#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uil n SER 2 N 0.00 0.55 0.16 1.61 2.88 -1.26 -5.07 113.62 112.50 1uil n SER 2 Ca 0.00 0.21 0.00 0.00 -1.33 0.00 0.00 58.87 57.75 1uil n SER 2 Cb 0.00 -0.07 0.00 0.00 -0.75 0.00 0.00 64.21 63.39 1uil n SER 2 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1uil n SER 3 N -3.37 -1.35 -0.26 -3.46 2.88 -1.26 -5.17 113.62 101.64 1uil n SER 3 Ca 0.00 0.56 0.01 0.00 -1.33 0.00 0.00 58.87 58.12 1uil n SER 3 Cb 0.07 1.42 -0.00 0.00 -0.75 0.00 0.00 64.21 64.94 1uil n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1uil n GLY 4 N 0.54 -1.94 1.91 0.46 0.00 -1.26 -4.98 105.19 99.91 1uil n GLY 4 Ca 0.00 -1.36 0.00 0.00 0.00 0.00 0.00 46.02 44.66 1uil n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1uil n SER 5 N -0.42 -0.01 -1.30 1.61 3.41 -1.26 -5.16 113.62 110.48 1uil n SER 5 Ca 0.00 0.08 0.00 0.00 -0.26 0.00 0.00 58.87 58.70 1uil n SER 5 Cb 0.04 0.06 0.00 0.00 -0.26 0.00 0.00 64.21 64.06 1uil n SER 5 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1uil n SER 6 N -2.68 -7.15 -1.84 4.04 7.64 -1.26 -5.03 113.62 107.34 1uil n SER 6 Ca 0.00 1.16 -0.01 0.00 1.01 0.00 0.00 58.87 61.04 1uil n SER 6 Cb 0.00 -3.83 0.03 0.00 -1.01 0.00 0.00 64.21 59.40 1uil n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1uil n GLY 7 N -1.33 -0.33 3.43 0.23 0.00 -1.26 -5.09 105.19 100.83 1uil n GLY 7 Ca 0.00 -0.04 -0.44 0.00 0.00 0.00 0.00 46.02 45.54 1uil n GLY 7 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1uil s LEU 8 N -1.05 4.90 -0.28 0.99 1.43 -1.26 -4.66 118.68 118.76 1uil s LEU 8 Ca 0.02 -1.41 0.10 0.00 -1.03 0.00 0.00 54.13 51.81 1uil s LEU 8 Cb 0.10 -2.37 0.32 0.00 0.03 0.00 0.00 46.19 44.27 1uil s LEU 8 CO -0.03 -1.24 1.32 -1.84 0.23 0.00 0.00 176.35 174.80 1uil n GLU 9 N 6.93 1.07 -1.54 1.70 0.28 -1.26 -5.07 120.64 122.74 1uil n GLU 9 Ca 0.01 -1.00 -0.17 0.00 -0.16 0.00 0.00 57.16 55.84 1uil n GLU 9 Cb 0.45 0.31 -0.13 0.00 1.43 0.00 0.00 31.44 33.50 1uil n GLU 9 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 177.13 175.84 1uil n SER 10 N -1.17 0.66 -1.88 -1.84 3.41 -1.26 -4.69 113.62 106.85 1uil n SER 10 Ca -0.14 -1.14 -0.02 0.00 -0.26 0.00 0.00 58.87 57.32 1uil n SER 10 Cb 0.80 -1.26 0.01 0.00 -0.26 0.00 0.00 64.21 63.49 1uil n SER 10 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1uil n GLU 11 N 7.66 0.30 -3.55 4.33 1.02 -1.26 -5.13 120.64 124.01 1uil n GLU 11 Ca 0.54 -0.65 -0.29 0.00 -0.02 0.00 0.00 57.16 56.74 1uil n GLU 11 Cb 0.33 0.86 -0.14 0.00 -0.02 0.00 0.00 31.44 32.47 1uil n GLU 11 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 1uil s GLU 12 N -2.02 0.51 0.00 3.49 2.12 -1.26 -5.12 118.70 116.42 1uil s GLU 12 Ca 0.09 -1.07 0.00 0.00 0.36 0.00 0.00 54.97 54.35 1uil s GLU 12 Cb -0.01 -1.45 0.00 0.00 0.26 0.00 0.00 34.13 32.93 1uil s GLU 12 CO 0.03 -1.10 0.00 1.33 -0.54 0.00 0.00 175.26 174.97 1uil n VAL 13 N 4.55 0.00 -2.61 3.70 0.24 -1.26 -4.38 118.33 118.57 1uil n VAL 13 Ca 0.03 0.00 -0.41 0.00 -2.04 0.00 0.00 64.34 61.92 1uil n VAL 13 Cb 0.39 -0.54 -0.04 0.00 -1.47 0.00 0.00 33.84 32.18 1uil n VAL 13 CO 0.00 0.00 0.00 -1.81 -2.14 0.00 0.00 176.83 172.88 1uil s ASP 14 N -0.91 7.38 0.00 -1.34 1.01 -1.21 -4.40 116.67 117.21 1uil s ASP 14 Ca 0.00 1.96 0.00 0.00 0.71 0.00 0.00 52.55 55.22 1uil s ASP 14 Cb 0.00 -2.60 0.00 0.00 1.01 0.00 0.00 42.92 41.33 1uil s ASP 14 CO 0.00 -0.14 0.00 0.18 0.21 0.00 0.00 175.17 175.42 1uil n LEU 15 N 2.50 0.00 0.06 1.23 7.99 -1.26 -4.46 117.00 123.05 1uil n LEU 15 Ca 0.02 0.00 -0.18 0.00 -0.01 0.00 0.00 56.01 55.85 1uil n LEU 15 Cb 0.47 -0.21 -0.14 0.00 -0.11 0.00 0.00 43.42 43.43 1uil n LEU 15 CO 0.52 -0.22 -0.40 0.78 -1.51 0.00 0.00 177.39 176.57 1uil h ASN 16 