lko h GLY 32 N 0.86 1.27 1.28 4.60 0.00 -0.51 -2.12 103.07 108.45 1lko h GLY 32 Ca 0.20 -0.72 -0.11 0.00 0.00 0.00 0.00 47.33 46.70 1lko h GLY 32 CO -0.01 0.67 -0.17 -1.61 0.00 0.00 0.00 176.54 175.42 1lko h GLN 33 N 1.14 0.83 -0.42 4.80 5.75 -0.83 -2.36 115.11 124.02 1lko h GLN 33 Ca 0.26 -0.31 -0.03 0.00 -0.15 0.00 0.00 58.65 58.42 1lko h GLN 33 Cb 0.26 -0.05 -0.02 0.00 1.07 0.00 0.00 27.48 28.73 1lko h GLN 33 CO -0.02 0.94 0.15 0.00 -2.65 0.00 0.00 178.83 177.26 1lko h ALA 34 N 1.07 1.48 -0.35 3.38 0.00 -0.53 0.47 119.26 124.78 1lko h ALA 34 Ca 0.11 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 1lko h ALA 34 Cb 0.69 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 1lko h ALA 34 CO 0.05 0.40 0.03 -0.22 0.00 0.00 0.00 179.25 179.51 1lko h LYS 35 N 0.60 0.59 -0.19 0.00 1.63 -1.05 0.03 116.57 118.19 1lko h LYS 35 Ca 0.15 -0.17 -0.05 0.00 -0.85 0.00 0.00 60.65 59.72 1lko h LYS 35 Cb 0.15 -0.06 -0.01 0.00 -0.60 0.00 0.00 32.23 31.71 1lko h LYS 35 CO -0.01 0.69 -0.10 0.87 -3.45 0.00 0.00 179.45 177.45 1lko h LYS 36 N 0.41 0.29 -0.02 1.90 1.57 -0.82 -1.85 116.57 118.05 1lko h LYS 36 Ca 0.10 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.82 1lko h LYS 36 Cb 0.41 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.67 1lko h LYS 36 CO 0.01 0.40 0.00 -0.25 -0.57 0.00 0.00 179.45 179.05 1lko n ASP 37 N -4.28 0.41 -0.12 0.86 8.00 0.08 -4.91 116.55 116.58 1lko n ASP 37 Ca -0.00 -1.28 -0.01 0.00 0.71 0.00 0.00 54.79 54.21 1lko n ASP 37 Cb 0.26 -0.01 0.00 0.00 -0.02 0.00 0.00 41.12 41.35 1lko n ASP 37 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1lko n GLY 38 N 0.98 0.42 2.83 0.44 0.00 -0.69 -5.02 105.19 104.14 1lko n GLY 38 Ca 0.19 -0.84 -0.28 0.00 0.00 0.00 0.00 46.02 45.09 1lko n GLY 38 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1lko s PHE 39 N -2.14 3.11 0.10 1.61 0.08 -0.04 -4.34 117.98 116.36 1lko s PHE 39 Ca 0.00 -3.14 -0.18 0.00 0.12 0.00 0.00 56.93 53.73 1lko s PHE 39 Cb -0.00 -2.43 -0.06 0.00 -0.57 0.00 0.00 43.02 39.96 1lko s PHE 39 CO 0.00 -0.62 1.61 0.28 -0.10 0.00 0.00 175.22 176.40 1lko h VAL 40 N 4.58 1.20 -0.49 -0.44 2.07 -1.60 0.22 116.25 121.80 1lko h VAL 40 Ca 0.13 -0.66 0.02 0.00 0.82 0.00 0.00 66.70 67.01 1lko h VAL 40 Cb 0.80 1.11 -0.03 0.00 -1.52 0.00 0.00 31.29 31.64 1lko h VAL 40 CO 0.66 0.22 0.29 -0.61 0.02 0.00 0.00 177.57 178.15 1lko h GLN 41 N 0.29 0.57 -0.68 1.57 4.15 -1.85 -0.34 115.11 118.82 1lko h GLN 41 Ca 0.09 -0.03 -0.06 0.00 0.77 0.00 0.00 58.65 59.42 1lko h GLN 41 Cb 0.26 -0.13 -0.03 0.00 0.21 0.00 0.00 27.48 27.79 1lko h GLN 41 CO -0.00 0.38 0.20 0.82 -1.93 0.00 0.00 178.83 178.30 1lko h ILE 42 N 0.59 1.25 -0.40 2.39 2.04 -1.92 -0.96 117.51 120.51 1lko h ILE 42 Ca 0.20 -0.88 0.01 0.00 1.00 0.00 0.00 64.86 65.18 1lko h ILE 42 Cb 0.01 0.51 -0.02 0.00 -0.74 0.00 0.00 36.82 36.58 1lko h ILE 42 CO -0.09 0.34 0.26 -1.28 0.00 0.00 0.00 178.15 177.38 1lko h SER 43 N 1.02 0.44 0.43 1.72 0.87 -0.16 -0.80 113.55 117.07 1lko h SER 43 Ca 0.22 -0.01 -0.07 0.00 -1.23 0.00 0.00 61.79 60.70 1lko h SER 43 Cb 0.30 -0.11 -0.01 0.00 -0.44 0.00 0.00 62.40 62.15 1lko h SER 43 CO -0.01 0.32 -0.35 0.44 -0.53 0.00 0.00 176.83 176.70 1lko h ASP 44 N 0.52 0.00 -0.36 6.23 3.32 -0.76 -1.83 116.42 123.55 1lko h ASP 44 Ca 0.15 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 57.08 1lko h ASP 44 Cb -0.05 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.49 1lko h ASP 44 CO -0.04 0.35 -0.24 0.40 -1.72 0.00 0.00 179.24 177.99 1lko h ILE 45 N 0.00 1.29 -0.67 0.35 1.08 -0.52 0.10 117.51 119.14 1lko h ILE 45 Ca -0.00 -1.38 -0.02 0.00 -0.39 0.00 0.00 64.86 63.06 1lko h ILE 45 Cb 0.66 1.40 -0.03 0.00 -3.07 0.00 0.00 36.82 35.78 1lko h ILE 45 CO 0.05 0.46 0.34 -0.26 -0.69 0.00 0.00 178.15 178.04 1lko h PHE 46 N 0.58 0.94 -0.50 1.37 0.04 -0.78 0.61 116.94 119.21 1lko h PHE 46 Ca 0.07 -0.04 -0.05 0.00 2.80 0.00 0.00 57.97 60.76 1lko h PHE 46 Cb 0.80 -0.30 -0.02 0.00 2.20 0.00 0.00 35.95 38.63 1lko h PHE 46 CO 0.06 0.69 0.12 0.00 -0.60 0.00 0.00 178.31 178.59 1lko h ALA 47 N 1.16 0.66 -0.53 2.45 0.00 -1.16 -0.56 119.26 121.27 1lko h ALA 47 Ca 0.23 -0.21 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 1lko h ALA 47 Cb 0.09 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 1lko h ALA 47 CO -0.03 0.35 0.12 1.49 0.00 0.00 0.00 179.25 181.18 1lko h GLU 48 N 0.69 0.86 -0.78 0.00 4.81 -0.67 -1.44 114.58 118.05 1lko h GLU 48 Ca 0.16 -0.21 -0.02 0.00 -0.13 0.00 0.00 59.36 59.16 1lko h GLU 48 Cb 0.33 -0.11 -0.04 0.00 0.63 0.00 0.00 28.75 29.56 1lko h GLU 48 CO 0.00 0.82 0.43 1.15 -0.73 0.00 0.00 179.01 180.68 1lko h THR 49 N 0.75 1.23 -0.64 0.32 2.02 -0.68 -0.89 112.91 115.04 1lko h THR 49 Ca 0.16 -0.58 0.02 0.00 0.77 0.00 0.00 66.41 66.78 1lko h THR 49 Cb 0.36 0.20 -0.04 0.00 -1.74 0.00 0.00 68.15 66.93 1lko h THR 49 CO 0.00 0.26 0.41 0.00 0.37 0.00 0.00 175.52 176.56 1lko h ALA 50 N 1.22 0.82 -0.44 6.16 0.00 -0.73 -0.32 119.26 125.97 1lko h ALA 50 Ca 0.27 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 55.12 1lko h ALA 50 Cb 0.04 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.58 1lko h ALA 50 CO -0.04 0.19 0.12 -0.44 0.00 0.00 0.00 179.25 179.08 1lko h ASP 51 N 0.82 0.59 0.37 0.00 3.32 -0.57 -1.40 116.42 119.55 1lko h ASP 51 Ca 0.25 -0.08 -0.15 0.00 0.02 0.00 0.00 57.03 57.06 1lko