#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nat s GLU 4 N 0.00 4.65 -0.12 1.20 2.02 -1.26 -4.82 118.70 120.37 1nat s GLU 4 Ca 0.00 1.34 -0.05 0.00 0.02 0.00 0.00 54.97 56.28 1nat s GLU 4 Cb 0.00 -3.37 -0.04 0.00 0.10 0.00 0.00 34.13 30.83 1nat s GLU 4 CO 0.00 0.25 0.07 0.15 0.02 0.00 0.00 175.26 175.76 1nat s LYS 5 N -0.10 3.38 -0.10 1.61 1.02 -1.26 -0.45 119.74 123.85 1nat s LYS 5 Ca 0.44 -0.28 0.02 0.00 0.02 0.00 0.00 55.97 56.18 1nat s LYS 5 Cb -0.23 -3.05 0.01 0.00 -0.52 0.00 0.00 37.83 34.05 1nat s LYS 5 CO 0.28 0.65 -0.18 0.42 -0.92 0.00 0.00 175.35 175.60 1nat s ILE 6 N -0.68 1.64 -0.19 2.17 1.01 -0.17 -0.84 121.20 124.14 1nat s ILE 6 Ca 0.12 -0.75 -0.09 0.00 0.00 0.00 0.00 60.65 59.93 1nat s ILE 6 Cb -0.12 -1.46 -0.05 0.00 0.01 0.00 0.00 42.46 40.84 1nat s ILE 6 CO 0.02 0.47 0.12 -0.22 0.00 0.00 0.00 174.94 175.33 1nat s LEU 7 N 0.75 4.15 -0.28 2.97 2.96 -0.46 -0.26 118.68 128.51 1nat s LEU 7 Ca -0.11 0.23 -0.01 0.00 -0.22 0.00 0.00 54.13 54.02 1nat s LEU 7 Cb -0.16 -2.06 0.05 0.00 0.50 0.00 0.00 46.19 44.51 1nat s LEU 7 CO 0.02 0.21 -0.03 -0.63 -1.32 0.00 0.00 176.35 174.59 1nat s ILE 8 N 0.19 2.83 -0.62 6.68 1.01 0.30 -0.69 121.20 130.90 1nat s ILE 8 Ca 0.08 -1.34 -0.09 0.00 0.00 0.00 0.00 60.65 59.30 1nat s ILE 8 Cb -0.11 -2.59 0.16 0.00 0.01 0.00 0.00 42.46 39.93 1nat s ILE 8 CO -0.01 -0.02 0.50 -0.69 0.00 0.00 0.00 174.94 174.72 1nat s VAL 9 N 1.25 4.53 -0.09 2.92 1.01 -0.39 -0.11 120.40 129.52 1nat s VAL 9 Ca -0.05 -2.28 -0.06 0.00 0.00 0.00 0.00 61.98 59.60 1nat s VAL 9 Cb -0.19 -3.91 0.03 0.00 0.00 0.00 0.00 36.38 32.32 1nat s VAL 9 CO -0.02 -0.88 0.22 -0.62 0.00 0.00 0.00 175.10 173.80 1nat s ASP 10 N 2.05 -0.23 0.02 3.32 -1.08 -0.81 -1.15 116.67 118.79 1nat s ASP 10 Ca 0.12 0.46 0.24 0.00 -0.52 0.00 0.00 52.55 52.85 1nat s ASP 10 Cb -0.20 0.40 0.32 0.00 -1.46 0.00 0.00 42.92 41.98 1nat s ASP 10 CO -0.03 -0.12 1.28 -0.67 0.52 0.00 0.00 175.17 176.14 1nat n ASP 11 N 3.64 0.60 -4.49 -0.34 2.03 -1.26 -4.44 116.55 112.30 1nat n ASP 11 Ca -0.20 -0.31 -0.43 0.00 0.52 0.00 0.00 54.79 54.38 1nat n ASP 11 Cb 0.55 0.42 -0.03 0.00 -0.72 0.00 0.00 41.12 41.35 1nat n ASP 11 CO 0.00 0.00 0.00 -1.10 -1.92 0.00 0.00 177.20 174.18 1nat s GLN 12 N -3.05 3.46 0.19 -0.67 -0.21 -1.26 -4.91 119.66 113.21 1nat s GLN 12 Ca 0.09 -1.29 -0.23 0.00 0.02 0.00 0.00 55.36 53.95 1nat s GLN 12 Cb 0.16 -4.83 0.09 0.00 1.00 0.00 0.00 33.01 29.44 1nat s GLN 12 CO 0.74 -1.92 1.49 0.98 -2.12 0.00 0.00 175.29 174.46 1nat n TYR 13 N 7.58 -0.19 -0.02 0.91 9.36 -1.26 -0.79 117.16 132.75 1nat n TYR 13 Ca 0.19 1.19 -0.10 0.00 3.32 0.00 0.00 57.90 62.50 1nat n TYR 13 Cb 0.49 -0.72 -0.04 0.00 -0.63 0.00 0.00 39.34 38.43 1nat n TYR 13 CO 0.00 0.00 0.00 0.78 0.22 0.00 0.00 176.86 177.86 1nat h GLY 14 N 0.00 0.20 1.12 2.98 0.00 -1.98 0.07 103.07 105.45 1nat h GLY 14 Ca 0.25 -0.07 0.01 0.00 0.00 0.00 0.00 47.33 47.52 1nat h GLY 14 CO -0.93 0.06 0.57 -2.22 0.00 0.00 0.00 176.54 174.03 1nat h ILE 15 N 0.18 1.23 -0.30 2.60 1.08 -1.71 -0.43 117.51 120.17 1nat h ILE 15 Ca 0.05 -0.44 -0.04 0.00 -0.39 0.00 0.00 64.86 64.04 1nat h ILE 15 Cb -0.01 -0.06 -0.01 0.00 -3.07 0.00 0.00 36.82 33.67 1nat h ILE 15 CO -0.02 0.23 0.02 -0.09 -0.69 0.00 0.00 178.15 177.60 1nat h ARG 16 N 1.21 0.51 -0.07 2.37 2.43 -0.46 0.23 114.38 120.60 1nat h ARG 16 Ca 0.32 -0.15 -0.06 0.00 -0.81 0.00 0.00 59.98 59.28 1nat h ARG 16 Cb -0.12 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.37 1nat h ARG 16 CO -0.07 0.63 -0.26 0.82 -1.51 0.00 0.00 179.97 179.59 1nat h ILE 17 N 0.31 1.22 -0.01 1.20 5.03 -0.83 0.02 117.51 124.45 1nat h ILE 17 Ca 0.09 -1.01 -0.06 0.00 -0.12 0.00 0.00 64.86 63.75 1nat h ILE 17 Cb 0.39 1.46 0.00 0.00 -3.03 0.00 0.00 36.82 35.64 1nat h ILE 17 CO 0.01 0.30 -0.23 0.25 -0.68 0.00 0.00 178.15 177.80 1nat h LEU 18 N 0.10 0.22 -0.48 1.44 5.85 -0.78 -2.42 115.31 119.25 1nat h LEU 18 Ca 0.02 -0.74 0.02 0.00 0.84 0.00 0.00 57.88 58.02 1nat h LEU 18 Cb 0.52 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 