N 0.00 0.41 -0.83 -1.43 2.35 -2.01 -3.32 115.58 110.74 1uil h ASN 16 Ca 0.00 -0.60 0.14 0.00 -0.55 0.00 0.00 56.30 55.29 1uil h ASN 16 Cb 0.00 -0.13 -0.09 0.00 0.05 0.00 0.00 38.32 38.14 1uil h ASN 16 CO 0.00 1.50 0.42 0.00 -1.65 0.00 0.00 177.43 177.70 1uil h ALA 17 N 0.43 1.23 -0.31 -0.83 0.00 -1.95 -2.22 119.26 115.61 1uil h ALA 17 Ca -0.27 0.08 0.03 0.00 0.00 0.00 0.00 54.91 54.76 1uil h ALA 17 Cb 2.03 -0.01 -0.06 0.00 0.00 0.00 0.00 17.79 19.75 1uil h ALA 17 CO 0.16 -0.09 -0.37 0.78 0.00 0.00 0.00 179.25 179.73 1uil h GLY 18 N 0.61 -1.36 0.00 0.00 0.00 -1.78 1.43 103.07 101.97 1uil h GLY 18 Ca 0.45 0.78 0.09 0.00 0.00 0.00 0.00 47.33 48.65 1uil h GLY 18 CO -0.35 -0.34 -0.16 1.41 0.00 0.00 0.00 176.54 177.10 1uil h LEU 19 N -0.23 -0.56 0.45 3.11 -0.00 -1.59 -1.97 115.31 114.53 1uil h LEU 19 Ca 0.05 0.15 -0.01 0.00 -0.00 0.00 0.00 57.88 58.08 1uil h LEU 19 Cb 0.37 0.34 -0.03 0.00 -0.00 0.00 0.00 40.66 41.34 1uil h LEU 19 CO -0.41 -0.19 -0.52 0.45 -0.00 0.00 0.00 178.44 177.77 1uil h HIS 20 N -0.05 -1.44 0.00 1.13 3.86 -0.57 -3.49 115.15 114.59 1uil h HIS 20 Ca 0.22 0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.45 1uil h HIS 20 Cb 0.39 0.57 0.00 0.00 1.06 0.00 0.00 27.41 29.43 1uil h HIS 20 CO -0.43 -0.67 0.00 0.41 0.86 0.00 0.00 177.93 178.10 1uil n GLY 21 N -1.56 2.70 2.12 2.45 0.00 0.48 -4.93 105.19 106.44 1uil n GLY 21 Ca -0.12 -1.08 -0.21 0.00 0.00 0.00 0.00 46.02 44.62 1uil n GLY 21 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1uil n ASN 22 N 0.00 6.49 -4.54 1.61 5.15 -1.26 -4.87 115.26 117.84 1uil n ASN 22 Ca 0.00 -3.13 -0.42 0.00 -0.60 0.00 0.00 54.58 50.43 1uil n ASN 22 Cb 0.00 -1.12 -0.03 0.00 -0.53 0.00 0.00 39.78 38.10 1uil n ASN 22 CO 0.00 0.00 0.00 0.26 1.40 0.00 0.00 177.26 178.92 1uil s TRP 23 N -1.80 2.48 0.00 1.20 0.23 -1.26 -4.79 118.94 115.00 1uil s TRP 23 Ca 0.42 0.04 -0.01 0.00 -2.03 0.00 0.00 56.10 54.52 1uil s TRP 23 Cb 0.30 -4.49 -0.04 0.00 0.03 0.00 0.00 33.47 29.27 1uil s TRP 23 CO -0.08 -1.80 0.14 0.95 0.96 0.00 0.00 176.95 177.12 1uil s THR 24 N 5.10 5.12 0.31 2.01 -4.23 -1.26 -4.84 115.64 117.84 1uil s THR 24 Ca 0.35 -0.30 0.22 0.00 -1.18 0.00 0.00 61.69 60.79 1uil s THR 24 Cb -0.09 -3.38 0.34 0.00 1.34 0.00 0.00 72.50 70.71 1uil s THR 24 CO 0.18 0.32 1.15 0.18 -0.54 0.00 0.00 174.62 175.91 1uil n LEU 25 N 0.98 0.18 0.26 4.79 4.77 -1.26 0.11 117.00 126.83 1uil n LEU 25 Ca -0.11 1.07 -0.11 0.00 -0.03 0.00 0.00 56.01 56.83 1uil n LEU 25 Cb 0.52 -0.52 -0.05 0.00 -2.33 0.00 0.00 43.42 41.04 1uil n LEU 25 CO 0.42 -1.17 0.37 -0.33 -1.33 0.00 0.00 177.39 175.35 1uil h GLU 26 N 0.00 -0.66 0.03 3.23 5.08 -1.95 -1.87 114.58 118.44 1uil h GLU 26 Ca 0.64 0.05 0.01 0.00 -1.00 0.00 0.00 59.36 59.06 1uil h GLU 26 Cb 1.99 0.15 -0.04 0.00 0.50 0.00 0.00 28.75 31.35 1uil h GLU 26 CO -0.40 -0.44 -0.37 -0.91 -1.00 0.00 0.00 179.01 175.90 1uil h ASN 27 N -0.90 -1.12 -0.48 1.42 -0.26 0.48 -1.28 115.58 113.44 1uil h ASN 27 Ca -0.07 0.12 0.04 0.00 -0.56 0.00 0.00 56.30 55.83 1uil h ASN 27 Cb 0.53 0.42 -0.06 0.00 -1.06 0.00 0.00 38.32 38.15 1uil h ASN 27 CO 0.12 -0.37 -0.28 0.00 -1.06 0.00 0.00 177.43 175.83 1uil n ALA 28 N -2.80 -0.31 -0.46 -0.83 0.00 0.27 0.11 120.51 116.48 1uil n ALA 28 Ca -0.05 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.79 1uil n ALA 28 Cb 0.28 0.14 0.00 0.00 0.00 0.00 0.00 19.45 19.86 1uil n ALA 28 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1uil n LYS 29 N -4.09 0.00 -0.21 0.00 4.81 -0.70 0.47 118.16 118.44 1uil n LYS 29 Ca 0.01 0.74 -0.06 0.00 -0.87 0.00 0.00 58.31 58.13 1uil n LYS 29 Cb 0.12 -1.27 -0.06 0.00 0.02 0.00 0.00 35.03 33.85 1uil n LYS 29 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1uil h ALA 30 