h ASP 51 Cb -0.03 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.35 1lko h ASP 51 CO -0.08 0.58 -0.64 1.56 -1.72 0.00 0.00 179.24 178.94 1lko h GLN 52 N 0.63 0.25 -0.09 3.56 4.20 -0.32 -2.52 115.11 120.83 1lko h GLN 52 Ca 0.15 -0.18 -0.08 0.00 0.06 0.00 0.00 58.65 58.59 1lko h GLN 52 Cb 0.21 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.01 1lko h GLN 52 CO -0.01 0.80 -0.33 0.93 -0.67 0.00 0.00 178.83 179.56 1lko h GLU 53 N 0.18 0.17 -0.85 1.46 4.39 -0.48 -1.29 114.58 118.16 1lko h GLU 53 Ca -0.01 -0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.63 1lko h GLU 53 Cb 1.16 -0.01 -0.04 0.00 -0.10 0.00 0.00 28.75 29.76 1lko h GLU 53 CO 0.10 0.48 0.53 -0.09 -1.16 0.00 0.00 179.01 178.87 1lko h ARG 54 N 0.15 1.14 -0.03 2.33 2.43 -0.85 -0.56 114.38 118.97 1lko h ARG 54 Ca 0.02 -0.09 -0.20 0.00 -0.81 0.00 0.00 59.98 58.91 1lko h ARG 54 Cb 0.66 -0.25 -0.01 0.00 -0.42 0.00 0.00 29.97 29.96 1lko h ARG 54 CO 0.05 0.78 -0.81 0.93 -1.51 0.00 0.00 179.97 179.40 1lko h GLU 55 N 1.16 0.33 -0.29 0.20 4.39 -1.03 -1.18 114.58 118.16 1lko h GLU 55 Ca 0.31 -0.31 -0.02 0.00 0.34 0.00 0.00 59.36 59.68 1lko h GLU 55 Cb -0.08 0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 28.63 1lko h GLU 55 CO -0.06 0.98 0.11 0.45 -1.16 0.00 0.00 179.01 179.33 1lko h HIS 56 N 0.21 0.45 -0.98 4.33 3.86 -0.84 -2.13 115.15 120.04 1lko h HIS 56 Ca -0.04 -0.04 0.01 0.00 -1.16 0.00 0.00 60.37 59.14 1lko h HIS 56 Cb 1.41 -0.13 -0.05 0.00 1.06 0.00 0.00 27.41 29.70 1lko h HIS 56 CO 0.04 0.44 0.64 0.00 0.86 0.00 0.00 177.93 179.92 1lko h ALA 57 N 0.95 1.25 -0.35 2.45 0.00 -1.03 -2.25 119.26 120.28 1lko h ALA 57 Ca 0.10 -0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 1lko h ALA 57 Cb 0.19 -0.40 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 1lko h ALA 57 CO -0.01 0.65 0.12 -0.22 0.00 0.00 0.00 179.25 179.79 1lko h LYS 58 N 1.34 0.54 -0.57 0.00 3.64 -0.92 0.19 116.57 120.79 1lko h LYS 58 Ca 0.36 -0.11 0.03 0.00 -1.27 0.00 0.00 60.65 59.66 1lko h LYS 58 Cb -0.14 -0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 31.56 1lko h LYS 58 CO -0.08 0.55 0.34 -0.09 -2.27 0.00 0.00 179.45 177.91 1lko h ARG 59 N 0.42 0.66 -0.20 1.90 9.65 -1.17 -1.27 114.38 124.37 1lko h ARG 59 Ca 0.11 -0.04 -0.02 0.00 -1.10 0.00 0.00 59.98 58.93 1lko h ARG 59 Cb 0.23 -0.15 -0.01 0.00 -1.39 0.00 0.00 29.97 28.66 1lko h ARG 59 CO -0.01 0.43 0.03 -0.07 2.80 0.00 0.00 179.97 183.16 1lko h LEU 60 N 0.68 0.31 -1.05 3.80 3.38 -1.16 -3.05 115.31 118.23 1lko h LEU 60 Ca 0.23 -0.26 0.11 0.00 0.09 0.00 0.00 57.88 58.05 1lko h LEU 60 Cb 0.03 -0.08 -0.08 0.00 0.09 0.00 0.00 40.66 40.62 1lko h LEU 60 CO -0.10 0.49 0.63 0.15 0.09 0.00 0.00 178.44 179.70 1lko h PHE 61 N 0.12 1.12 0.00 1.13 3.57 -0.28 -1.69 116.94 120.92 1lko h PHE 61 Ca 0.06 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.59 1lko h PHE 61 Cb 0.31 -0.36 0.00 0.00 2.79 0.00 0.00 35.95 38.69 1lko h PHE 61 CO 0.02 0.49 0.00 0.87 -2.23 0.00 0.00 178.31 177.46 1lko h LYS 62 N 1.02 0.00 0.00 1.11 1.57 -1.12 -2.66 116.57 116.48 1lko h LYS 62 Ca 0.47 0.00 -0.16 0.00 -1.87 0.00 0.00 60.65 59.09 1lko h LYS 62 Cb 0.41 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.70 1lko h LYS 62 CO -0.23 0.00 -0.77 0.74 -0.57 0.00 0.00 179.45 178.62 1lko h PHE 63 N 0.00 0.00 -4.11 -1.35 0.04 -1.33 -3.46 116.94 106.73 1lko h PHE 63 Ca 0.00 0.00 -0.55 0.00 2.80 0.00 0.00 57.97 60.22 1lko h PHE 63 Cb 0.32 0.00 0.14 0.00 2.20 0.00 0.00 35.95 38.61 1lko h PHE 63 CO 0.00 0.77 0.50 -0.51 -0.60 0.00 0.00 178.31 178.47 1lko s LEU 64 N -6.71 3.60 0.00 1.54 1.43 -1.01 -4.97 118.68 112.56 1lko s LEU 64 Ca 0.02 2.53 0.16 0.00 -1.03 0.00 0.00 54.13 55.81 1lko s LEU 64 Cb 0.09 -4.61 0.34 0.00 0.03 0.00 0.00 46.19 42.05 1lko s LEU 64 CO 0.78 -1.87 1.26 -0.62 0.23 0.00 0.00 176.35 176.13 1lko n GLU 65 N -1.81 2.30 0.00 1.70 1.02 -1.26 -5.09 120.64 117.49 1lko n GLU 65 Ca 0.15 -2.04 0.00 0.00 -0.02 0.00 0.00 57.16 55.25 1lko n GLU 65 Cb 0.49 -1.37 0.00 0.00 -0.02 0.00 0.00 31.44 30.54 1lko n GLU 65 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1lko n GLY 66 N 0.97 1.97 0.00 0.62 0.00 -1.26 -5.15 105.19 102.35 1lko n GLY 66 Ca 0.15 -2.02 0.00 0.00 0.00 0.00 0.00 46.02 44.14 1lko n GLY 66 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1lko n GLY 67 N 0.92 -0.51 3.68 -0.02 0.00 -1.26 -4.93 105.19 103.07 1lko n GLY 67 Ca 0.00 -1.67 -0.38 0.00 0.00 0.00 0.00 46.02 43.97 1lko n GLY 67 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1lko s ASP 68 N -2.48 6.42 -0.05 1.61 1.11 -1.26 -5.07 116.67 116.95 1lko s ASP 68 Ca 0.00 0.49 0.06 0.00 0.18 0.00 0.00 52.55 53.28 1lko s ASP 68 Cb 0.00 -2.21 -0.01 0.00 1.07 0.00 0.00 42.92 41.76 1lko s ASP 68 CO 0.00 -0.03 -0.25 -0.22 1.18 0.00 0.00 175.17 175.85 1lko s LEU 69 N 1.11 2.06 0.05 1.23 2.96 -1.26 -5.12 118.68 119.71 1lko s LEU 69 Ca 0.18 -0.50 -0.22 0.00 -0.22 0.00 0.00 54.13 53.37 1lko s LEU 69 Cb -0.14 -1.35 -0.06 0.00 0.50 0.00 0.00 46.19 45.14 1lko s LEU 69 CO 0.07 0.25 0.66 -0.70 -1.32 0.00 0.00 176.35 175.31 1lko s GLU 70 N -0.22 4.37 0.10 1.98 2.12 -1.26 -5.07 118.70 120.72 1lko s GLU 70 Ca -0.02 0.88 0.05 0.00 0.36 0.00 0.00 54.97 56.24 1lko s GLU 70 Cb -0.13 -3.31 -0.03 0.00 0.26 0.00 0.00 34.13 30.91 1lko s GLU 70 CO 0.03 0.44 -0.13 0.96 -0.54 0.00 0.00 175.26 176.02 1lko s