41.45 1nat h LEU 18 CO 0.04 0.94 0.28 -0.07 -0.34 0.00 0.00 178.44 179.28 1nat h LEU 19 N -0.47 0.44 0.23 2.25 3.38 -0.85 -2.24 115.31 118.06 1nat h LEU 19 Ca -0.03 0.01 0.01 0.00 0.09 0.00 0.00 57.88 57.96 1nat h LEU 19 Cb 0.96 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 41.59 1nat h LEU 19 CO 0.05 0.31 -0.38 -1.13 0.09 0.00 0.00 178.44 177.38 1nat h ASN 20 N 0.55 -1.08 -0.96 -0.43 -0.73 -1.03 -2.60 115.58 109.30 1nat h ASN 20 Ca 0.19 0.11 0.09 0.00 1.87 0.00 0.00 56.30 58.56 1nat h ASN 20 Cb 0.03 0.39 -0.07 0.00 0.27 0.00 0.00 38.32 38.94 1nat h ASN 20 CO -0.10 -0.49 0.62 -0.08 -0.37 0.00 0.00 177.43 177.02 1nat h GLU 21 N -0.69 1.00 0.90 6.67 4.57 -1.31 -1.80 114.58 123.94 1nat h GLU 21 Ca 0.00 -0.06 -0.04 0.00 -1.18 0.00 0.00 59.36 58.08 1nat h GLU 21 Cb 0.67 -0.23 0.01 0.00 -0.16 0.00 0.00 28.75 29.04 1nat h GLU 21 CO -0.16 0.66 -0.43 0.28 -1.18 0.00 0.00 179.01 178.18 1nat h VAL 22 N 1.03 0.01 0.00 0.32 2.07 -1.22 -1.80 116.25 116.67 1nat h VAL 22 Ca 0.44 -0.11 -0.02 0.00 0.82 0.00 0.00 66.70 67.83 1nat h VAL 22 Cb 0.33 0.02 -0.00 0.00 -1.52 0.00 0.00 31.29 30.11 1nat h VAL 22 CO -0.20 0.00 -0.10 -0.26 0.02 0.00 0.00 177.57 177.03 1nat h PHE 23 N -1.32 0.00 -0.14 1.57 0.04 -1.38 0.67 116.94 116.39 1nat h PHE 23 Ca -0.12 0.00 -0.22 0.00 2.80 0.00 0.00 57.97 60.43 1nat h PHE 23 Cb 0.93 0.00 0.01 0.00 2.20 0.00 0.00 35.95 39.09 1nat h PHE 23 CO -0.00 0.10 -0.77 -0.97 -0.60 0.00 0.00 178.31 176.07 1nat h ASN 24 N 0.00 0.88 0.02 2.17 -0.73 -1.34 -0.85 115.58 115.73 1nat h ASN 24 Ca -0.00 -0.58 -0.09 0.00 1.87 0.00 0.00 56.30 57.50 1nat h ASN 24 Cb 0.26 -0.26 -0.01 0.00 0.27 0.00 0.00 38.32 38.57 1nat h ASN 24 CO 0.01 1.37 -0.28 0.50 -0.37 0.00 0.00 177.43 178.67 1nat h LYS 25 N 0.51 0.40 0.00 6.67 3.64 -0.05 -2.97 116.57 124.77 1nat h LYS 25 Ca -0.05 -0.15 -0.09 0.00 -1.27 0.00 0.00 60.65 59.08 1nat h LYS 25 Cb 1.40 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 33.18 1nat h LYS 25 CO 0.16 0.64 -0.45 1.49 -2.27 0.00 0.00 179.45 179.02 1nat h GLU 26 N 0.35 0.00 0.00 1.90 4.57 -0.82 -3.47 114.58 117.11 1nat h GLU 26 Ca 0.05 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.23 1nat h GLU 26 Cb 0.67 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.26 1nat h GLU 26 CO 0.05 0.45 0.00 0.41 -1.18 0.00 0.00 179.01 178.74 1nat n GLY 27 N -0.16 1.32 3.90 1.92 0.00 -0.97 -5.07 105.19 106.13 1nat n GLY 27 Ca -0.01 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.71 1nat n GLY 27 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1nat s TYR 28 N -1.96 3.47 -0.20 1.61 1.51 -0.36 -4.58 117.35 116.84 1nat s TYR 28 Ca 0.00 0.72 -0.16 0.00 -1.01 0.00 0.00 57.07 56.62 1nat s TYR 28 Cb 0.00 -2.17 -0.04 0.00 -0.11 0.00 0.00 41.96 39.64 1nat s TYR 28 CO 0.00 0.14 0.41 -1.14 -1.11 0.00 0.00 175.55 173.85 1nat s GLN 29 N -3.54 4.19 0.21 -0.62 0.74 0.41 -4.31 119.66 116.74 1nat s GLN 29 Ca 0.45 0.23 0.09 0.00 0.05 0.00 0.00 55.36 56.18 1nat s GLN 29 Cb -0.11 -3.53 -0.04 0.00 1.10 0.00 0.00 33.01 30.43 1nat s GLN 29 CO 0.29 -0.03 -0.03 0.95 -0.55 0.00 0.00 175.29 175.92 1nat s THR 30 N 1.28 3.45 0.03 -0.34 -4.23 -1.26 -1.00 115.64 113.57 1nat s THR 30 Ca 0.20 -1.68 0.03 0.00 -1.18 0.00 0.00 61.69 59.06 1nat s THR 30 Cb -0.15 -2.77 -0.02 0.00 1.34 0.00 0.00 72.50 70.91 1nat s THR 30 CO 0.08 -0.21 -0.10 -0.36 -0.54 0.00 0.00 174.62 173.50 1nat s PHE 31 N -1.94 0.83 0.10 3.99 0.08 0.64 -4.92 117.98 116.76 1nat s PHE 31 Ca 0.28 -0.33 0.10 0.00 0.12 0.00 0.00 56.93 57.10 1nat s PHE 31 Cb -0.08 -0.50 -0.04 0.00 -0.57 0.00 0.00 43.02 41.83 1nat s PHE 31 CO 0.18 -0.02 -0.26 -0.65 -0.10 0.00 0.00 175.22 174.37 1nat s GLN 32 N -1.02 1.57 0.05 0.44 -0.21 -1.26 -0.54 119.66 118.68 1nat s GLN 32 Ca -0.02 -1.25 -0.05 0.00 0.02 0.00 0.00 55.36 54.05 1nat s GLN 32 Cb -0.07 -1.94 -0.02 0.00 1.00 0.00 0.00 33.01 31.98 1nat s GLN 32 CO 0.01 0.47 0.08 0.00 -2.12 0.00 0.00 175.29 173.73 1nat s ALA 33 N -0.97 0.04 0.00 6.09 0.00 0.85 -4.92 121.76 