N -1.49 -0.35 -0.83 3.14 0.00 -0.23 0.52 119.26 120.02 1uil h ALA 30 Ca 0.00 0.06 0.08 0.00 0.00 0.00 0.00 54.91 55.05 1uil h ALA 30 Cb 0.00 1.17 -0.10 0.00 0.00 0.00 0.00 17.79 18.86 1uil h ALA 30 CO 0.00 -0.57 -0.47 -2.13 0.00 0.00 0.00 179.25 176.08 1uil n ARG 31 N -4.25 -0.35 -0.40 0.00 0.00 0.30 0.51 116.66 112.48 1uil n ARG 31 Ca 0.01 1.25 -0.08 0.00 -0.00 0.00 0.00 57.85 59.03 1uil n ARG 31 Cb 0.15 -1.85 -0.06 0.00 0.00 0.00 0.00 32.46 30.71 1uil n ARG 31 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.63 178.88 1uil h LEU 32 N 0.00 -1.95 -0.97 6.15 5.85 0.23 1.75 115.31 126.37 1uil h LEU 32 Ca 0.15 0.32 0.12 0.00 0.84 0.00 0.00 57.88 59.31 1uil h LEU 32 Cb 0.36 0.90 -0.09 0.00 0.37 0.00 0.00 40.66 42.20 1uil h LEU 32 CO -0.78 -0.25 0.59 -1.13 -0.34 0.00 0.00 178.44 176.53 1uil h ASN 33 N -0.01 0.85 -0.23 1.25 -1.24 0.61 -0.56 115.58 116.25 1uil h ASN 33 Ca 0.21 0.06 -0.01 0.00 0.71 0.00 0.00 56.30 57.27 1uil h ASN 33 Cb 0.47 -0.11 -0.01 0.00 0.73 0.00 0.00 38.32 39.40 1uil h ASN 33 CO -0.94 0.44 0.12 1.56 -1.29 0.00 0.00 177.43 177.32 1uil h GLN 34 N 0.92 0.32 -0.29 6.67 1.08 0.49 0.43 115.11 124.73 1uil h GLN 34 Ca 0.49 -0.04 0.08 0.00 -1.45 0.00 0.00 58.65 57.73 1uil h GLN 34 Cb 0.52 -0.06 -0.01 0.00 -0.05 0.00 0.00 27.48 27.88 1uil h GLN 34 CO -0.28 0.30 0.21 -0.92 -0.95 0.00 0.00 178.83 177.20 1uil h TYR 35 N 0.25 0.00 0.03 2.96 3.20 0.23 0.63 116.97 124.27 1uil h TYR 35 Ca 0.08 0.00 -0.28 0.00 3.14 0.00 0.00 58.73 61.67 1uil h TYR 35 Cb 0.08 0.00 -0.04 0.00 1.54 0.00 0.00 36.73 38.31 1uil h TYR 35 CO -0.03 0.00 -1.55 0.74 -1.64 0.00 0.00 178.16 175.67 1uil h PHE 36 N 0.00 0.12 -0.02 -3.82 0.04 -0.51 -2.41 116.94 110.34 1uil h PHE 36 Ca 0.14 -0.09 -0.19 0.00 2.80 0.00 0.00 57.97 60.63 1uil h PHE 36 Cb 0.56 -0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.70 1uil h PHE 36 CO 0.00 1.14 -0.81 1.96 -0.60 0.00 0.00 178.31 180.00 1uil h GLN 37 N 0.02 0.24 0.04 1.51 4.20 0.14 0.62 115.11 121.88 1uil h GLN 37 Ca -0.23 -0.23 -0.00 0.00 0.06 0.00 0.00 58.65 58.24 1uil h GLN 37 Cb 1.97 0.06 0.00 0.00 0.30 0.00 0.00 27.48 29.81 1uil h GLN 37 CO 0.11 0.93 -0.02 0.87 -0.67 0.00 0.00 178.83 180.04 1uil h LYS 38 N 0.15 -0.05 0.00 1.46 1.79 0.07 -3.26 116.57 116.74 1uil h LYS 38 Ca -0.04 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.44 1uil h LYS 38 Cb 1.40 0.01 0.00 0.00 -1.58 0.00 0.00 32.23 32.06 1uil h LYS 38 CO 0.13 0.55 0.00 0.93 -1.08 0.00 0.00 179.45 179.98 1uil h GLU 39 N -0.95 0.00 -0.22 3.15 4.39 -1.52 -3.46 114.58 115.98 1uil h GLU 39 Ca -0.00 0.00 -0.09 0.00 0.34 0.00 0.00 59.36 59.60 1uil h GLU 39 Cb 0.62 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 29.24 1uil h GLU 39 CO 0.01 0.00 -0.08 1.63 -1.16 0.00 0.00 179.01 179.40 1uil n LYS 40 N -2.39 -0.43 -1.79 2.33 4.76 0.15 -5.01 118.16 115.78 1uil n LYS 40 Ca 0.02 0.58 -0.30 0.00 -2.87 0.00 0.00 58.31 55.75 1uil n LYS 40 Cb 0.27 -4.26 0.06 0.00 -1.84 0.00 0.00 35.03 29.27 1uil n LYS 40 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 1uil s ILE 41 N -2.11 3.21 -0.07 -0.18 1.01 0.17 -4.95 121.20 118.28 1uil s ILE 41 Ca 0.00 0.39 0.01 0.00 0.00 0.00 0.00 60.65 61.06 1uil s ILE 41 Cb 0.00 -3.31 0.02 0.00 0.01 0.00 0.00 42.46 39.17 1uil s ILE 41 CO 0.00 -0.51 -0.10 0.00 0.00 0.00 0.00 174.94 174.33 1uil s GLN 42 N -5.32 1.49 -0.13 2.79 -2.07 -1.26 -4.48 119.66 110.68 1uil s GLN 42 Ca 0.59 -0.32 -0.10 0.00 -1.82 0.00 0.00 55.36 53.72 1uil s GLN 42 Cb -0.12 -1.33 0.04 0.00 -1.09 0.00 0.00 33.01 30.51 1uil s GLN 42 CO 0.52 -0.05 0.32 0.20 -1.32 0.00 0.00 175.29 174.96 1uil s GLY 43 N 0.93 -0.24 0.30 2.60 0.00 -1.26 -5.12 107.32 104.53 1uil s GLY 43 Ca -0.10 1.02 0.10 0.00 0.00 0.00 0.00 44.72 45.74 