ILE 71 N -0.50 1.13 -0.21 -3.70 -4.36 -1.26 -5.04 121.20 107.26 1lko s ILE 71 Ca 0.33 -1.54 0.01 0.00 -0.26 0.00 0.00 60.65 59.20 1lko s ILE 71 Cb -0.20 -1.30 0.04 0.00 1.25 0.00 0.00 42.46 42.26 1lko s ILE 71 CO 0.20 -0.39 -0.11 -0.69 0.24 0.00 0.00 174.94 174.20 1lko s VAL 72 N -1.90 1.73 0.09 8.37 1.01 -1.26 -5.11 120.40 123.33 1lko s VAL 72 Ca 0.04 -1.08 -0.20 0.00 0.00 0.00 0.00 61.98 60.74 1lko s VAL 72 Cb -0.06 -1.79 0.05 0.00 0.00 0.00 0.00 36.38 34.57 1lko s VAL 72 CO 0.02 0.17 0.49 0.00 0.00 0.00 0.00 175.10 175.77 1lko s ALA 73 N 1.36 -1.23 -0.11 5.51 0.00 -1.26 -5.12 121.76 120.92 1lko s ALA 73 Ca -0.02 0.37 -0.05 0.00 0.00 0.00 0.00 51.96 52.26 1lko s ALA 73 Cb -0.16 0.55 -0.04 0.00 0.00 0.00 0.00 23.12 23.47 1lko s ALA 73 CO -0.08 -0.58 0.08 0.00 0.00 0.00 0.00 175.76 175.18 1lko s ALA 74 N -3.05 3.62 0.09 0.00 0.00 -1.26 -5.11 121.76 116.05 1lko s ALA 74 Ca -0.02 -0.71 0.02 0.00 0.00 0.00 0.00 51.96 51.25 1lko s ALA 74 Cb 0.00 -1.76 -0.04 0.00 0.00 0.00 0.00 23.12 21.32 1lko s ALA 74 CO -0.07 0.60 -0.07 -0.06 0.00 0.00 0.00 175.76 176.17 1lko s PHE 75 N -0.95 0.86 -0.17 0.00 0.08 -1.26 -5.10 117.98 111.44 1lko s PHE 75 Ca 0.14 -0.86 -0.29 0.00 0.12 0.00 0.00 56.93 56.04 1lko s PHE 75 Cb -0.12 -0.50 -0.03 0.00 -0.57 0.00 0.00 43.02 41.80 1lko s PHE 75 CO 0.03 -0.14 1.63 -2.14 -0.10 0.00 0.00 175.22 174.50 1lko s PRO 76 N -3.54 3.90 -1.16 0.24 0.02 -1.26 -4.91 135.00 128.28 1lko s PRO 76 Ca 0.09 1.82 -0.16 0.00 0.02 0.00 0.00 61.00 62.78 1lko s PRO 76 Cb 0.03 -4.02 0.15 0.00 0.02 0.00 0.00 34.50 30.68 1lko s PRO 76 CO -0.04 -1.18 1.42 0.00 -0.33 0.00 0.00 177.00 176.87 1lko s ALA 77 N 4.92 3.76 0.00 -1.55 0.00 -1.26 -4.84 121.76 122.79 1lko s ALA 77 Ca 0.72 -3.16 0.00 0.00 0.00 0.00 0.00 51.96 49.52 1lko s ALA 77 Cb -0.27 -4.19 0.00 0.00 0.00 0.00 0.00 23.12 18.65 1lko s ALA 77 CO 0.29 -2.91 0.00 0.41 0.00 0.00 0.00 175.76 173.55 1lko n GLY 78 N 4.62 -3.56 3.24 0.00 0.00 -1.26 -5.07 105.19 103.16 1lko n GLY 78 Ca 0.36 -1.93 -0.15 0.00 0.00 0.00 0.00 46.02 44.30 1lko n GLY 78 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1lko s ILE 79 N -0.90 0.00 -0.26 -0.61 -4.36 -1.26 -5.15 121.20 108.66 1lko s ILE 79 Ca 0.00 -1.98 -0.08 0.00 -0.26 0.00 0.00 60.65 58.33 1lko s ILE 79 Cb 0.00 -2.50 -0.03 0.00 1.25 0.00 0.00 42.46 41.18 1lko s ILE 79 CO 0.00 0.00 0.09 -0.63 0.24 0.00 0.00 174.94 174.64 1lko s ILE 80 N -3.86 4.45 0.00 8.37 1.01 -1.26 -4.99 121.20 124.92 1lko s ILE 80 Ca 0.39 -0.15 0.00 0.00 0.00 0.00 0.00 60.65 60.90 1lko s ILE 80 Cb 0.05 -3.10 0.00 0.00 0.01 0.00 0.00 42.46 39.42 1lko s ILE 80 CO 0.18 0.31 0.00 0.00 0.00 0.00 0.00 174.94 175.43 1lko n ALA 81 N 4.94 0.00 -1.12 9.38 0.00 -1.26 -5.12 120.51 127.34 1lko n ALA 81 Ca -0.16 0.00 -0.30 0.00 0.00 0.00 0.00 53.44 52.98 1lko n ALA 81 Cb 0.51 0.00 0.13 0.00 0.00 0.00 0.00 19.45 20.09 1lko n ALA 81 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.50 177.66 1lko s ASP 82 N 1.00 3.69 0.23 0.00 -4.77 -1.26 -4.74 116.67 110.82 1lko s ASP 82 Ca 0.00 1.73 -0.08 0.00 -3.30 0.00 0.00 52.55 50.90 1lko s ASP 82 Cb 0.00 -2.38 0.24 0.00 -1.09 0.00 0.00 42.92 39.69 1lko s ASP 82 CO 0.00 -2.54 1.88 0.74 0.70 0.00 0.00 175.17 175.96 1lko h THR 83 N -1.48 1.16 -0.16 2.11 2.02 -1.94 -0.42 112.91 114.20 1lko h THR 83 Ca -0.47 -0.38 0.02 0.00 0.77 0.00 0.00 66.41 66.35 1lko h THR 83 Cb 1.26 -0.03 -0.02 0.00 -1.74 0.00 0.00 68.15 67.62 1lko h THR 83 CO 0.51 0.20 0.04 -0.74 0.37 0.00 0.00 175.52 175.90 1lko h HIS 84 N 1.10 0.08 -1.01 3.16 -0.00 -1.95 0.54 115.15 117.06 1lko h HIS 84 Ca 0.33 0.01 0.01 0.00 -0.00 0.00 0.00 60.37 60.72 1lko h HIS 84 Cb -0.04 -0.01 -0.05 0.00 -0.00 0.00 0.00 27.41 27.31 1lko h HIS 84 CO -0.02 0.03 0.67 0.00 -0.00 0.00 0.00 177.93 178.62 1lko h ALA 85 N 1.11 1.28 -0.52 5.26 0.00 -1.82 -1.20 119.26 123.37 1lko h ALA 85 Ca 0.07 -0.07 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 1lko h ALA 85 Cb 0.05 -0.41 -0.02 0.00 0.00 0.00 0.00 17.79 17.41 1lko h ALA 85 CO -0.08 0.67 0.01 -0.91 0.00 0.00 0.00 179.25 178.93 1lko h ASN 86 N 1.37 0.85 -0.51 0.00 2.35 -0.47 -0.71 115.58 118.45 1lko h ASN 86 Ca 0.37 -0.21 -0.09 0.00 -0.55 0.00 0.00 56.30 55.81 1lko h ASN 86 Cb -0.16 -0.23 -0.02 0.00 0.05 0.00 0.00 38.32 37.97 1lko h ASN 86 CO -0.08 0.91 -0.04 -0.07 -1.65 0.00 0.00 177.43 176.49 1lko h LEU 87 N 0.82 0.92 -0.30 1.61 3.38 -0.30 -0.55 115.31 120.88 1lko h LEU 87 Ca 0.16 -0.33 -0.02 0.00 0.09 0.00 0.00 57.88 57.78 1lko h LEU 87 Cb 0.48 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 1lko h LEU 87 CO 0.02 1.03 0.10 0.40 0.09 0.00 0.00 178.44 180.08 1lko h ILE 88 N 0.79 1.19 -0.70 1.22 1.08 -0.94 -0.59 117.51 119.57 1lko h ILE 88 Ca 0.14 -0.60 -0.04 0.00 -0.39 0.00 0.00 64.86 63.96 1lko h ILE 88 Cb 0.58 1.03 -0.03 0.00 -3.07 0.00 0.00 36.82 35.33 1lko h ILE 88 CO 0.03 0.20 0.27 0.00 -0.69 0.00 0.00 178.15 177.97 1lko h ALA 89 N 0.94 0.91 -0.44 1.87 0.00 -1.05 -1.68 119.26 119.82 1lko h ALA 89 Ca 0.10 -0.19 -0.03 0.00 0.00 0.00 0.00 54.91 54.79 1lko h ALA 89 Cb 0.22 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 1lko h ALA 89 CO -0.01 0.54 0.16 0.77 0.00 0.00 0.00 179.25 180.72 1lko h SER 90 N 1.00 0.62 -0.94 0.00 0.02 -0.93 -2.06 113.55 111.27 1lko h SER 90 Ca 0.23 -0.18 0.01 0.00 -0.84 0.00 0.00 61.79 61.01 1lko h SER 90 Cb 0.22 -0.16 -0.05 0.00 0.14 0.00 0.00 62.40 62.55 1lko h SER 90 CO -0.02 0.63 0.62 0.00 -1.14 0.00 0.00 176.83 176.93 1lko h ALA 91 N 1.01 1.34 -0.66 3.77 0.00 -0.86 -1.13 119.26 122.72 1lko h ALA 91 Ca 0.14 -0.06 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 1lko h ALA 91 Cb 0.22 -0.38 -0.03 0.00 0.00 0.00 0.00 17.79 17.60 1lko h ALA 91 CO -0.01 0.61 0.24 0.00 0.00 0.00 0.00 179.25 180.10 1lko h ALA 92 N 1.42 1.17 -0.37 0.00 0.00 -0.91 0.60 119.26 121.17 1lko h ALA 92 Ca 0.35 -0.19 -0.09 0.00 0.00 0.00 0.00 54.91 54.98 1lko h ALA 92 Cb -0.14 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.38 1lko h ALA 92 CO -0.08 0.59 -0.13 0.78 0.00 0.00 0.00 179.25 180.42 1lko h GLY 93 N 1.05 0.80 0.99 0.00 0.00 -0.65 -2.14 103.07 103.12 1lko h GLY 93 Ca 0.22 -0.69 -0.00 0.00 0.00 0.00 0.00 47.33 46.86 1lko h GLY 93 CO -0.02 0.63 0.31 0.83 0.00 0.00 0.00 176.54 178.29 1lko h GLU 94 N 0.54 0.68 -0.43 4.80 4.39 -0.85 -2.31 114.58 121.39 1lko h GLU 94 Ca 0.09 -0.06 0.06 0.00 0.34 0.00 0.00 59.36 59.79 1lko h GLU 94 Cb 0.65 -0.14 -0.05 0.00 -0.10 0.00 0.00 28.75 29.11 1lko h GLU 94 CO 0.04 0.49 0.15 1.25 -1.16 0.00 0.00 179.01 179.78 1lko h HIS 95 N 0.67 0.26 -0.67 4.33 2.76 -0.70 -0.94 115.15 120.86 1lko h HIS 95 Ca 0.18 0.02 -0.02 0.00 -2.20 0.00 0.00 60.37 58.35 1lko h HIS 95 Cb -0.02 -0.05 -0.03 0.00 1.55 0.00 0.00 27.41 28.86 1lko h HIS 95 CO -0.03 0.09 0.34 1.25 -1.30 0.00 0.00 177.93 178.29 1lko h HIS 96 N 0.31 0.94 -0.28 5.26 -0.00 -1.18 -0.83 115.15 119.38 1lko h HIS 96 Ca 0.20 -0.04 0.00 0.00 -0.00 0.00 0.00 60.37 60.54 1lko h HIS 96 Cb 0.20 -0.30 -0.01 0.00 -0.00 0.00 0.00 27.41 27.30 1lko h HIS 96 CO -0.16 0.69 0.18 0.93 -0.00 0.00 0.00 177.93 179.57 1lko h GLU 97 N 0.92 0.38 0.00 5.26 5.08 -0.79 0.43 114.58 125.86 1lko h GLU 97 Ca 0.23 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.56 1lko h GLU 97 Cb 0.08 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1lko h GLU 97 CO -0.03 0.28 -0.59 0.10 -1.00 0.00 0.00 179.01 177.77 1lko h TYR 98 N 0.36 0.00 0.00 4.33 -0.00 -1.11 -0.39 116.97 120.17 1lko h TYR 98 Ca 0.10 0.00 -0.35 0.00 0.00 0.00 0.00 58.73 58.48 1lko h TYR 98 Cb -0.01 0.00 -0.06 0.00 0.00 0.00 0.00 36.73 36.66 1lko h TYR 98 CO -0.05 0.00 -2.24 0.25 -0.00 0.00 0.00 178.16 176.12 1lko n THR 99 N -2.64 1.46 0.03 -0.90 -2.24 -0.32 -4.56 114.28 105.10 1lko n THR 99 Ca 0.02 -0.82 -0.00 0.00 -2.27 0.00 0.00 64.05 60.98 1lko n THR 99 Cb 0.51 -0.70 -0.00 0.00 -2.10 0.00 0.00 70.33 68.04 1lko n THR 99 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1lko n GLU 100 N -2.88 0.02 0.52 -0.78 -0.58 0.03 -4.77 120.64 112.21 1lko n GLU 100 Ca -0.31 0.01 -0.21 0.00 -0.42 0.00 0.00 57.16 56.24 1lko n GLU 100 Cb 1.12 -0.43 -0.10 0.00 -0.57 0.00 0.00 31.44 31.46 1lko n GLU 100 CO 0.00 0.00 0.00 1.98 -0.48 0.00 0.00 177.13 178.63 1lko h MET 101 N -0.04 -1.29 -0.57 3.49 4.05 -1.30 -2.34 114.93 116.92 1lko h MET 101 Ca 0.00 0.09 -0.08 0.00 -0.28 0.00 0.00 59.70 59.42 1lko h MET 101 Cb 0.04 0.29 -0.02 0.00 -0.80 0.00 0.00 31.60 31.12 1lko h MET 101 CO 0.00 -0.86 0.02 1.88 0.23 0.00 0.00 176.91 178.18 1lko h TYR 102 N -1.34 1.04 -0.48 1.39 0.05 -1.31 0.12 116.97 116.44 1lko h TYR 102 Ca -0.14 -0.16 -0.05 0.00 0.05 0.00 0.00 58.73 58.44 1lko h TYR 102 Cb 1.03 -0.28 -0.02 0.00 1.01 0.00 0.00 36.73 38.47 1lko h TYR 102 CO -0.01 0.92 0.10 -1.35 -1.05 0.00 0.00 178.16 176.77 1lko h PRO 103 N 0.89 0.73 -0.25 4.88 0.11 -1.75 0.85 132.00 137.46 1lko h PRO 103 Ca 0.17 -0.14 -0.08 0.00 0.11 0.00 0.00 66.00 66.06 1lko h PRO 103 Cb 0.50 -0.11 -0.01 0.00 0.11 0.00 0.00 31.00 31.49 1lko h PRO 103 CO 0.02 0.67 -0.15 0.77 -0.21 0.00 0.00 178.00 179.10 1lko h SER 104 N 0.70 0.56 -0.68 -2.05 0.02 -1.06 -1.55 113.55 109.49 1lko h SER 104 Ca 0.16 -0.43 -0.04 0.00 -0.84 0.00 0.00 61.79 60.64 1lko h SER 104 Cb 0.28 -0.16 -0.03 0.00 0.14 0.00 0.00 62.40 62.64 1lko h SER 104 CO -0.00 0.87 0.29 -0.26 -1.14 0.00 0.00 176.83 176.59 1lko h PHE 105 N 0.26 1.04 -0.39 3.45 0.04 -0.68 -1.48 116.94 119.17 1lko h PHE 105 Ca 0.05 -0.06 -0.05 0.00 2.80 0.00 0.00 57.97 60.71 1lko h PHE 105 Cb 0.67 -0.32 -0.02 0.00 2.20 0.00 0.00 35.95 38.49 1lko h PHE 105 CO 0.07 0.78 0.06 0.00 -0.60 0.00 0.00 178.31 178.62 1lko h ALA 106 N 1.31 0.52 -0.59 2.45 0.00 -0.72 -0.39 119.26 121.84 1lko h ALA 106 Ca 0.24 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 1lko h ALA 106 Cb 0.17 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 1lko h ALA 106 CO -0.02 0.23 0.26 -0.09 0.00 0.00 0.00 179.25 179.63 1lko h ARG 107 N 0.50 0.86 -0.55 0.00 2.43 -0.98 -0.33 114.38 116.31 1lko h ARG 107 Ca 0.12 -0.14 -0.09 0.00 -0.81 0.00 0.00 59.98 59.06 1lko h ARG 107 Cb 0.37 -0.15 -0.02 0.00 -0.42 0.00 0.00 29.97 29.75 1lko h ARG 107 CO 0.01 0.72 -0.00 0.82 -1.51 0.00 0.00 179.97 180.01 1lko h ILE 108 N 0.81 1.26 -0.43 1.20 2.04 -1.16 -1.03 117.51 120.20 1lko h ILE 108 Ca 0.20 -1.09 -0.02 0.00 1.00 0.00 0.00 64.86 64.95 1lko h ILE 108 Cb 0.16 0.84 -0.02 0.00 -0.74 0.00 0.00 36.82 37.06 1lko h ILE 108 CO -0.02 0.39 0.21 0.00 0.00 0.00 0.00 178.15 178.72 1lko h ALA 109 N 1.13 0.56 -0.77 1.87 0.00 -0.55 -0.64 119.26 120.86 1lko h ALA 109 Ca 0.16 -0.11 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 1lko h ALA 109 Cb 0.51 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.09 1lko