122.85 1nat s ALA 33 Ca 0.13 -0.71 0.00 0.00 0.00 0.00 0.00 51.96 51.38 1nat s ALA 33 Cb -0.10 0.30 0.00 0.00 0.00 0.00 0.00 23.12 23.32 1nat s ALA 33 CO 0.05 -0.36 0.47 0.00 0.00 0.00 0.00 175.76 175.92 1nat n ALA 34 N 0.48 1.03 -2.41 0.00 0.00 -1.26 -1.93 120.51 116.42 1nat n ALA 34 Ca -0.17 -0.47 -0.10 0.00 0.00 0.00 0.00 53.44 52.70 1nat n ALA 34 Cb 0.60 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 19.96 1nat n ALA 34 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1nat s ASN 35 N -0.16 0.18 0.04 0.00 0.01 -1.26 -4.40 114.94 109.35 1nat s ASN 35 Ca 0.00 -1.08 -0.08 0.00 -0.71 0.00 0.00 52.86 51.00 1nat s ASN 35 Cb 0.00 0.37 -0.30 0.00 0.41 0.00 0.00 41.25 41.72 1nat s ASN 35 CO 0.00 -0.82 1.02 1.23 -1.51 0.00 0.00 177.10 177.02 1nat h GLY 36 N 2.70 0.40 0.89 0.66 0.00 -1.90 -2.76 103.07 103.07 1nat h GLY 36 Ca -0.33 -1.02 -0.00 0.00 0.00 0.00 0.00 47.33 45.97 1nat h GLY 36 CO 0.54 0.89 0.04 1.41 0.00 0.00 0.00 176.54 179.42 1nat h LEU 37 N 0.10 0.12 -1.57 3.11 4.07 -1.96 0.04 115.31 119.22 1nat h LEU 37 Ca -0.20 -0.13 -0.03 0.00 0.08 0.00 0.00 57.88 57.61 1nat h LEU 37 Cb 2.04 -0.03 -0.01 0.00 1.08 0.00 0.00 40.66 43.74 1nat h LEU 37 CO 0.21 0.22 0.01 1.56 -1.08 0.00 0.00 178.44 179.36 1nat h GLN 38 N 0.02 0.28 -0.02 1.13 4.20 -1.97 -2.65 115.11 116.10 1nat h GLN 38 Ca 0.03 -0.04 -0.01 0.00 0.06 0.00 0.00 58.65 58.69 1nat h GLN 38 Cb 0.13 -0.05 -0.00 0.00 0.30 0.00 0.00 27.48 27.85 1nat h GLN 38 CO -0.00 0.30 -0.02 0.00 -0.67 0.00 0.00 178.83 178.44 1nat h ALA 39 N 1.74 0.03 -0.84 3.87 0.00 -1.14 -2.72 119.26 120.20 1nat h ALA 39 Ca 0.07 -0.24 0.10 0.00 0.00 0.00 0.00 54.91 54.83 1nat h ALA 39 Cb 0.18 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 17.90 1nat h ALA 39 CO 0.00 -0.22 0.54 -0.07 0.00 0.00 0.00 179.25 179.51 1nat h LEU 40 N -0.40 0.71 -0.31 0.00 4.07 -0.95 -1.33 115.31 117.09 1nat h LEU 40 Ca 0.00 0.02 -0.04 0.00 0.08 0.00 0.00 57.88 57.95 1nat h LEU 40 Cb 0.49 -0.13 -0.01 0.00 1.08 0.00 0.00 40.66 42.09 1nat h LEU 40 CO 0.00 0.42 0.06 -0.78 -1.08 0.00 0.00 178.44 177.06 1nat h ASP 41 N 0.78 0.49 0.72 -0.43 3.58 -1.42 -2.02 116.42 118.12 1nat h ASP 41 Ca 0.39 -0.25 -0.08 0.00 0.42 0.00 0.00 57.03 57.51 1nat h ASP 41 Cb 0.45 -0.13 -0.01 0.00 1.72 0.00 0.00 39.33 41.36 1nat h ASP 41 CO -0.16 0.62 -0.36 0.40 -2.88 0.00 0.00 179.24 176.86 1nat h ILE 42 N 0.34 0.93 0.04 2.25 2.04 -1.14 -1.67 117.51 120.30 1nat h ILE 42 Ca 0.09 -1.43 -0.00 0.00 1.00 0.00 0.00 64.86 64.53 1nat h ILE 42 Cb 0.33 1.85 0.00 0.00 -0.74 0.00 0.00 36.82 38.27 1nat h ILE 42 CO 0.01 0.36 -0.02 0.58 0.00 0.00 0.00 178.15 179.07 1nat h VAL 43 N 0.00 1.25 -0.08 1.67 2.07 -0.96 0.24 116.25 120.43 1nat h VAL 43 Ca -0.00 -0.95 -0.01 0.00 0.82 0.00 0.00 66.70 66.56 1nat h VAL 43 Cb 0.82 1.87 -0.01 0.00 -1.52 0.00 0.00 31.29 32.46 1nat h VAL 43 CO 0.05 0.24 0.01 0.74 0.02 0.00 0.00 177.57 178.63 1nat h THR 44 N -0.47 1.05 0.02 2.57 2.02 -1.25 0.91 112.91 117.76 1nat h THR 44 Ca -0.01 -0.18 -0.36 0.00 0.77 0.00 0.00 66.41 66.63 1nat h THR 44 Cb 0.43 0.97 -0.06 0.00 -1.74 0.00 0.00 68.15 67.76 1nat h THR 44 CO 0.01 0.06 -2.26 0.29 0.37 0.00 0.00 175.52 173.99 1nat n LYS 45 N -4.48 0.68 -0.00 6.66 4.01 -0.64 -4.58 118.16 119.80 1nat n LYS 45 Ca -0.02 0.13 0.09 0.00 -0.51 0.00 0.00 58.31 58.00 1nat n LYS 45 Cb 0.12 -1.59 -0.12 0.00 -0.51 0.00 0.00 35.03 32.93 1nat n LYS 45 CO 0.00 0.00 0.00 0.39 -1.11 0.00 0.00 177.40 176.68 1nat n GLU 46 N -3.07 0.90 -3.77 1.97 -0.58 0.07 -5.04 120.64 111.12 1nat n GLU 46 Ca -0.35 -0.08 -0.29 0.00 -0.42 0.00 0.00 57.16 56.02 1nat n GLU 46 Cb 1.07 -1.38 0.01 0.00 -0.57 0.00 0.00 31.44 30.58 1nat n GLU 46 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1nat n ARG 47 N -1.75 -1.12 -2.21 3.49 1.74 0.31 -4.91 116.66 112.21 1nat n ARG 47 Ca 0.00 0.61 -0.33 0.00 -0.77 0.00 0.00 57.85 57.36 1nat n ARG 47 Cb 0.37 -2.99 -0.00 0.00 -1.02 0.00 0.00 32.46 28.81 1nat n ARG 47 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1nat