1uil s GLY 43 CO 0.01 1.00 -0.14 -0.54 0.00 0.00 0.00 173.10 173.43 1uil s GLU 44 N 0.55 1.68 -0.17 2.90 2.02 -1.26 -5.10 118.70 119.33 1uil s GLU 44 Ca -0.03 -1.82 -0.08 0.00 0.02 0.00 0.00 54.97 53.06 1uil s GLU 44 Cb -0.05 -1.62 -0.04 0.00 0.10 0.00 0.00 34.13 32.52 1uil s GLU 44 CO -0.03 0.22 0.12 0.71 0.02 0.00 0.00 175.26 176.29 1uil s TYR 45 N -2.64 3.43 -0.45 1.61 2.02 -1.26 -4.71 117.35 115.35 1uil s TYR 45 Ca 0.30 0.35 -0.13 0.00 -0.37 0.00 0.00 57.07 57.22 1uil s TYR 45 Cb -0.01 -2.06 0.07 0.00 -0.40 0.00 0.00 41.96 39.57 1uil s TYR 45 CO 0.14 0.42 0.34 0.21 -1.57 0.00 0.00 175.55 175.10 1uil s LYS 46 N -0.15 2.84 -0.21 -0.62 2.36 0.44 -4.91 119.74 119.49 1uil s LYS 46 Ca 0.10 -1.39 -0.19 0.00 -2.55 0.00 0.00 55.97 51.94 1uil s LYS 46 Cb -0.12 -4.00 -0.03 0.00 -1.05 0.00 0.00 37.83 32.64 1uil s LYS 46 CO 0.00 -1.00 0.56 0.71 1.55 0.00 0.00 175.35 177.18 1uil s TYR 47 N 1.56 3.36 -0.33 4.03 2.02 -1.25 -0.12 117.35 126.61 1uil s TYR 47 Ca 0.04 0.81 -0.03 0.00 -0.37 0.00 0.00 57.07 57.52 1uil s TYR 47 Cb -0.24 -2.73 0.06 0.00 -0.40 0.00 0.00 41.96 38.66 1uil s TYR 47 CO 0.05 -0.16 0.07 0.99 -1.57 0.00 0.00 175.55 174.94 1uil s THR 48 N 1.85 3.25 0.15 -0.71 2.01 0.28 -4.78 115.64 117.69 1uil s THR 48 Ca 0.25 -1.48 -0.30 0.00 0.31 0.00 0.00 61.69 60.47 1uil s THR 48 Cb -0.16 -2.95 -0.07 0.00 0.01 0.00 0.00 72.50 69.34 1uil s THR 48 CO 0.10 -0.26 1.10 -1.58 -0.69 0.00 0.00 174.62 173.29 1uil s GLN 49 N 1.26 4.57 0.01 4.92 0.74 -1.26 0.19 119.66 130.10 1uil s GLN 49 Ca -0.01 1.70 0.00 0.00 0.05 0.00 0.00 55.36 57.10 1uil s GLN 49 Cb -0.20 -3.30 -0.00 0.00 1.10 0.00 0.00 33.01 30.61 1uil s GLN 49 CO -0.01 0.03 0.01 1.33 -0.55 0.00 0.00 175.29 176.10 1uil n VAL 50 N 2.65 0.00 -1.19 1.34 0.24 0.09 -4.93 118.33 116.53 1uil n VAL 50 Ca 0.04 -0.08 0.15 0.00 -2.04 0.00 0.00 64.34 62.41 1uil n VAL 50 Cb 0.46 0.04 -0.04 0.00 -1.47 0.00 0.00 33.84 32.83 1uil n VAL 50 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1uil n GLY 51 N -0.02 -1.70 3.81 7.63 0.00 -1.26 -2.67 105.19 110.98 1uil n GLY 51 Ca 0.00 -0.88 -0.31 0.00 0.00 0.00 0.00 46.02 44.84 1uil n GLY 51 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1uil s PRO 52 N -2.43 2.55 0.08 1.61 0.04 -1.10 -4.68 135.00 131.07 1uil s PRO 52 Ca 0.00 0.81 -0.31 0.00 0.04 0.00 0.00 61.00 61.53 1uil s PRO 52 Cb 0.00 -1.96 -0.16 0.00 0.04 0.00 0.00 34.50 32.42 1uil s PRO 52 CO 0.00 -1.34 1.63 0.22 0.04 0.00 0.00 177.00 177.56 1uil h ASP 53 N -0.89 -0.76 -1.48 6.66 1.82 -1.97 0.49 116.42 120.29 1uil h ASP 53 Ca -0.45 0.05 0.45 0.00 -0.39 0.00 0.00 57.03 56.69 1uil h ASP 53 Cb 1.24 0.22 -0.10 0.00 0.68 0.00 0.00 39.33 41.37 1uil h ASP 53 CO 0.58 -0.48 1.01 1.12 -1.61 0.00 0.00 179.24 179.86 1uil h HIS 54 N -0.75 0.31 -1.66 0.28 2.07 -1.99 -3.10 115.15 110.30 1uil h HIS 54 Ca -0.06 0.01 -0.30 0.00 -2.85 0.00 0.00 60.37 57.17 1uil h HIS 54 Cb 0.62 -0.08 -0.27 0.00 2.57 0.00 0.00 27.41 30.25 1uil h HIS 54 CO -0.10 -0.10 -0.65 1.21 -3.07 0.00 0.00 177.93 175.22 1uil s ASN 55 N -4.45 0.23 0.46 3.10 3.84 -0.49 -5.14 114.94 112.49 1uil s ASN 55 Ca -0.07 -1.68 0.06 0.00 0.21 0.00 0.00 52.86 51.38 1uil s ASN 55 Cb 0.28 0.92 -0.02 0.00 -0.55 0.00 0.00 41.25 41.88 1uil s ASN 55 CO 0.84 -0.19 0.20 0.00 -2.79 0.00 0.00 177.10 175.16 1uil s ARG 56 N 1.20 2.22 -0.21 0.43 1.70 0.16 -2.73 118.95 121.73 1uil s ARG 56 Ca 0.21 -1.99 -0.16 0.00 -0.47 0.00 0.00 55.73 53.33 1uil s ARG 56 Cb -0.08 -1.92 0.06 0.00 -0.57 0.00 0.00 34.95 32.44 1uil s ARG 56 CO -0.06 -0.28 0.54 -1.12 -1.08 0.00 0.00 175.30 173.30 1uil s SER 57 N -3.99 -0.64 -0.38 -2.89 0.01 -1.09 -4.97 113.70 99.76 1uil s SER 57 Ca 0.33 1.14 -0.17 0.00 1.31 0.00 0.00 55.95 58.56 1uil s SER 57 Cb 