h ALA 109 CO 0.03 0.12 0.38 0.00 0.00 0.00 0.00 179.25 179.77 1lko h ARG 110 N 0.56 1.10 -0.56 0.00 3.08 -0.82 0.20 114.38 117.93 1lko h ARG 110 Ca 0.15 -0.16 -0.04 0.00 0.07 0.00 0.00 59.98 60.00 1lko h ARG 110 Cb 0.12 -0.20 -0.03 0.00 0.08 0.00 0.00 29.97 29.95 1lko h ARG 110 CO -0.02 0.85 0.18 0.93 -1.07 0.00 0.00 179.97 180.84 1lko h GLU 111 N 1.08 0.84 -0.01 0.04 3.07 -0.74 -2.32 114.58 116.53 1lko h GLU 111 Ca 0.26 -0.15 0.00 0.00 -0.50 0.00 0.00 59.36 58.98 1lko h GLU 111 Cb 0.11 -0.14 0.00 0.00 -0.84 0.00 0.00 28.75 27.88 1lko h GLU 111 CO -0.03 0.72 -0.05 0.39 -1.40 0.00 0.00 179.01 178.63 1lko n GLU 112 N -4.30 1.09 -0.44 2.33 1.02 -0.29 -4.92 120.64 115.13 1lko n GLU 112 Ca 0.04 -0.42 0.00 0.00 -0.02 0.00 0.00 57.16 56.77 1lko n GLU 112 Cb 0.19 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.12 1lko n GLU 112 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1lko n GLY 113 N 1.18 0.74 2.95 0.62 0.00 -0.75 -5.02 105.19 104.90 1lko n GLY 113 Ca 0.18 -0.42 -0.39 0.00 0.00 0.00 0.00 46.02 45.39 1lko n GLY 113 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1lko n TYR 114 N -2.44 3.30 -0.24 1.61 4.01 0.64 -4.87 117.16 119.17 1lko n TYR 114 Ca 0.00 -3.36 -0.06 0.00 -0.16 0.00 0.00 57.90 54.32 1lko n TYR 114 Cb 0.00 -1.15 0.05 0.00 -0.31 0.00 0.00 39.34 37.93 1lko n TYR 114 CO 0.00 0.00 0.00 0.93 -0.46 0.00 0.00 176.86 177.33 1lko h GLU 115 N 5.43 0.88 -0.23 -0.72 4.39 -1.89 -1.05 114.58 121.39 1lko h GLU 115 Ca 0.19 -0.06 -0.01 0.00 0.34 0.00 0.00 59.36 59.82 1lko h GLU 115 Cb 0.69 -0.20 -0.01 0.00 -0.10 0.00 0.00 28.75 29.14 1lko h GLU 115 CO 1.11 0.60 0.12 1.49 -1.16 0.00 0.00 179.01 181.16 1lko h GLU 116 N 0.90 0.33 -0.79 2.33 4.81 -1.96 -1.46 114.58 118.74 1lko h GLU 116 Ca 0.24 -0.05 -0.05 0.00 -0.13 0.00 0.00 59.36 59.38 1lko h GLU 116 Cb -0.08 -0.06 -0.03 0.00 0.63 0.00 0.00 28.75 29.20 1lko h GLU 116 CO -0.05 0.33 0.32 0.82 -0.73 0.00 0.00 179.01 179.70 1lko h ILE 117 N 0.25 1.26 -0.77 2.32 2.04 -1.94 -1.60 117.51 119.07 1lko h ILE 117 Ca 0.08 -0.82 -0.00 0.00 1.00 0.00 0.00 64.86 65.12 1lko h ILE 117 Cb 0.11 0.32 -0.04 0.00 -0.74 0.00 0.00 36.82 36.47 1lko h ILE 117 CO -0.01 0.34 0.47 0.00 0.00 0.00 0.00 178.15 178.95 1lko h ALA 118 N 1.17 0.97 -0.25 1.87 0.00 -0.94 -0.72 119.26 121.36 1lko h ALA 118 Ca 0.26 -0.08 -0.07 0.00 0.00 0.00 0.00 54.91 55.02 1lko h ALA 118 Cb 0.22 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 1lko h ALA 118 CO -0.02 0.43 -0.17 0.00 0.00 0.00 0.00 179.25 179.49 1lko h ARG 119 N 1.04 0.42 -0.37 0.00 3.08 -0.86 -1.48 114.38 116.22 1lko h ARG 119 Ca 0.28 -0.13 -0.08 0.00 0.07 0.00 0.00 59.98 60.12 1lko h ARG 119 Cb -0.06 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 29.94 1lko h ARG 119 CO -0.05 0.59 -0.08 0.28 -1.07 0.00 0.00 179.97 179.63 1lko h VAL 120 N 0.39 1.28 -0.47 2.04 2.07 -0.47 0.49 116.25 121.58 1lko h VAL 120 Ca 0.07 -1.15 0.00 0.00 0.82 0.00 0.00 66.70 66.44 1lko h VAL 120 Cb 0.53 1.27 -0.02 0.00 -1.52 0.00 0.00 31.29 31.54 1lko h VAL 120 CO 0.03 0.38 0.30 -0.26 0.02 0.00 0.00 177.57 178.04 1lko h PHE 121 N 0.50 0.61 -0.62 1.57 0.04 -0.83 0.80 116.94 119.02 1lko h PHE 121 Ca 0.09 0.00 -0.05 0.00 2.80 0.00 0.00 57.97 60.82 1lko h PHE 121 Cb 0.59 -0.20 -0.03 0.00 2.20 0.00 0.00 35.95 38.51 1lko h PHE 121 CO 0.05 0.41 0.19 0.00 -0.60 0.00 0.00 178.31 178.36 1lko h ALA 122 N 1.15 1.15 -0.35 2.45 0.00 -1.12 -1.89 119.26 120.65 1lko h ALA 122 Ca 0.17 -0.20 -0.16 0.00 0.00 0.00 0.00 54.91 54.72 1lko h ALA 122 Cb -0.03 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.51 1lko h ALA 122 CO -0.03 0.58 -0.39 0.77 0.00 0.00 0.00 179.25 180.18 1lko h SER 123 N 0.92 0.95 -0.48 0.00 0.02 -0.39 -2.87 113.55 111.69 1lko h SER 123 Ca 0.20 -0.48 -0.04 0.00 -0.84 0.00 0.00 61.79 60.64 1lko h SER 123 Cb 0.28 -0.27 -0.03 0.00 0.14 0.00 0.00 62.40 62.52 1lko h SER 123 CO -0.01 1.24 0.18 0.40 -1.14 0.00 0.00 176.83 177.50 1lko h ILE 124 N 0.68 1.21 -0.57 3.27 2.04 -0.65 -1.95 117.51 121.54 1lko h ILE 124 Ca 0.05 -0.68 0.05 0.00 1.00 0.00 0.00 64.86 65.27 1lko h ILE 124 Cb 0.98 0.60 -0.03 0.00 -0.74 0.00 0.00 36.82 37.63 1lko h ILE 124 CO 0.09 0.26 0.38 0.00 0.00 0.00 0.00 178.15 178.89 1lko h ALA 125 N 1.43 1.77 -0.45 1.87 0.00 -1.13 -0.69 119.26 122.05 1lko h ALA 125 Ca 0.18 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.03 1lko h ALA 125 Cb 0.20 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 1lko h ALA 125 CO -0.01 0.15 0.12 0.28 0.00 0.00 0.00 179.25 179.80 1lko h VAL 126 N 0.61 1.23 -0.65 0.00 2.07 -1.21 -1.67 116.25 116.63 1lko h VAL 126 Ca 0.24 -0.78 -0.01 0.00 0.82 0.00 0.00 66.70 66.97 1lko h VAL 126 Cb 0.18 0.88 -0.03 0.00 -1.52 0.00 0.00 31.29 30.80 1lko h VAL 126 CO -0.07 0.28 0.37 0.00 0.02 0.00 0.00 177.57 178.18 1lko h ALA 127 N 0.98 0.83 -0.27 1.67 0.00 -1.03 -2.52 119.26 118.91 1lko h ALA 127 Ca 0.14 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.90 1lko h ALA 127 Cb 0.30 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 1lko h ALA 127 CO -0.00 0.32 -0.09 0.93 0.00 0.00 0.00 179.25 180.41 1lko h GLU 128 N 0.88 0.44 -0.59 0.00 4.39 -0.99 -1.35 114.58 117.36 1lko h GLU 128 Ca 0.23 -0.11 -0.08 0.00 0.34 0.00 0.00 59.36 59.74 1lko h GLU 128 Cb 0.01 -0.06 -0.02 0.00 -0.10 0.00 0.00 28.75 28.58 1lko h GLU 128 CO -0.04 0.54 0.06 1.49 -1.16 0.00 0.00 179.01 179.89 1lko h GLU 129 N 0.41 0.99 -0.10 2.33 4.81 -0.88 -0.76 114.58 121.39 1lko h GLU 129 Ca 0.08 -0.27 -0.16 0.00 -0.13 0.00 0.00 59.36 58.88 1lko h GLU 129 Cb 0.41 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 29.67 1lko h GLU 129 CO 0.02 0.94 -0.63 0.35 -0.73 0.00 0.00 179.01 178.96 1lko h PHE 130 N 0.92 0.48 -0.52 0.92 3.57 -1.25 -1.84 116.94 119.23 1lko h PHE 130 Ca 0.18 -0.19 0.04 0.00 3.53 0.00 0.00 57.97 61.53 1lko h PHE 130 Cb 0.46 -0.08 -0.04 0.00 2.79 0.00 0.00 35.95 39.07 1lko h PHE 130 CO 0.03 0.90 0.27 0.45 -2.23 0.00 0.00 178.31 177.73 1lko h HIS 131 N 0.27 0.49 -0.52 0.41 3.86 -0.81 -1.44 115.15 117.41 1lko h HIS 131 Ca -0.01 0.02 -0.00 0.00 -1.16 0.00 0.00 60.37 59.22 1lko h HIS 131 Cb 1.17 -0.15 -0.02 0.00 1.06 0.00 0.00 27.41 29.47 1lko h HIS 131 CO 0.03 0.24 0.31 1.49 0.86 0.00 0.00 177.93 180.87 1lko h GLU 132 N 0.52 0.71 -0.51 2.45 4.81 -0.88 -1.92 114.58 119.75 1lko h GLU 132 Ca 0.23 -0.07 0.07 0.00 -0.13 0.00 0.00 59.36 59.46 1lko h GLU 132 Cb 0.13 -0.15 -0.06 0.00 0.63 0.00 0.00 28.75 29.30 1lko h GLU 132 CO -0.15 0.52 0.19 -0.22 -0.73 0.00 0.00 179.01 178.62 1lko h LYS 133 N 0.70 0.37 -0.15 1.92 3.64 -0.63 0.11 116.57 122.52 1lko h LYS 133 Ca 0.19 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.54 1lko h LYS 133 Cb 0.00 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 31.73 1lko h LYS 133 CO -0.03 0.24 0.09 0.00 -2.27 0.00 0.00 179.45 177.48 1lko h ARG 134 N 0.38 0.21 -0.45 1.90 3.08 -0.98 -0.04 114.38 118.47 1lko h ARG 134 Ca 0.24 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.27 1lko h ARG 134 Cb 0.25 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.23 1lko h ARG 134 CO -0.24 0.19 0.28 0.74 -1.07 0.00 0.00 179.97 179.88 1lko h PHE 135 N 0.16 0.58 -0.59 3.04 0.04 -0.80 -1.00 116.94 118.37 1lko h PHE 135 Ca 0.05 0.00 -0.07 0.00 2.80 0.00 0.00 57.97 60.76 1lko h PHE 135 Cb 0.04 -0.19 -0.02 0.00 2.20 0.00 0.00 35.95 37.98 1lko h PHE 135 CO -0.05 0.39 0.11 -0.07 -0.60 0.00 0.00 178.31 178.09 1lko h LEU 136 N 0.60 0.93 -0.41 1.54 3.38 -0.66 -0.98 115.31 119.71 1lko h LEU 136 Ca 0.16 -0.25 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 1lko h LEU 136 Cb -0.03 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.45 1lko h LEU 136 CO -0.03 0.94 0.23 0.44 0.09 0.00 0.00 178.44 180.12 1lko h ASP 137 N 0.87 0.50 -0.51 -0.43 5.19 -0.74 -0.68 116.42 120.62 1lko h ASP 137 Ca 0.18 -0.07 -0.11 0.00 -0.62 0.00 0.00 57.03 56.41 1lko h ASP 137 Cb 0.41 -0.13 -0.02 0.00 0.18 0.00 0.00 39.33 39.77 1lko h ASP 137 CO 0.01 0.43 -0.10 -0.26 -3.12 0.00 0.00 179.24 176.21 1lko h PHE 138 N 0.54 1.10 -0.77 4.55 0.04 -1.06 -0.85 116.94 120.49 1lko h PHE 138 Ca 0.15 -0.22 -0.01 0.00 2.80 0.00 0.00 57.97 60.69 1lko h PHE 138 Cb 0.03 -0.28 -0.04 0.00 2.20 0.00 0.00 35.95 37.87 1lko h PHE 138 CO -0.03 1.02 0.46 0.00 -0.60 0.00 0.00 178.31 179.16 1lko h ALA 139 N 0.99 0.98 -0.72 2.45 0.00 -0.95 -1.04 119.26 120.98 1lko h ALA 139 Ca 0.14 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.90 1lko h ALA 139 Cb 0.65 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 1lko h ALA 139 CO 0.04 0.46 0.21 -0.09 0.00 0.00 0.00 179.25 179.87 1lko h ARG 140 N 1.06 1.13 -0.73 0.00 2.43 -0.81 -0.42 114.38 117.04 1lko h ARG 140 Ca 0.28 -0.25 -0.01 0.00 -0.81 0.00 0.00 59.98 59.18 1lko h ARG 140 Cb -0.02 -0.16 -0.03 0.00 -0.42 0.00 0.00 29.97 29.33 1lko h ARG 140 CO -0.05 0.98 0.41 -0.91 -1.51 0.00 0.00 179.97 178.88 1lko h ASN 141 N 1.07 0.91 -0.09 -3.80 -0.26 -0.53 -0.69 115.58 112.19 1lko h ASN 141 Ca 0.23 -0.09 -0.01 0.00 -0.56 0.00 0.00 56.30 55.87 1lko h ASN 141 Cb 0.33 -0.23 -0.00 0.00 -1.06 0.00 0.00 38.32 37.35 1lko h ASN 141 CO -0.00 0.74 0.02 0.40 -1.06 0.00 0.00 177.43 177.52 1lko h ILE 142 N 1.01 1.21 -0.78 2.81 2.04 -0.83 0.21 117.51 123.18 1lko h ILE 142 Ca 0.26 -0.65 0.02 0.00 1.00 0.00 0.00 64.86 65.48 1lko h ILE 142 Cb 0.03 1.47 -0.04 0.00 -0.74 0.00 0.00 36.82 37.54 1lko h ILE 142 CO -0.04 0.19 0.51 0.50 0.00 0.00 0.00 178.15 179.31 1lko h LYS 143 N -0.08 0.98 -0.01 2.37 3.64 -0.84 -2.21 116.57 120.42 1lko h LYS 143 Ca 0.03 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1lko h LYS 143 Cb 0.28 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 31.88 1lko h LYS 143 CO 0.00 0.65 -0.12 0.39 -2.27 0.00 0.00 179.45 178.10 1lko n GLU 144 N -4.43 1.18 -3.23 1.90 1.02 -0.29 -4.94 120.64 111.84 1lko n GLU 144 Ca 0.09 -0.65 -0.16 0.00 -0.02 0.00 0.00 57.16 56.42 1lko n GLU 144 Cb 0.07 -1.49 0.05 0.00 -0.02 0.00 0.00 31.44 30.05 1lko n GLU 144 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1lko n GLY 145 N 1.25 -0.05 0.36 0.62 0.00 -0.49 -4.93 105.19 101.95 1lko n GLY 145 Ca 0.16 -0.05 0.04 0.00 0.00 0.00 0.00 46.02 46.17 1lko n GLY 145 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1lko n ARG 146 N -3.52 2.73 -0.12 1.61 5.12 0.62 -4.40 116.66 118.70 1lko n ARG 146 Ca 0.01 -2.01 -0.12 0.00 -1.93 0.00 0.00 57.85 53.80 1lko n ARG 146 Cb 0.54 -1.27 -0.02 0.00 -1.16 0.00 0.00 32.46 30.55 1lko n ARG 146 CO 0.00 0.00 0.00 0.28 -1.93 0.00 0.00 177.63 175.98 1lko h VAL 147 N 0.98 1.28 0.00 1.55 2.07 -1.90 -3.34 116.25 116.89 1lko h VAL 147 Ca 0.00 -1.24 0.00 0.00 0.82 0.00 0.00 66.70 66.28 1lko h VAL 147 Cb 0.77 1.31 0.00 0.00 -1.52 0.00 0.00 31.29 31.85 1lko h VAL 