s PRO 48 N -5.56 3.46 -0.03 5.56 0.04 -1.26 -4.93 135.00 132.28 1nat s PRO 48 Ca 0.21 1.28 -0.21 0.00 0.04 0.00 0.00 61.00 62.32 1nat s PRO 48 Cb -0.10 -2.05 -0.14 0.00 0.04 0.00 0.00 34.50 32.25 1nat s PRO 48 CO 0.90 -0.71 0.94 -0.44 0.04 0.00 0.00 177.00 177.73 1nat h ASP 49 N 0.83 -0.34 -4.40 6.66 3.32 -1.34 -3.45 116.42 117.69 1nat h ASP 49 Ca -0.48 -0.19 -0.70 0.00 0.02 0.00 0.00 57.03 55.69 1nat h ASP 49 Cb 1.22 0.09 -0.28 0.00 0.22 0.00 0.00 39.33 40.59 1nat h ASP 49 CO 0.58 0.12 -0.88 -0.22 -1.72 0.00 0.00 179.24 177.11 1nat s LEU 50 N -9.21 2.14 -0.16 1.55 2.96 -1.04 -3.57 118.68 111.35 1nat s LEU 50 Ca -0.12 -0.55 0.01 0.00 -0.22 0.00 0.00 54.13 53.26 1nat s LEU 50 Cb 0.01 -1.31 0.01 0.00 0.50 0.00 0.00 46.19 45.40 1nat s LEU 50 CO 0.44 0.28 -0.20 -0.69 -1.32 0.00 0.00 176.35 174.86 1nat s VAL 51 N -0.74 2.15 -0.40 1.68 1.01 -0.37 -1.36 120.40 122.36 1nat s VAL 51 Ca 0.11 -0.93 -0.13 0.00 0.00 0.00 0.00 61.98 61.03 1nat s VAL 51 Cb -0.10 -1.88 0.04 0.00 0.00 0.00 0.00 36.38 34.43 1nat s VAL 51 CO 0.01 0.54 0.27 -0.76 0.00 0.00 0.00 175.10 175.16 1nat s LEU 52 N 1.05 5.01 -0.26 3.92 1.43 0.13 -0.98 118.68 128.99 1nat s LEU 52 Ca -0.01 -1.06 -0.03 0.00 -1.03 0.00 0.00 54.13 52.00 1nat s LEU 52 Cb -0.14 -2.09 0.02 0.00 0.03 0.00 0.00 46.19 44.01 1nat s LEU 52 CO -0.07 -0.46 -0.02 -0.22 0.23 0.00 0.00 176.35 175.82 1nat s LEU 53 N 1.59 3.36 -0.02 1.79 2.96 -0.42 -1.26 118.68 126.68 1nat s LEU 53 Ca 0.03 -0.79 -0.30 0.00 -0.22 0.00 0.00 54.13 52.85 1nat s LEU 53 Cb -0.20 -1.73 -0.05 0.00 0.50 0.00 0.00 46.19 44.71 1nat s LEU 53 CO 0.07 -0.14 1.31 -0.62 -1.32 0.00 0.00 176.35 175.65 1nat s ASP 54 N 1.39 6.95 0.42 3.68 -1.08 -0.30 -0.87 116.67 126.85 1nat s ASP 54 Ca 0.01 1.98 0.29 0.00 -0.52 0.00 0.00 52.55 54.32 1nat s ASP 54 Cb -0.17 -2.56 1.30 0.00 -1.46 0.00 0.00 42.92 40.03 1nat s ASP 54 CO -0.02 -0.65 1.88 0.24 0.52 0.00 0.00 175.17 177.14 1nat h MET 55 N 7.62 0.00 -3.30 4.34 2.86 -1.28 -3.28 114.93 121.89 1nat h MET 55 Ca -0.36 0.00 -0.79 0.00 -2.06 0.00 0.00 59.70 56.49 1nat h MET 55 Cb 1.17 0.00 -0.24 0.00 0.06 0.00 0.00 31.60 32.59 1nat h MET 55 CO 0.89 0.00 1.12 1.63 1.06 0.00 0.00 176.91 181.60 1nat n LYS 56 N -2.66 4.05 -4.19 1.72 4.76 -1.26 -3.42 118.16 117.16 1nat n LYS 56 Ca 0.01 -4.22 -0.27 0.00 -2.87 0.00 0.00 58.31 50.96 1nat n LYS 56 Cb 0.22 -2.67 -0.08 0.00 -1.84 0.00 0.00 35.03 30.67 1nat n LYS 56 CO 0.00 0.00 0.00 0.96 -1.37 0.00 0.00 177.40 176.99 1nat s ILE 57 N -1.42 3.81 0.33 -0.18 -5.25 -1.24 -4.64 121.20 112.60 1nat s ILE 57 Ca 0.34 -1.36 -0.29 0.00 -0.99 0.00 0.00 60.65 58.36 1nat s ILE 57 Cb 0.04 -2.91 -0.10 0.00 2.95 0.00 0.00 42.46 42.43 1nat s ILE 57 CO 0.05 -0.09 1.36 -2.84 -1.79 0.00 0.00 174.94 171.63 1nat s PRO 58 N -2.89 4.29 0.00 0.37 0.02 -1.26 -4.48 135.00 131.05 1nat s PRO 58 Ca 0.27 2.30 0.00 0.00 0.02 0.00 0.00 61.00 63.60 1nat s PRO 58 Cb -0.10 -3.05 0.00 0.00 0.02 0.00 0.00 34.50 31.37 1nat s PRO 58 CO 0.19 -0.29 0.00 0.41 -0.33 0.00 0.00 177.00 176.98 1nat n GLY 59 N 0.87 2.22 3.84 0.52 0.00 -1.26 -4.30 105.19 107.07 1nat n GLY 59 Ca 0.01 0.01 -0.36 0.00 0.00 0.00 0.00 46.02 45.68 1nat n GLY 59 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1nat s MET 60 N 0.00 3.99 0.28 1.61 -2.45 -1.26 -5.07 119.30 116.40 1nat s MET 60 Ca 0.00 0.49 -0.28 0.00 -1.25 0.00 0.00 55.69 54.65 1nat s MET 60 Cb 0.00 -3.05 -0.09 0.00 1.25 0.00 0.00 34.83 32.94 1nat s MET 60 CO 0.00 0.55 0.97 0.16 1.05 0.00 0.00 175.02 177.75 1nat s ASP 61 N -1.50 7.45 0.29 1.11 -4.77 -1.26 -4.55 116.67 113.43 1nat s ASP 61 Ca 0.33 1.95 0.03 0.00 -3.30 0.00 0.00 52.55 51.57 1nat s ASP 61 Cb -0.16 -2.60 0.66 0.00 -1.09 0.00 0.00 42.92 39.73 1nat s ASP 61 CO 0.18 0.01 1.77 1.23 0.70 0.00 0.00 175.17 179.06 1nat h GLY 62 N 3.68 1.63 2.00 2.12 0.00 -1.88 0.06 103.07 110.69 1nat h GLY 62 Ca -0.46 -0.31 -0.02 0.00 0.00 0.00 0.00 47.33 46.54 1nat h GLY 62 CO 0.66 -0.06 -0.07 -2.22 0.00 0.00 0.00 176.54 174.85 1nat h ILE 63 N 0.70 0.70 0.15 