0.02 1.09 0.00 0.00 0.21 0.00 0.00 66.02 67.34 1uil s SER 57 CO 0.19 -0.20 0.44 -0.36 0.41 0.00 0.00 173.24 173.71 1uil s PHE 58 N 0.89 3.18 -0.59 2.43 0.40 -1.26 -0.73 117.98 122.30 1uil s PHE 58 Ca -0.05 -0.11 -0.28 0.00 -0.60 0.00 0.00 56.93 55.90 1uil s PHE 58 Cb -0.05 -2.84 0.02 0.00 0.51 0.00 0.00 43.02 40.66 1uil s PHE 58 CO -0.07 -0.57 1.34 0.42 0.70 0.00 0.00 175.22 177.03 1uil s ILE 59 N 2.18 3.83 -0.45 0.64 1.01 0.50 -3.97 121.20 124.94 1uil s ILE 59 Ca 0.14 0.69 -0.23 0.00 0.00 0.00 0.00 60.65 61.25 1uil s ILE 59 Cb -0.16 -4.58 0.03 0.00 0.01 0.00 0.00 42.46 37.75 1uil s ILE 59 CO 0.13 -1.32 0.76 0.00 0.00 0.00 0.00 174.94 174.51 1uil s ALA 60 N 5.77 3.30 -0.03 9.38 0.00 -0.71 0.99 121.76 140.46 1uil s ALA 60 Ca 0.47 -1.05 0.07 0.00 0.00 0.00 0.00 51.96 51.45 1uil s ALA 60 Cb -0.09 -3.44 -0.02 0.00 0.00 0.00 0.00 23.12 19.56 1uil s ALA 60 CO 0.23 -1.91 -0.23 -1.83 0.00 0.00 0.00 175.76 172.03 1uil s GLU 61 N 3.21 2.23 -0.09 0.00 -1.05 0.82 -2.29 118.70 121.53 1uil s GLU 61 Ca 0.28 -0.87 -0.06 0.00 -0.15 0.00 0.00 54.97 54.18 1uil s GLU 61 Cb -0.13 -2.13 0.03 0.00 -0.44 0.00 0.00 34.13 31.47 1uil s GLU 61 CO 0.22 0.57 0.22 1.41 0.95 0.00 0.00 175.26 178.63 1uil s MET 62 N -0.63 0.21 -0.05 -4.83 1.75 -0.53 -0.42 119.30 114.80 1uil s MET 62 Ca 0.10 0.40 0.06 0.00 -1.25 0.00 0.00 55.69 55.00 1uil s MET 62 Cb -0.10 -0.02 -0.01 0.00 2.84 0.00 0.00 34.83 37.53 1uil s MET 62 CO -0.00 -0.10 -0.24 0.99 -0.65 0.00 0.00 175.02 175.01 1uil s THR 63 N 0.74 1.95 0.09 10.11 2.01 -1.26 -0.74 115.64 128.53 1uil s THR 63 Ca -0.05 -1.02 0.02 0.00 0.31 0.00 0.00 61.69 60.95 1uil s THR 63 Cb -0.07 -1.65 -0.04 0.00 0.01 0.00 0.00 72.50 70.76 1uil s THR 63 CO -0.04 0.55 -0.07 0.27 -0.69 0.00 0.00 174.62 174.64 1uil s ILE 64 N -0.20 0.65 -0.03 1.82 -4.36 -0.10 -4.95 121.20 114.03 1uil s ILE 64 Ca -0.02 -1.76 0.07 0.00 -0.26 0.00 0.00 60.65 58.69 1uil s ILE 64 Cb -0.13 -1.46 -0.02 0.00 1.25 0.00 0.00 42.46 42.11 1uil s ILE 64 CO 0.03 -0.78 -0.25 -0.47 0.24 0.00 0.00 174.94 173.71 1uil s TYR 65 N -3.17 2.28 -0.18 1.37 6.14 -1.26 -0.00 117.35 122.53 1uil s TYR 65 Ca 0.07 -0.48 -0.02 0.00 0.64 0.00 0.00 57.07 57.28 1uil s TYR 65 Cb 0.02 -1.47 -0.01 0.00 0.42 0.00 0.00 41.96 40.92 1uil s TYR 65 CO -0.04 -0.07 -0.09 0.42 0.64 0.00 0.00 175.55 176.41 1uil s ILE 66 N -0.51 3.19 0.02 3.14 -1.09 0.20 -4.95 121.20 121.20 1uil s ILE 66 Ca 0.07 -0.58 0.11 0.00 -2.23 0.00 0.00 60.65 58.02 1uil s ILE 66 Cb -0.10 -2.40 -0.19 0.00 -1.58 0.00 0.00 42.46 38.18 1uil s ILE 66 CO -0.00 0.48 1.01 0.07 -1.23 0.00 0.00 174.94 175.27 1uil h LYS 67 N 7.42 0.00 0.00 2.79 -0.00 -1.95 -0.94 116.57 123.88 1uil h LYS 67 Ca -0.35 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.30 1uil h LYS 67 Cb 1.18 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.41 1uil h LYS 67 CO 0.59 0.71 0.00 0.00 -0.00 0.00 0.00 179.45 180.75 1uil n GLN 68 N -3.18 0.08 -0.02 0.07 10.64 -1.26 -2.70 117.38 121.01 1uil n GLN 68 Ca -0.07 0.23 -0.03 0.00 -1.83 0.00 0.00 57.00 55.30 1uil n GLN 68 Cb 0.96 -1.50 -0.02 0.00 -0.86 0.00 0.00 30.24 28.82 1uil n GLN 68 CO 0.00 0.00 0.00 1.28 -1.83 0.00 0.00 177.06 176.51 1uil n LEU 69 N -1.40 2.02 0.00 2.61 4.77 -1.21 -5.03 117.00 118.77 1uil n LEU 69 Ca 0.04 -0.02 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 1uil n LEU 69 Cb 0.12 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 1uil n LEU 69 CO 0.11 0.41 0.00 0.61 -1.33 0.00 0.00 177.39 177.19 1uil n GLY 70 N 3.13 0.94 0.41 -0.72 0.00 -0.42 -5.06 105.19 103.48 1uil n GLY 70 Ca -0.07 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 45.93 1uil n GLY 70 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1uil n ARG 71 N -2.12 0.06 -4.10 