147 CO 0.03 0.41 0.00 0.49 0.02 0.00 0.00 177.57 178.52 1lko n PHE 148 N -4.33 0.00 -3.77 1.57 3.72 -1.26 -4.88 117.46 108.51 1lko n PHE 148 Ca -0.02 -0.38 -0.13 0.00 -0.05 0.00 0.00 57.45 56.87 1lko n PHE 148 Cb 0.38 -0.04 -0.13 0.00 -0.94 0.00 0.00 39.48 38.75 1lko n PHE 148 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 176.76 175.54 1lko s LEU 149 N -0.76 0.88 0.27 4.37 2.96 -1.26 -1.28 118.68 123.85 1lko s LEU 149 Ca 0.00 0.40 0.05 0.00 -0.22 0.00 0.00 54.13 54.36 1lko s LEU 149 Cb 0.00 0.60 -0.06 0.00 0.50 0.00 0.00 46.19 47.24 1lko s LEU 149 CO 0.00 -0.12 -0.01 -0.13 -1.32 0.00 0.00 176.35 174.77 1lko s ARG 150 N 0.72 1.48 0.06 1.98 1.81 0.71 -4.27 118.95 121.44 1lko s ARG 150 Ca -0.05 -1.76 -0.26 0.00 -1.72 0.00 0.00 55.73 51.93 1lko s ARG 150 Cb -0.07 -0.85 -0.17 0.00 -0.45 0.00 0.00 34.95 33.41 1lko s ARG 150 CO -0.04 -0.07 1.59 1.05 -0.68 0.00 0.00 175.30 177.15 1lko h GLU 151 N 2.33 -0.28 -6.21 3.54 9.09 -1.99 -3.44 114.58 117.62 1lko h GLU 151 Ca -0.39 0.02 -0.54 0.00 0.05 0.00 0.00 59.36 58.49 1lko h GLU 151 Cb 1.23 0.06 -0.06 0.00 -1.65 0.00 0.00 28.75 28.33 1lko h GLU 151 CO 0.67 -0.11 -0.56 -0.65 0.05 0.00 0.00 179.01 178.41 1lko s GLN 152 N -5.74 2.84 0.34 1.06 1.11 -1.26 -4.99 119.66 113.02 1lko s GLN 152 Ca -0.15 -1.01 -0.29 0.00 0.01 0.00 0.00 55.36 53.93 1lko s GLN 152 Cb 0.04 -2.56 -0.11 0.00 -1.01 0.00 0.00 33.01 29.38 1lko s GLN 152 CO 0.63 0.44 1.41 0.00 0.01 0.00 0.00 175.29 177.78 1lko s ALA 153 N -1.96 3.56 0.02 6.09 0.00 -1.26 -4.53 121.76 123.67 1lko s ALA 153 Ca 0.32 1.42 -0.00 0.00 0.00 0.00 0.00 51.96 53.69 1lko s ALA 153 Cb -0.09 -3.55 0.00 0.00 0.00 0.00 0.00 23.12 19.48 1lko s ALA 153 CO 0.24 -0.84 0.03 -2.37 0.00 0.00 0.00 175.76 172.82 1lko n THR 154 N 0.89 0.00 -4.30 0.00 5.66 -0.24 -4.88 114.28 111.41 1lko n THR 154 Ca 0.02 -0.13 -0.34 0.00 -3.05 0.00 0.00 64.05 60.54 1lko n THR 154 Cb 0.40 0.08 -0.11 0.00 -1.55 0.00 0.00 70.33 69.15 1lko n THR 154 CO 0.00 0.00 0.00 -0.54 -3.05 0.00 0.00 175.07 171.48 1lko s LYS 155 N -2.06 3.60 -0.07 1.09 1.02 -1.26 -1.10 119.74 120.96 1lko s LYS 155 Ca 0.02 -0.45 0.04 0.00 0.02 0.00 0.00 55.97 55.60 1lko s LYS 155 Cb -0.00 -2.96 -0.02 0.00 -0.52 0.00 0.00 37.83 34.33 1lko s LYS 155 CO 0.02 0.35 -0.19 -1.58 -0.92 0.00 0.00 175.35 173.02 1lko s TRP 156 N 0.10 2.60 -0.07 3.18 0.52 0.99 -0.93 118.94 125.32 1lko s TRP 156 Ca 0.01 -0.50 0.02 0.00 0.02 0.00 0.00 56.10 55.66 1lko s TRP 156 Cb -0.13 -1.65 -0.02 0.00 -1.15 0.00 0.00 33.47 30.51 1lko s TRP 156 CO 0.02 -0.07 -0.14 0.50 0.02 0.00 0.00 176.95 177.29 1lko s ARG 157 N -0.28 2.77 -0.31 4.98 3.52 0.12 0.03 118.95 129.79 1lko s ARG 157 Ca 0.01 -0.69 -0.26 0.00 -0.13 0.00 0.00 55.73 54.66 1lko s ARG 157 Cb -0.13 -2.46 0.01 0.00 -1.56 0.00 0.00 34.95 30.81 1lko s ARG 157 CO 0.03 0.50 0.94 0.00 -0.81 0.00 0.00 175.30 175.96 1lko h ARG 159 N 8.05 0.00 -0.09 0.00 3.08 -1.34 0.29 114.38 124.37 1lko h ARG 159 Ca -0.22 0.00 -0.20 0.00 0.07 0.00 0.00 59.98 59.63 1lko h ARG 159 Cb 1.08 0.00 0.01 0.00 0.08 0.00 0.00 29.97 31.14 1lko h ARG 159 CO 0.96 0.10 -0.71 -0.97 -1.07 0.00 0.00 179.97 178.28 1lko h ASN 160 N 0.00 0.78 0.00 7.04 -0.73 -1.91 -3.40 115.58 117.35 1lko h ASN 160 Ca -0.00 -0.67 0.00 0.00 1.87 0.00 0.00 56.30 57.50 1lko h ASN 160 Cb 0.38 -0.23 0.00 0.00 0.27 0.00 0.00 38.32 38.74 1lko h ASN 160 CO 0.01 1.33 0.00 0.00 -0.37 0.00 0.00 177.43 178.40 1lko n GLY 162 N 0.32 0.75 3.75 0.00 0.00 1.00 -5.02 105.19 105.99 1lko n GLY 162 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 1lko n GLY 162 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1lko n TYR 163 N -2.06 2.58 -4.17 1.61 9.36 -1.26 -4.59 117.16 118.64 1lko n TYR 163 Ca 0.00 0.46 -0.34 0.00 3.32 0.00 0.00 57.90 61.34 1lko n TYR 163 Cb 0.00 -2.45 -0.15 0.00 -0.63 0.00 0.00 39.34 36.12 1lko n TYR 163 CO 0.00 0.00 0.00 0.08 0.22 0.00 0.00 176.86 177.16 1lko s VAL 164 N -1.18 2.92 -0.12 2.97 1.01 -1.26 -0.45 120.40 124.30 1lko s VAL 164 Ca 0.60 -0.66 -0.01 0.00 0.00 0.00 0.00 61.98 61.90 1lko s VAL 164 Cb -0.47 -2.28 -0.03 0.00 0.00 0.00 0.00 36.38 33.60 1lko s VAL 164 CO 0.59 0.48 -0.07 -2.28 0.00 0.00 0.00 175.10 173.81 1lko s HIS 165 N 1.18 2.94 -0.22 5.22 2.46 0.10 -4.94 115.29 122.04 1lko s HIS 165 Ca 0.02 -0.28 -0.07 0.00 0.47 0.00 0.00 55.06 55.20 1lko s HIS 165 Cb -0.14 -1.85 -0.03 0.00 -0.13 0.00 0.00 32.58 30.42 1lko s HIS 165 CO -0.04 0.04 0.07 -1.21 -2.47 0.00 0.00 174.74 171.13 1lko s GLU 166 N -0.02 3.78 0.00 2.88 2.02 -1.26 -0.01 118.70 126.09 1lko s GLU 166 Ca -0.01 -0.43 0.00 0.00 0.02 0.00 0.00 54.97 54.56 1lko s GLU 166 Cb -0.14 -3.27 0.00 0.00 0.10 0.00 0.00 34.13 30.82 1lko s GLU 166 CO 0.03 0.00 0.00 0.41 0.02 0.00 0.00 175.26 175.72 1lko n GLY 167 N 4.35 -0.36 0.23 -1.39 0.00 -0.26 -4.94 105.19 102.82 1lko n GLY 167 Ca -0.16 -1.19 0.10 0.00 0.00 0.00 0.00 46.02 44.77 1lko n GLY 167 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1lko h THR 168 N 2.87 0.62 -3.83 2.61 1.35 -1.84 -0.61 112.91 114.09 1lko h THR 168 Ca 0.00 -1.00 -0.09 0.00 -0.55 0.00 0.00 66.41 64.77 1lko h THR 168 Cb 0.00 1.66 -0.14 0.00 -1.73 0.00 0.00 68.15 67.94 1lko h THR 168 CO 0.00 0.21 -0.37 -0.83 -0.25 0.00 0.00 175.52 174.29 1lko s GLY 169 N -4.27 0.18 0.51 5.82 0.00 -1.26 -0.21 107.32 108.09 1lko s GLY 169 Ca -0.01 -0.68 -0.21 0.00 