2.60 1.08 -1.93 -1.30 117.51 119.52 1nat h ILE 63 Ca 0.54 -0.29 -0.34 0.00 -0.39 0.00 0.00 64.86 64.37 1nat h ILE 63 Cb 0.81 1.18 -0.00 0.00 -3.07 0.00 0.00 36.82 35.74 1nat h ILE 63 CO -0.38 0.07 -1.74 -0.08 -0.69 0.00 0.00 178.15 175.33 1nat h GLU 64 N 0.00 0.33 0.00 2.37 4.57 -1.41 -2.47 114.58 117.96 1nat h GLU 64 Ca -0.00 -0.56 -0.04 0.00 -1.18 0.00 0.00 59.36 57.58 1nat h GLU 64 Cb 0.17 0.21 -0.01 0.00 -0.16 0.00 0.00 28.75 28.96 1nat h GLU 64 CO 0.01 1.22 -0.19 -0.84 -1.18 0.00 0.00 179.01 178.04 1nat h ILE 65 N 0.09 0.68 -0.01 2.32 -0.00 -0.98 -1.60 117.51 118.01 1nat h ILE 65 Ca -0.33 -0.79 -0.17 0.00 -0.00 0.00 0.00 64.86 63.57 1nat h ILE 65 Cb 2.07 1.50 0.01 0.00 -0.00 0.00 0.00 36.82 40.40 1nat h ILE 65 CO 0.16 0.18 -0.64 0.25 -0.00 0.00 0.00 178.15 178.10 1nat h LEU 66 N 0.00 0.58 -0.87 0.16 5.85 -1.29 -1.46 115.31 118.28 1nat h LEU 66 Ca -0.00 -0.75 0.00 0.00 0.84 0.00 0.00 57.88 57.97 1nat h LEU 66 Cb 0.48 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 41.30 1nat h LEU 66 CO 0.02 1.25 0.54 0.11 -0.34 0.00 0.00 178.44 180.03 1nat h LYS 67 N -0.03 1.17 -0.43 1.25 1.57 -1.13 -2.64 116.57 116.32 1nat h LYS 67 Ca -0.08 -0.09 -0.10 0.00 -1.87 0.00 0.00 60.65 58.51 1nat h LYS 67 Cb 1.34 -0.25 -0.02 0.00 0.08 0.00 0.00 32.23 33.38 1nat h LYS 67 CO 0.13 0.80 -0.15 0.00 -0.57 0.00 0.00 179.45 179.66 1nat h ARG 68 N 1.19 0.81 -0.69 3.15 3.08 -1.19 -2.41 114.38 118.32 1nat h ARG 68 Ca 0.31 -0.30 -0.06 0.00 0.07 0.00 0.00 59.98 60.01 1nat h ARG 68 Cb -0.08 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 29.89 1nat h ARG 68 CO -0.06 0.92 0.20 0.52 -1.07 0.00 0.00 179.97 180.48 1nat h MET 69 N 0.73 1.08 -0.49 0.04 2.86 -1.20 -2.48 114.93 115.46 1nat h MET 69 Ca 0.11 -0.24 0.02 0.00 -2.06 0.00 0.00 59.70 57.53 1nat h MET 69 Cb 0.66 -0.15 -0.03 0.00 0.06 0.00 0.00 31.60 32.13 1nat h MET 69 CO 0.05 0.94 0.29 -0.22 1.06 0.00 0.00 176.91 179.03 1nat h LYS 70 N 1.02 0.57 -0.65 1.72 1.63 -1.12 -1.11 116.57 118.63 1nat h LYS 70 Ca 0.22 -0.03 -0.02 0.00 -0.85 0.00 0.00 60.65 59.96 1nat h LYS 70 Cb 0.32 -0.13 -0.03 0.00 -0.60 0.00 0.00 32.23 31.79 1nat h LYS 70 CO -0.00 0.38 0.31 0.28 -3.45 0.00 0.00 179.45 176.96 1nat h VAL 71 N 0.58 1.21 -0.29 2.00 2.07 -1.28 -0.96 116.25 119.59 1nat h VAL 71 Ca 0.20 -0.60 -0.18 0.00 0.82 0.00 0.00 66.70 66.94 1nat h VAL 71 Cb 0.02 0.39 -0.00 0.00 -1.52 0.00 0.00 31.29 30.18 1nat h VAL 71 CO -0.09 0.25 -0.51 0.40 0.02 0.00 0.00 177.57 177.64 1nat h ILE 72 N 0.92 1.28 -2.26 4.57 2.04 -0.91 -3.41 117.51 119.74 1nat h ILE 72 Ca 0.23 -1.70 -0.42 0.00 1.00 0.00 0.00 64.86 63.97 1nat h ILE 72 Cb 0.10 1.59 -0.35 0.00 -0.74 0.00 0.00 36.82 37.43 1nat h ILE 72 CO -0.03 0.55 -0.71 -0.62 0.00 0.00 0.00 178.15 177.34 1nat s ASP 73 N -6.92 2.02 0.21 1.72 2.15 -0.49 -5.01 116.67 110.34 1nat s ASP 73 Ca -0.10 -1.35 0.12 0.00 0.43 0.00 0.00 52.55 51.65 1nat s ASP 73 Cb 0.11 0.24 0.63 0.00 -0.30 0.00 0.00 42.92 43.60 1nat s ASP 73 CO 0.88 -0.34 1.30 -1.84 -0.17 0.00 0.00 175.17 175.00 1nat n GLU 74 N 4.74 0.08 -0.28 4.34 0.28 -0.38 -0.78 120.64 128.63 1nat n GLU 74 Ca 0.04 0.54 0.07 0.00 -0.16 0.00 0.00 57.16 57.65 1nat n GLU 74 Cb 0.44 -1.86 0.21 0.00 1.43 0.00 0.00 31.44 31.66 1nat n GLU 74 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 1nat n ASN 75 N -1.90 3.37 -4.74 -1.84 5.03 -1.26 -5.01 115.26 108.91 1nat n ASN 75 Ca -0.01 -2.16 -0.42 0.00 0.87 0.00 0.00 54.58 52.86 1nat n ASN 75 Cb 0.13 -0.34 -0.02 0.00 -1.02 0.00 0.00 39.78 38.53 1nat n ASN 75 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1nat n ILE 76 N 0.62 0.76 -3.54 2.41 0.13 0.04 -4.94 119.36 114.83 1nat n ILE 76 Ca 0.16 -0.19 -0.41 0.00 -1.10 0.00 0.00 62.75 61.21 1nat n ILE 76 Cb 0.56 -1.95 -0.10 0.00 -0.84 0.00 0.00 39.64 37.30 1nat n ILE 76 CO 0.00 0.00 0.00 -0.13 2.80 0.00 0.00 176.55 179.22 1nat s ARG 77 N -0.08 2.79 -0.01 9.51 0.52 -1.23 -5.00 118.95 125.44 1nat s ARG 77 Ca 0.67 -1.27 0.01 0.00 -0.52 0.00 0.00 55.73 54.62 1nat s ARG 77 Cb -0.50 -3.85 -0.03 0.00 0.52 0.00 0.00 34.95 31.08 1nat s ARG 77 CO 0.44 -0.87 -0.02 0.08 0.02 0.00 0.00 175.30 174.96 1nat s VAL 78 N 1.54 4.05 -0.26 3.52 1.01 -1.26 -1.24 120.40 127.75 1nat s VAL 78 Ca 0.03 -0.59 0.01 0.00 0.00 0.00 0.00 61.98 61.43 1nat s VAL 78 Cb -0.22 -2.78 0.07 0.00 0.00 0.00 0.00 36.38 33.46 1nat s VAL 78 CO 0.05 0.42 -0.02 -0.63 0.00 0.00 0.00 175.10 174.93 1nat s ILE 79 N -1.03 1.53 0.25 2.22 1.01 -0.15 0.49 121.20 125.53 1nat s ILE 79 Ca 0.18 -1.40 -0.21 0.00 0.00 0.00 0.00 60.65 59.23 1nat s ILE 79 Cb -0.11 -1.90 -0.09 0.00 0.01 0.00 0.00 42.46 40.37 1nat s ILE 79 CO 0.08 -0.25 0.77 0.27 0.00 0.00 0.00 174.94 175.81 1nat s ILE 80 N 1.36 4.50 -0.12 2.92 -4.36 -1.11 -1.30 121.20 123.10 1nat s ILE 80 Ca -0.01 1.36 0.00 0.00 -0.26 0.00 0.00 60.65 61.74 1nat s ILE 80 Cb -0.19 -3.86 -0.02 0.00 1.25 0.00 0.00 42.46 39.65 1nat s ILE 80 CO -0.09 0.15 -0.12 -0.04 0.24 0.00 0.00 174.94 175.08 1nat s MET 81 N -2.10 3.25 0.01 0.37 -1.94 -0.05 -0.42 119.30 118.42 1nat s MET 81 Ca 0.46 -0.67 -0.00 0.00 -1.71 0.00 0.00 55.69 53.77 1nat s MET 81 Cb -0.16 -2.61 0.00 0.00 2.01 0.00 0.00 34.83 34.07 1nat s MET 81 CO 0.21 0.30 0.01 -2.37 -0.01 0.00 0.00 175.02 173.16 1nat n THR 82 N 3.29 0.00 -3.45 2.05 5.66 -0.02 -0.76 114.28 121.04 1nat n THR 82 Ca -0.18 -0.04 -0.36 0.00 -3.05 0.00 0.00 64.05 60.42 1nat n THR 82 Cb 0.53 0.02 -0.06 0.00 -1.55 0.00 0.00 70.33 69.27 1nat n THR 82 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1nat s ALA 83 N -1.57 3.66 0.63 1.79 0.00 -1.26 0.06 121.76 125.06 1nat s ALA 83 Ca 0.01 -0.21 0.34 0.00 0.00 0.00 0.00 51.96 52.10 1nat s ALA 83 Cb -0.00 -2.42 1.94 0.00 0.00 0.00 0.00 23.12 22.64 1nat s ALA 83 CO 0.00 0.49 2.20 0.10 0.00 0.00 0.00 175.76 178.55 1nat h TYR 84 N 4.07 0.00 -0.44 0.00 -0.00 -1.94 -2.32 116.97 116.34 1nat h TYR 84 Ca -0.50 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.23 1nat h TYR 84 Cb 1.20 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.93 1nat h TYR 84 CO 0.68 0.00 0.00 0.41 -0.00 0.00 0.00 178.16 179.25 1nat n GLY 85 N -1.26 1.98 2.72 0.10 0.00 -1.26 -4.50 105.19 102.97 1nat n GLY 85 Ca -0.01 -0.58 -0.40 0.00 0.00 0.00 0.00 46.02 45.02 1nat n GLY 85 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1nat n GLU 86 N 0.66 4.68 -0.19 1.61 -0.58 -0.87 -4.84 120.64 121.11 1nat n GLU 86 Ca 0.18 -4.40 0.01 0.00 -0.42 0.00 0.00 57.16 52.53 1nat n GLU 86 Cb 0.68 -2.41 0.27 0.00 -0.57 0.00 0.00 31.44 29.41 1nat n GLU 86 CO 0.00 0.00 0.00 -0.07 -0.48 0.00 0.00 177.13 176.58 1nat h LEU 87 N 3.84 0.82 -0.26 -4.62 3.38 -1.86 -1.31 115.31 115.30 1nat h LEU 87 Ca 0.52 -0.02 -0.19 0.00 0.09 0.00 0.00 57.88 58.28 1nat h LEU 87 Cb 0.27 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.80 1nat h LEU 87 CO 1.22 0.59 -0.89 0.44 0.09 0.00 0.00 178.44 179.90 1nat h ASP 88 N 0.97 0.15 -0.12 -0.43 3.32 -1.99 -2.82 116.42 115.50 1nat h ASP 88 Ca 0.26 -0.13 -0.22 0.00 0.02 0.00 0.00 57.03 56.96 1nat h ASP 88 Cb -0.10 -0.05 0.01 0.00 0.22 0.00 0.00 39.33 39.41 1nat h ASP 88 CO -0.06 0.96 -0.79 -0.03 -1.72 0.00 0.00 179.24 177.60 1nat h MET 89 N 0.06 0.77 -0.47 3.56 4.05 -1.93 -2.06 114.93 118.91 1nat h MET 89 Ca -0.03 -0.64 -0.05 0.00 -0.28 0.00 0.00 59.70 58.70 1nat h MET 89 Cb 1.53 0.14 -0.02 0.00 -0.80 0.00 0.00 31.60 32.45 1nat h MET 89 CO 0.13 1.25 0.11 0.82 0.23 0.00 0.00 176.91 179.44 1nat h ILE 90 N 0.52 1.21 -0.09 1.77 2.04 -1.30 -2.05 117.51 119.62 1nat h ILE 90 Ca -0.06 -0.76 -0.02 0.00 1.00 0.00 0.00 64.86 65.02 1nat h ILE 90 Cb 1.42 0.74 -0.00 0.00 -0.74 0.00 0.00 36.82 38.23 1nat h ILE 90 CO 0.16 0.28 -0.04 -0.61 0.00 0.00 0.00 178.15 177.94 1nat h GLN 91 N 0.70 0.18 -0.57 2.37 5.75 -1.39 -2.55 115.11 119.60 1nat h GLN 91 Ca 0.16 -0.08 0.10 0.00 -0.15 0.00 0.00 58.65 58.68 1nat h GLN 91 Cb 0.27 -0.01 -0.08 0.00 1.07 0.00 0.00 27.48 28.74 1nat h GLN 91 CO -0.00 0.54 0.15 0.93 -2.65 0.00 0.00 178.83 177.79 1nat h GLU 92 N -0.19 0.28 -0.75 1.69 5.08 -1.06 0.21 114.58 119.85 1nat h GLU 