1.61 1.85 -0.85 -5.00 116.66 108.11 1uil n ARG 71 Ca 0.00 -0.42 -0.09 0.00 -1.00 0.00 0.00 57.85 56.35 1uil n ARG 71 Cb 0.00 0.35 -0.10 0.00 -1.05 0.00 0.00 32.46 31.66 1uil n ARG 71 CO 0.00 0.00 0.00 -0.98 -0.01 0.00 0.00 177.63 176.64 1uil s ARG 72 N -2.16 0.64 0.03 2.89 1.70 -1.26 0.60 118.95 121.38 1uil s ARG 72 Ca 0.05 -1.16 0.08 0.00 -0.47 0.00 0.00 55.73 54.23 1uil s ARG 72 Cb 0.00 0.04 -0.02 0.00 -0.57 0.00 0.00 34.95 34.40 1uil s ARG 72 CO 0.03 -0.07 -0.22 0.96 -1.08 0.00 0.00 175.30 174.93 1uil s ILE 73 N -3.39 1.77 0.15 4.99 -4.36 1.00 -4.94 121.20 116.42 1uil s ILE 73 Ca 0.05 -1.18 0.11 0.00 -0.26 0.00 0.00 60.65 59.36 1uil s ILE 73 Cb 0.04 -1.52 -0.04 0.00 1.25 0.00 0.00 42.46 42.19 1uil s ILE 73 CO -0.07 0.29 -0.25 0.12 0.24 0.00 0.00 174.94 175.27 1uil s PHE 74 N -0.74 2.26 0.05 1.37 2.19 -1.26 -0.92 117.98 120.92 1uil s PHE 74 Ca 0.08 -0.38 0.00 0.00 0.33 0.00 0.00 56.93 56.97 1uil s PHE 74 Cb -0.09 -1.18 -0.03 0.00 -1.31 0.00 0.00 43.02 40.41 1uil s PHE 74 CO 0.01 0.39 -0.05 0.00 1.83 0.00 0.00 175.22 177.41 1uil s ALA 75 N -1.33 0.49 -0.30 11.12 0.00 0.08 -4.91 121.76 126.91 1uil s ALA 75 Ca 0.16 -0.96 -0.07 0.00 0.00 0.00 0.00 51.96 51.09 1uil s ALA 75 Cb -0.09 0.17 0.19 0.00 0.00 0.00 0.00 23.12 23.39 1uil s ALA 75 CO 0.07 -0.21 0.95 0.50 0.00 0.00 0.00 175.76 177.07 1uil s ARG 76 N -2.72 0.25 0.50 0.00 3.00 -1.26 -1.46 118.95 117.26 1uil s ARG 76 Ca -0.02 0.17 0.05 0.00 -1.00 0.00 0.00 55.73 54.93 1uil s ARG 76 Cb -0.01 0.09 -0.00 0.00 0.00 0.00 0.00 34.95 35.03 1uil s ARG 76 CO -0.04 -0.44 0.22 -1.21 0.00 0.00 0.00 175.30 173.83 1uil s GLU 77 N 2.78 2.23 -0.51 5.12 0.41 -0.97 -4.96 118.70 122.80 1uil s GLU 77 Ca 0.23 -2.08 0.07 0.00 -0.41 0.00 0.00 54.97 52.78 1uil s GLU 77 Cb -0.03 -1.90 0.33 0.00 -1.78 0.00 0.00 34.13 30.75 1uil s GLU 77 CO -0.22 -0.40 0.83 -2.39 -0.49 0.00 0.00 175.26 172.58 1uil n HIS 78 N -1.47 2.52 0.00 1.61 1.44 -1.26 -1.74 115.22 116.31 1uil n HIS 78 Ca -0.07 -3.93 0.00 0.00 -2.01 0.00 0.00 57.72 51.71 1uil n HIS 78 Cb 0.65 -0.47 0.00 0.00 0.12 0.00 0.00 29.99 30.29 1uil n HIS 78 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1uil n GLY 79 N 0.16 -2.85 0.10 -1.39 0.00 -1.25 -4.87 105.19 95.08 1uil n GLY 79 Ca 0.28 -0.94 -0.21 0.00 0.00 0.00 0.00 46.02 45.15 1uil n GLY 79 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1uil n SER 80 N -1.95 1.86 -4.35 1.61 7.64 -1.26 -4.33 113.62 112.85 1uil n SER 80 Ca 0.00 0.43 -0.22 0.00 1.01 0.00 0.00 58.87 60.10 1uil n SER 80 Cb 0.00 -0.96 -0.10 0.00 -1.01 0.00 0.00 64.21 62.14 1uil n SER 80 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 1uil s ASN 81 N -6.81 2.26 0.27 6.43 0.01 -1.26 -4.38 114.94 111.46 1uil s ASN 81 Ca -0.28 -1.45 -0.00 0.00 -0.71 0.00 0.00 52.86 50.41 1uil s ASN 81 Cb 0.06 0.10 0.63 0.00 0.41 0.00 0.00 41.25 42.45 1uil s ASN 81 CO 0.57 -0.71 1.66 0.11 -1.51 0.00 0.00 177.10 177.21 1uil h LYS 82 N 2.08 0.22 0.00 -0.60 1.57 -1.95 0.44 116.57 118.33 1uil h LYS 82 Ca -0.39 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 58.38 1uil h LYS 82 Cb 1.25 -0.05 0.00 0.00 0.08 0.00 0.00 32.23 33.51 1uil h LYS 82 CO 0.65 0.15 0.00 1.17 -0.57 0.00 0.00 179.45 180.85 1uil n LYS 83 N -5.21 0.00 0.00 3.15 0.00 -1.26 0.19 118.16 115.03 1uil n LYS 83 Ca 0.19 0.50 0.00 0.00 0.00 0.00 0.00 58.31 59.00 1uil n LYS 83 Cb 0.61 -1.39 0.00 0.00 0.00 0.00 0.00 35.03 34.25 1uil n LYS 83 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.40 178.68 1uil n LEU 84 N -1.86 0.00 -0.27 3.14 7.99 -0.82 0.77 117.00 125.95 1uil n LEU 84 Ca 0.00 0.93 -0.01 0.00 -0.01 0.00 0.00 56.01 56.92 1uil n LEU 84 Cb 0.00 -0.43 0.03 0.00 -0.11 0.00 0.00 43.42 42.91 1uil n LEU 84 CO 0.00 -0.43 0.41 0.00 -1.51 0.00 0.00 177.39 175.87 1uil n ALA 85 N -2.41 -0.09 0.09 -1.18 0.00 0.15 0.20 120.51 117.27 1uil n ALA 85 Ca 0.00 0.71 -0.12 0.00 0.00 0.00 0.00 53.44 54.02 1uil n ALA 85 Cb 0.00 -0.31 -0.05 0.00 0.00 0.00 0.00 19.45 19.09 1uil n ALA 85 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1uil h ALA 86 N 0.97 -0.39 -0.03 0.00 0.00 0.10 -1.27 119.26 118.64 1uil h ALA 86 Ca 0.24 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.13 1uil h ALA 86 Cb 0.42 0.41 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 1uil h ALA 86 CO -0.70 -0.77 -0.05 1.96 0.00 0.00 0.00 179.25 179.68 1uil h GLN 87 N -0.43 -0.04 -0.96 0.00 4.20 0.85 0.27 115.11 119.00 1uil h GLN 87 Ca 0.04 0.00 0.15 0.00 0.06 0.00 0.00 58.65 58.91 1uil h GLN 87 Cb 0.48 0.01 -0.16 0.00 0.30 0.00 0.00 27.48 28.11 1uil h GLN 87 CO -0.17 -0.03 -0.36 0.43 -0.67 0.00 0.00 178.83 178.04 1uil n SER 88 N -2.91 -0.59 -0.07 1.46 7.64 0.15 0.06 113.62 119.36 1uil n SER 88 Ca -0.00 1.67 -0.10 0.00 1.01 0.00 0.00 58.87 61.44 1uil n SER 88 Cb 0.03 -0.40 -0.07 0.00 -1.01 0.00 0.00 64.21 62.76 1uil n SER 88 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1uil h ALA 90 N -0.46 -0.43 -1.59 0.00 0.00 0.17 0.36 119.26 117.31 1uil h ALA 90 Ca 0.04 -0.00 0.50 0.00 0.00 0.00 0.00 54.91 55.45 1uil h ALA 90 Cb 0.46 0.65 -0.11 0.00 0.00 0.00 0.00 17.79 18.78 1uil h ALA 90 CO -0.40 -0.45 1.08 1.25 0.00 0.00 0.00 179.25 180.74 1uil h LEU 91 N -0.04 0.13 0.21 0.00 5.85 -0.33 1.30 115.31 122.42 1uil h LEU 91 Ca 0.00 0.09 -0.01 0.00 0.84 0.00 0.00 57.88 58.81 1uil h LEU 91 Cb 0.05 0.09 -0.00 0.00 0.37 0.00 0.00 40.66 41.17 1uil h LEU 91 CO -0.04 -0.14 -0.13 -1.28 -0.34 0.00 0.00 178.44 176.51 1uil h SER 92 N 0.02 -0.33 -0.18 1.25 0.87 0.48 0.52 113.55 116.18 1uil h SER 92 Ca 0.88 0.02 -0.04 0.00 -1.23 0.00 0.00 61.79 61.43 1uil h SER 92 Cb 3.12 0.10 -0.01 0.00 -0.44 0.00 0.00 62.40 65.18 1uil h SER 92 CO -0.27 -0.22 -0.03 -0.07 -0.53 0.00 0.00 176.83 175.72 1uil h LEU 93 N -0.33 0.34 -0.04 2.23 -0.00 0.24 -2.71 115.31 115.04 1uil h LEU 93 Ca -0.02 -0.35 0.04 0.00 -0.00 0.00 0.00 57.88 57.55 1uil h LEU 93 Cb 0.28 -0.09 -0.06 0.00 -0.00 0.00 0.00 40.66 40.79 1uil h LEU 93 CO 0.02 0.61 -0.37 0.58 -0.00 0.00 0.00 178.44 179.27 1uil h VAL 94 N 0.07 0.22 -0.34 1.22 2.07 -0.57 0.15 116.25 119.07 1uil h VAL 94 Ca 0.05 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.61 1uil h VAL 94 Cb 0.45 0.22 -0.06 0.00 -1.52 0.00 0.00 31.29 30.38 1uil h VAL 94 CO 0.01 0.00 -0.40 -0.09 0.02 0.00 0.00 177.57 177.12 1uil h ARG 95 N -0.50 -0.24 -0.33 1.57 2.43 0.08 0.18 114.38 117.58 1uil h ARG 95 Ca 0.07 0.02 0.07 0.00 -0.81 0.00 0.00 59.98 59.32 1uil h ARG 95 Cb 0.60 0.05 -0.08 0.00 -0.42 0.00 0.00 29.97 30.12 1uil h ARG 95 CO -0.32 -0.16 -0.39 1.96 -1.51 0.00 0.00 179.97 179.55 1uil h GLN 96 N -0.24 -0.33 -0.26 0.20 7.50 -1.13 -0.95 115.11 119.90 1uil h GLN 96 Ca 0.06 0.02 0.03 0.00 0.50 0.00 0.00 58.65 59.26 1uil h GLN 96 Cb 0.40 0.08 -0.04 0.00 0.05 0.00 0.00 27.48 27.96 1uil h GLN 96 CO -0.45 -0.22 -0.28 -0.07 -1.50 0.00 0.00 178.83 176.31 1uil h LEU 97 N -0.34 -0.95 -1.68 1.46 3.38 0.38 0.75 115.31 118.30 1uil h LEU 97 Ca 0.13 0.13 0.42 0.00 0.09 0.00 0.00 57.88 58.65 1uil h LEU 97 Cb 0.58 0.39 -0.09 0.00 0.09 0.00 0.00 40.66 41.63 1uil h LEU 97 CO -0.51 -0.18 0.95 0.22 0.09 0.00 0.00 178.44 179.01 1uil h TYR 98 N -0.16 0.29 0.36 1.13 3.20 -0.06 0.25 116.97 121.98 1uil h TYR 98 Ca 0.04 0.01 -0.02 0.00 3.14 0.00 0.00 58.73 61.91 1uil h TYR 98 Cb 0.28 -0.08 0.00 0.00 1.54 0.00 0.00 36.73 38.47 1uil h TYR 98 CO -0.72 -0.07 -0.17 1.12 -1.64 0.00 0.00 178.16 176.68 1uil h HIS 99 N 0.09 -0.44 -0.60 -3.82 2.07 0.16 -3.31 115.15 109.30 1uil h HIS 99 Ca 0.75 -0.01 0.11 0.00 -2.85 0.00 0.00 60.37 58.37 1uil h HIS 99 Cb 2.60 0.15 -0.12 0.00 2.57 0.00 0.00 27.41 32.61 1uil h HIS 99 CO -0.00 -0.28 -0.26 -0.07 -3.07 0.00 0.00 177.93 174.25 1uil h LEU 100 N -0.98 -0.92 0.00 6.12 3.38 0.19 -3.45 115.31 119.64 1uil h LEU 100 Ca -0.05 0.21 0.00 0.00 0.09 0.00 0.00 57.88 58.13 1uil h LEU 100 Cb 0.37 0.50 0.00 0.00 0.09 0.00 0.00 40.66 41.62 1uil h LEU 100 CO 0.08 -0.27 0.00 0.61 0.09 0.00 0.00 178.44 178.95 1uil n GLY 101 N -1.44 0.75 0.21 0.83 0.00 0.65 -5.09 105.19 101.10 1uil n GLY 101 Ca 0.06 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.98 1uil n GLY 101 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1uil n VAL 102 N 0.00 1.46 -2.06 1.61 0.24 -1.07 -5.03 118.33 113.48 1uil n VAL 102 Ca 0.00 0.14 -0.01 0.00 -2.04 0.00 0.00 64.34 62.43 1uil n VAL 102 Cb 0.00 -2.23 0.01 0.00 -1.47 0.00 0.00 33.84 30.15 1uil n VAL 102 CO 0.00 0.00 0.00 2.30 -2.14 0.00 0.00 176.83 176.99 1uil n ILE 103 N -4.33 0.00 -4.18 1.34 -5.35 -1.26 -5.00 119.36 100.58 1uil n ILE 103 Ca -0.15 -0.07 -0.16 0.00 -0.27 0.00 0.00 62.75 62.10 1uil n ILE 103 Cb 0.48 -1.46 -0.14 0.00 -1.74 0.00 0.00 39.64 36.79 1uil n ILE 103 CO 0.00 0.00 0.00 -1.83 -1.76 0.00 0.00 176.55 172.96 1uil s GLU 104 N -2.61 0.49 0.27 6.28 1.03 -1.26 -4.76 118.70 118.15 1uil s GLU 104 Ca 0.03 -0.31 -0.27 0.00 0.03 0.00 0.00 54.97 54.45 1uil s GLU 104 Cb -0.00 -0.44 -0.16 0.00 -0.80 0.00 0.00 34.13 32.73 1uil s GLU 104 CO 0.02 0.12 0.57 0.00 -1.33 0.00 0.00 175.26 174.64 1uil n ALA 105 N 2.67 -2.20 -1.00 -0.84 0.00 -1.26 -4.93 120.51 112.95 1uil n ALA 105 Ca -0.15 0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.65 1uil n ALA 105 Cb 0.57 -1.69 0.00 0.00 0.00 0.00 0.00 19.45 18.33 1uil n ALA 105 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 1uil n TYR 106 N -0.18 -1.49 0.00 0.00 9.36 -1.26 -4.97 117.16 118.62 1uil n TYR 106 Ca 0.15 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.37 1uil n TYR 106 Cb 0.30 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.01 1uil n TYR 106 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 1uil n SER 107 N -1.35 0.00 -1.53 2.98 2.88 -1.26 -4.78 113.62 110.57 1uil n SER 107 Ca 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.54 1uil n SER 107 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 1uil n SER 107 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1uil n SER 108 N 0.00 -8.26 -3.17 -3.46 2.88 -1.26 -4.58 113.62 95.76 1uil n SER 108 Ca 0.00 1.38 0.00 0.00 -1.33 0.00 0.00 58.87 58.92 1uil n SER 108 Cb 0.00 -4.67 0.00 0.00 -0.75 0.00 0.00 64.21 58.79 1uil n SER 108 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1uil n GLY 109 N -1.39 0.17 3.41 0.46 0.00 -1.26 -3.28 105.19 103.30 1uil n GLY 109 Ca 0.00 -1.41 -0.37 0.00 0.00 0.00 0.00 46.02 44.23 1uil n GLY 109 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1uil n PRO 110 N 0.00 2.34 -3.89 1.61 -0.04 -1.26 -4.37 135.00 129.40 1uil n PRO 110 Ca 0.00 -2.71 -0.09 0.00 -0.04 0.00 0.00 63.50 60.66 1uil n PRO 110 Cb 0.00 -3.48 -0.07 0.00 -0.04 0.00 0.00 33.50 29.91 1uil n PRO 110 CO 0.00 0.00 0.00 -1.12 -0.04 0.00 0.00 175.50 174.34 1uil s SER 111 N 5.03 0.04 -0.07 3.54 0.01 -1.26 -5.09 113.70 115.90 1uil s SER 111 Ca 0.59 -0.73 -0.09 0.00 1.31 0.00 0.00 55.95 57.03 1uil s SER 111 Cb 0.05 0.40 -0.04 0.00 0.21 0.00 0.00 66.02 66.65 1uil s SER 111 CO 0.09 -0.83 -0.19 -0.24 0.41 0.00 0.00 173.24 172.48 1uil n SER 112 N -0.16 1.46 0.00 2.44 2.88 -1.26 -5.01 113.62 113.97 1uil n SER 112 Ca -0.11 0.23 0.00 0.00 -1.33 0.00 0.00 58.87 57.66 1uil n SER 112 Cb 0.63 -0.53 0.00 0.00 -0.75 0.00 0.00 64.21 63.56 1uil n SER 112 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42