0.00 0.00 0.00 44.72 43.82 1lko s GLY 169 CO 0.63 -0.82 1.17 0.00 0.00 0.00 0.00 173.10 174.08 1lko s ALA 170 N -3.88 2.81 0.65 3.20 0.00 -0.41 -4.96 121.76 119.16 1lko s ALA 170 Ca 0.08 0.92 -0.13 0.00 0.00 0.00 0.00 51.96 52.83 1lko s ALA 170 Cb 0.05 -3.39 -0.01 0.00 0.00 0.00 0.00 23.12 19.76 1lko s ALA 170 CO -0.09 -0.80 1.06 -1.25 0.00 0.00 0.00 175.76 174.68 1lko s PRO 171 N -3.00 3.12 0.36 0.00 0.04 -1.26 -4.95 135.00 129.30 1lko s PRO 171 Ca 0.69 1.07 0.05 0.00 0.04 0.00 0.00 61.00 62.85 1lko s PRO 171 Cb -0.28 -2.01 0.68 0.00 0.04 0.00 0.00 34.50 32.93 1lko s PRO 171 CO 0.32 -0.96 1.92 0.93 0.04 0.00 0.00 177.00 179.25 1lko h GLU 172 N -0.18 0.51 -3.85 4.56 4.39 -1.95 -3.31 114.58 114.75 1lko h GLU 172 Ca -0.45 -0.09 -0.27 0.00 0.34 0.00 0.00 59.36 58.90 1lko h GLU 172 Cb 1.21 -0.09 -0.29 0.00 -0.10 0.00 0.00 28.75 29.49 1lko h GLU 172 CO 0.57 0.49 -0.73 -0.51 -1.16 0.00 0.00 179.01 177.67 1lko s LEU 173 N -9.15 1.88 0.04 1.33 1.43 -1.26 -1.43 118.68 111.52 1lko s LEU 173 Ca -0.08 -0.02 -0.31 0.00 -1.03 0.00 0.00 54.13 52.70 1lko s LEU 173 Cb 0.16 -0.09 -0.06 0.00 0.03 0.00 0.00 46.19 46.23 1lko s LEU 173 CO 0.75 -0.00 1.40 0.00 0.23 0.00 0.00 176.35 178.73 1lko n PRO 175 N 4.90 0.16 -0.09 0.00 -0.04 -1.26 -0.73 135.00 137.95 1lko n PRO 175 Ca 0.13 0.44 -0.12 0.00 -0.04 0.00 0.00 63.50 63.91 1lko n PRO 175 Cb 0.43 -1.84 -0.05 0.00 -0.04 0.00 0.00 33.50 32.00 1lko n PRO 175 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1lko n ALA 176 N -1.74 0.68 0.87 0.55 0.00 -1.26 -4.68 120.51 114.94 1lko n ALA 176 Ca 0.02 -0.58 0.10 0.00 0.00 0.00 0.00 53.44 52.98 1lko n ALA 176 Cb 0.19 -0.10 0.06 0.00 0.00 0.00 0.00 19.45 19.60 1lko n ALA 176 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1lko n ALA 178 N 0.76 -0.04 -1.81 0.00 0.00 0.10 -4.96 120.51 114.55 1lko n ALA 178 Ca 0.11 0.04 -0.32 0.00 0.00 0.00 0.00 53.44 53.27 1lko n ALA 178 Cb 0.49 -1.21 -0.02 0.00 0.00 0.00 0.00 19.45 18.71 1lko n ALA 178 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 1lko s HIS 179 N -1.47 3.40 0.87 0.00 3.76 -1.26 -4.58 115.29 116.01 1lko s HIS 179 Ca 0.00 1.44 -0.11 0.00 -0.15 0.00 0.00 55.06 56.24 1lko s HIS 179 Cb 0.00 -2.82 0.11 0.00 1.11 0.00 0.00 32.58 30.99 1lko s HIS 179 CO 0.00 -0.58 1.10 -1.25 -0.85 0.00 0.00 174.74 173.16 1lko s PRO 180 N -4.31 1.47 0.50 8.40 0.04 -1.26 -0.45 135.00 139.38 1lko s PRO 180 Ca 0.59 1.07 0.35 0.00 0.04 0.00 0.00 61.00 63.06 1lko s PRO 180 Cb -0.11 -1.81 1.50 0.00 0.04 0.00 0.00 34.50 34.11 1lko s PRO 180 CO 0.37 -2.17 1.71 -0.22 0.04 0.00 0.00 177.00 176.73 1lko h LYS 181 N -1.51 0.08 -0.75 4.56 3.64 -1.33 -1.45 116.57 119.81 1lko h LYS 181 Ca -0.47 -0.00 0.22 0.00 -1.27 0.00 0.00 60.65 59.12 1lko h LYS 181 Cb 1.26 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 33.04 1lko h LYS 181 CO 0.51 0.05 0.72 0.00 -2.27 0.00 0.00 179.45 178.47 1lko h ALA 182 N 1.39 2.57 -0.00 5.00 0.00 -1.88 -0.47 119.26 125.88 1lko h ALA 182 Ca 0.71 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.60 1lko h ALA 182 Cb 2.56 0.06 0.00 0.00 0.00 0.00 0.00 17.79 20.41 1lko h ALA 182 CO -0.15 -1.11 -0.12 0.72 0.00 0.00 0.00 179.25 178.59 1lko n HIS 183 N -3.73 0.00 -3.06 0.00 8.25 -0.55 -1.88 115.22 114.25 1lko n HIS 183 Ca 0.16 0.00 -0.33 0.00 -0.26 0.00 0.00 57.72 57.29 1lko n HIS 183 Cb 0.99 -0.36 -0.06 0.00 1.12 0.00 0.00 29.99 31.67 1lko n HIS 183 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 1lko s PHE 184 N -2.84 3.37 0.14 4.41 0.40 -0.19 -0.86 117.98 122.42 1lko s PHE 184 Ca 0.18 1.31 -0.06 0.00 -0.60 0.00 0.00 56.93 57.77 1lko s PHE 184 Cb 0.19 -2.61 -0.02 0.00 0.51 0.00 0.00 43.02 41.09 1lko s PHE 184 CO 0.54 0.06 0.19 -1.83 0.70 0.00 0.00 175.22 174.88 1lko s GLU 185 N -2.98 1.03 0.25 0.44 -1.05 -0.33 -4.73 118.70 111.33 1lko s GLU 185 Ca 0.55 -1.24 -0.30 0.00 -0.15 0.00 0.00 54.97 53.84 1lko s GLU 185 Cb -0.10 0.32 -0.09 0.00 -0.44 0.00 0.00 34.13 33.82 1lko s GLU 185 CO 0.17 -0.34 1.30 -0.51 0.95 0.00 0.00 175.26 176.83 1lko s LEU 186 N -2.98 4.43 0.04 1.83 1.43 -1.26 0.15 118.68 122.32 1lko s LEU 186 Ca 0.18 2.50 -0.30 0.00 -1.03 0.00 0.00 54.13 55.47 1lko s LEU 186 Cb 0.05 -3.62 -0.08 0.00 0.03 0.00 0.00 46.19 42.56 1lko s LEU 186 CO -0.01 -0.51 1.78 -0.22 0.23 0.00 0.00 176.35 177.62 1lko s LEU 187 N -0.75 4.38 0.02 1.79 1.98 -0.11 -4.67 118.68 121.32 1lko s LEU 187 Ca 0.54 2.54 0.05 0.00 -2.89 0.00 0.00 54.13 54.37 1lko s LEU 187 Cb -0.38 -3.55 -0.03 0.00 0.66 0.00 0.00 46.19 42.90 1lko s LEU 187 CO 0.43 -0.97 -0.13 -0.83 -1.89 0.00 0.00 176.35 172.96 1lko s GLY 188 N 3.28 1.64 -0.36 7.98 0.00 -1.26 -4.97 107.32 113.62 1lko s GLY 188 Ca 0.79 -1.11 0.00 0.00 0.00 0.00 0.00 44.72 44.41 1lko s GLY 188 CO 0.35 -0.98 0.19 -0.42 0.00 0.00 0.00 173.10 172.25 1lko s ILE 189 N -0.93 0.61 -0.86 0.90 1.01 -1.26 -5.03 121.20 115.64 1lko s ILE 189 Ca 0.15 -1.80 0.01 0.00 0.00 0.00 0.00 60.65 59.01 1lko s ILE 189 Cb -0.11 -1.45 0.29 0.00 0.01 0.00 0.00 42.46 41.20 1lko s ILE 189 CO 0.06 -0.88 1.20 -0.46 0.00 0.00 0.00 174.94 174.86 1lko n ASN 190 N 4.17 5.37 0.00 3.58 2.04 -1.26 -5.35 115.26 123.81 1lko n ASN 190 Ca 0.07 -3.49 0.00 0.00 -0.44 0.00 0.00 54.58 50.72 1lko n ASN 190 Cb 0.38 -0.97 0.00 0.00 -2.53 0.00 0.00 39.78 36.66 1lko n ASN 190 CO 0.00 0.00 0.00 -2.67 -0.44 0.00 0.00 177.26 174.15