92 Ca 0.02 -0.02 0.01 0.00 -1.00 0.00 0.00 59.36 58.37 1nat h GLU 92 Cb 0.48 -0.06 -0.04 0.00 0.50 0.00 0.00 28.75 29.63 1nat h GLU 92 CO 0.01 0.19 0.49 0.77 -1.00 0.00 0.00 179.01 179.47 1nat h SER 93 N 0.29 0.86 -0.42 1.42 0.02 -1.40 0.28 113.55 114.61 1nat h SER 93 Ca 0.29 -0.03 -0.05 0.00 -0.84 0.00 0.00 61.79 61.16 1nat h SER 93 Cb 0.40 -0.22 -0.02 0.00 0.14 0.00 0.00 62.40 62.70 1nat h SER 93 CO -0.35 0.63 0.07 0.50 -1.14 0.00 0.00 176.83 176.55 1nat h LYS 94 N 1.02 0.69 -0.02 3.45 3.64 -0.55 0.75 116.57 125.55 1nat h LYS 94 Ca 0.27 -0.18 0.02 0.00 -1.27 0.00 0.00 60.65 59.49 1nat h LYS 94 Cb -0.10 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 31.62 1nat h LYS 94 CO -0.06 0.73 -0.07 0.93 -2.27 0.00 0.00 179.45 178.71 1nat h GLU 95 N 0.54 -0.11 0.00 1.90 3.07 0.72 -2.12 114.58 118.58 1nat h GLU 95 Ca 0.13 0.01 -0.00 0.00 -0.50 0.00 0.00 59.36 58.99 1nat h GLU 95 Cb 0.37 0.03 -0.00 0.00 -0.84 0.00 0.00 28.75 28.30 1nat h GLU 95 CO 0.01 -0.08 -0.01 -0.07 -1.40 0.00 0.00 179.01 177.46 1nat h LEU 96 N -0.12 0.00 0.00 1.33 3.38 -0.28 -3.46 115.31 116.16 1nat h LEU 96 Ca 0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1nat h LEU 96 Cb 0.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.91 1nat h LEU 96 CO -0.09 0.01 0.00 0.61 0.09 0.00 0.00 178.44 179.06 1nat n GLY 97 N -0.42 1.88 3.72 0.83 0.00 -0.23 -5.05 105.19 105.92 1nat n GLY 97 Ca -0.01 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.59 1nat n GLY 97 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nat s ALA 98 N -1.88 3.41 0.11 4.61 0.00 0.09 -4.49 121.76 123.60 1nat s ALA 98 Ca 0.00 0.88 -0.28 0.00 0.00 0.00 0.00 51.96 52.57 1nat s ALA 98 Cb 0.00 -3.44 -0.10 0.00 0.00 0.00 0.00 23.12 19.58 1nat s ALA 98 CO 0.00 -0.41 1.64 -0.07 0.00 0.00 0.00 175.76 176.92 1nat h LEU 99 N 6.36 -0.72 0.00 0.00 4.07 -0.30 -3.44 115.31 121.28 1nat h LEU 99 Ca -0.42 0.08 0.00 0.00 0.08 0.00 0.00 57.88 57.61 1nat h LEU 99 Cb 1.21 0.26 0.00 0.00 1.08 0.00 0.00 40.66 43.22 1nat h LEU 99 CO 0.79 -0.36 0.00 1.07 -1.08 0.00 0.00 178.44 178.87 1nat n THR 100 N -5.38 0.00 -3.65 0.22 5.66 -1.26 -5.07 114.28 104.80 1nat n THR 100 Ca -0.07 0.00 -0.15 0.00 -3.05 0.00 0.00 64.05 60.78 1nat n THR 100 Cb 0.29 0.00 -0.08 0.00 -1.55 0.00 0.00 70.33 68.99 1nat n THR 100 CO 0.00 0.00 0.00 -1.38 -3.05 0.00 0.00 175.07 170.64 1nat s HIS 101 N -3.71 -0.53 -0.03 1.09 -3.43 -1.26 -2.74 115.29 104.68 1nat s HIS 101 Ca 0.00 1.10 0.06 0.00 -0.80 0.00 0.00 55.06 55.42 1nat s HIS 101 Cb 0.00 0.25 -0.01 0.00 -1.43 0.00 0.00 32.58 31.39 1nat s HIS 101 CO 0.00 -0.42 -0.20 -0.06 -2.00 0.00 0.00 174.74 172.06 1nat s PHE 102 N -0.56 1.89 0.23 0.38 0.08 0.44 -4.96 117.98 115.48 1nat s PHE 102 Ca -0.07 -0.44 -0.19 0.00 0.12 0.00 0.00 56.93 56.35 1nat s PHE 102 Cb -0.03 -1.24 -0.08 0.00 -0.57 0.00 0.00 43.02 41.10 1nat s PHE 102 CO 0.05 -0.10 0.72 0.00 -0.10 0.00 0.00 175.22 175.79 1nat s ALA 103 N -0.29 3.41 -0.12 5.36 0.00 -1.26 -0.84 121.76 128.02 1nat s ALA 103 Ca 0.03 0.14 -0.07 0.00 0.00 0.00 0.00 51.96 52.07 1nat s ALA 103 Cb -0.10 -2.80 -0.04 0.00 0.00 0.00 0.00 23.12 20.18 1nat s ALA 103 CO 0.01 0.33 0.12 0.15 0.00 0.00 0.00 175.76 176.37 1nat s LYS 104 N -2.06 3.46 0.25 0.00 1.02 0.11 -3.00 119.74 119.51 1nat s LYS 104 Ca 0.44 -0.18 -0.30 0.00 0.02 0.00 0.00 55.97 55.95 1nat s LYS 104 Cb -0.16 -3.15 -0.09 0.00 -0.52 0.00 0.00 37.83 33.91 1nat s LYS 104 CO 0.21 0.71 1.14 -2.14 -0.92 0.00 0.00 175.35 174.35 1nat s PRO 105 N -0.84 4.58 0.56 -1.68 0.02 -1.26 -4.65 135.00 131.72 1nat s PRO 105 Ca 0.14 1.84 0.05 0.00 0.02 0.00 0.00 61.00 63.05 1nat s PRO 105 Cb -0.12 -3.21 0.04 0.00 0.02 0.00 0.00 34.50 31.24 1nat s PRO 105 CO 0.03 0.09 0.40 -0.59 -0.33 0.00 0.00 177.00 176.60 1nat s PHE 106 N -0.75 1.52 -0.35 6.54 -0.12 -1.16 -5.10 117.98 118.56 1nat s PHE 106 Ca 0.48 -0.88 -0.13 0.00 -0.05 0.00 0.00 56.93 56.35 1nat s PHE 106 Cb -0.32 -1.88 -0.01 0.00 -0.63 0.00 0.00 43.02 40.17 1nat s PHE 106 CO 0.40 -0.50 0.25 0.34 -0.05 0.00 0.00 175.22 175.66 1nat s ASP 107 N -4.29 6.07 0.66 1.98 2.15 -1.26 -4.94 116.67 117.04 1nat s ASP 107 Ca 0.31 -0.47 0.35 0.00 0.43 0.00 0.00 52.55 53.18 1nat s ASP 107 Cb -0.02 -2.14 1.93 0.00 -0.30 0.00 0.00 42.92 42.38 1nat s ASP 107 CO 0.20 -0.26 2.10 -0.29 -0.17 0.00 0.00 175.17 176.75 1nat h ILE 108 N 5.50 0.06 0.02 4.11 6.09 -1.99 0.75 117.51 132.04 1nat h ILE 108 Ca -0.31 0.00 -0.21 0.00 -1.37 0.00 0.00 64.86 62.97 1nat h ILE 108 Cb 1.15 0.80 -0.02 0.00 0.47 0.00 0.00 36.82 39.23 1nat h ILE 108 CO 0.64 0.00 -0.96 0.44 -3.07 0.00 0.00 178.15 175.20 1nat h ASP 109 N 0.00 0.14 0.27 2.19 3.32 -1.98 -1.12 116.42 119.23 1nat h ASP 109 Ca 0.01 -0.13 -0.18 0.00 0.02 0.00 0.00 57.03 56.76 1nat h ASP 109 Cb 0.42 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.92 1nat h ASP 109 CO -0.00 1.02 -0.71 -0.33 -1.72 0.00 0.00 179.24 177.50 1nat h GLU 110 N 0.04 0.39 -0.09 3.56 5.08 0.09 0.46 114.58 124.11 1nat h GLU 110 Ca -0.04 -0.31 -0.13 0.00 -1.00 0.00 0.00 59.36 57.88 1nat h GLU 110 Cb 1.66 0.06 0.01 0.00 0.50 0.00 0.00 28.75 30.97 1nat h GLU 110 CO 0.14 0.95 -0.47 0.82 -1.00 0.00 0.00 179.01 179.45 1nat h ILE 111 N 0.27 1.39 -0.76 3.13 1.08 -1.35 -2.38 117.51 118.89 1nat h ILE 111 Ca -0.03 -1.83 0.07 0.00 -0.39 0.00 0.00 64.86 62.68 1nat h ILE 111 Cb 1.28 2.26 -0.06 0.00 -3.07 0.00 0.00 36.82 37.23 1nat h ILE 111 CO 0.12 0.54 0.44 -0.09 -0.69 0.00 0.00 178.15 178.47 1nat h ARG 112 N 0.03 0.77 0.00 2.37 2.43 -1.08 -1.18 114.38 117.73 1nat h ARG 112 Ca -0.03 -0.05 -0.08 0.00 -0.81 0.00 0.00 59.98 59.00 1nat h ARG 112 Cb 1.12 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 30.48 1nat h ARG 112 CO 0.10 0.51 -0.40 -0.44 -1.51 0.00 0.00 179.97 178.22 1nat h ASP 113 N 0.79 0.00 0.46 -3.80 5.19 -0.84 -3.15 116.42 115.07 1nat h ASP 113 Ca 0.34 0.00 -0.22 0.00 -0.62 0.00 0.00 57.03 56.53 1nat h ASP 113 Cb 0.21 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 39.72 1nat h ASP 113 CO -0.19 0.40 -0.96 0.00 -3.12 0.00 0.00 179.24 175.38 1nat h ALA 114 N 1.60 0.38 0.00 3.45 0.00 -0.70 -2.72 119.26 121.27 1nat h ALA 114 Ca -0.00 -0.74 -0.12 0.00 0.00 0.00 0.00 54.91 54.05 1nat h ALA 114 Cb 0.75 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 18.49 1nat h ALA 114 CO 0.05 0.87 -0.56 -0.39 0.00 0.00 0.00 179.25 179.22 1nat h VAL 115 N 0.17 1.34 0.00 0.00 -1.51 -1.38 -1.13 116.25 113.74 1nat h VAL 115 Ca -0.07 -1.97 -0.02 0.00 -1.23 0.00 0.00 66.70 63.40 1nat h VAL 115 Cb 1.60 2.08 -0.00 0.00 -2.13 0.00 0.00 31.29 32.84 1nat h VAL 115 CO 0.16 0.55 -0.12 0.11 -1.23 0.00 0.00 177.57 177.04 1nat h LYS 116 N 0.00 0.00 0.14 5.19 1.57 -1.56 0.83 116.57 122.74 1nat h LYS 116 Ca -0.01 0.00 -0.33 0.00 -1.87 0.00 0.00 60.65 58.45 1nat h LYS 116 Cb 1.03 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.34 1nat h LYS 116 CO 0.07 0.12 -1.64 -0.22 -0.57 0.00 0.00 179.45 177.21 1nat h LYS 117 N 0.00 0.30 0.08 3.15 3.64 -1.15 -3.20 116.57 119.39 1nat h LYS 117 Ca -0.00 -0.51 -0.35 0.00 -1.27 0.00 0.00 60.65 58.52 1nat h LYS 117 Cb 1.00 0.19 -0.03 0.00 -0.41 0.00 0.00 32.23 32.97 1nat h LYS 117 CO 0.01 1.17 -2.01 0.66 -2.27 0.00 0.00 179.45 177.02 1nat n TYR 118 N -3.49 1.00 -3.35 1.91 4.01 -0.46 -4.62 117.16 112.16 1nat n TYR 118 Ca -0.20 0.25 -0.27 0.00 -0.16 0.00 0.00 57.90 57.51 1nat n TYR 118 Cb 1.06 -1.14 -0.07 0.00 -0.31 0.00 0.00 39.34 38.87 1nat n TYR 118 CO 0.00 0.00 0.00 -0.11 -0.46 0.00 0.00 176.86 176.29 1nat n LEU 119 N -3.32 3.90 -4.67 7.72 -0.00 0.29 -5.07 117.00 115.85 1nat n LEU 119 Ca -0.30 -5.48 -0.44 0.00 -0.00 0.00 0.00 56.01 49.79 1nat n LEU 119 Cb 1.05 -0.66 -0.04 0.00 -0.00 0.00 0.00 43.42 43.77 1nat n LEU 119 CO 0.41 2.10 1.56 -2.65 -0.00 0.00 0.00 177.39 178.82 1nat n PRO 120 N 0.69 2.67 0.00 1.96 -0.02 -1.21 -4.45 135.00 134.64 1nat n PRO 120 Ca 0.30 0.98 0.13 0.00 -2.02 0.00 0.00 63.50 62.89 1nat n PRO 120 Cb 0.41 -2.90 0.30 0.00 -0.02 0.00 0.00 33.50 31.28 1nat n PRO 120 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37