#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uil s SER 2 N 0.00 3.34 -0.09 1.61 1.04 -1.26 -5.06 113.70 113.27 1uil s SER 2 Ca 0.00 -0.81 -0.09 0.00 0.48 0.00 0.00 55.95 55.53 1uil s SER 2 Cb 0.00 -0.23 -0.07 0.00 0.10 0.00 0.00 66.02 65.82 1uil s SER 2 CO 0.00 0.14 0.31 -1.28 0.98 0.00 0.00 173.24 173.40 1uil h SER 3 N 3.56 -0.09 0.00 7.02 0.87 -2.12 -3.47 113.55 119.31 1uil h SER 3 Ca -0.49 -0.19 0.00 0.00 -1.23 0.00 0.00 61.79 59.88 1uil h SER 3 Cb 1.19 0.02 0.00 0.00 -0.44 0.00 0.00 62.40 63.17 1uil h SER 3 CO 0.43 0.48 0.00 0.61 -0.53 0.00 0.00 176.83 177.83 1uil n GLY 4 N 1.41 2.22 3.53 5.77 0.00 -1.26 -4.95 105.19 111.91 1uil n GLY 4 Ca -0.03 -0.15 -0.42 0.00 0.00 0.00 0.00 46.02 45.42 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 4.31 0.16 -4.38 1.61 3.41 -1.26 -4.98 113.62 112.49 1uil n SER 5 Ca 0.00 0.97 -0.32 0.00 -0.26 0.00 0.00 58.87 59.26 1uil n SER 5 Cb 0.00 -1.23 -0.15 0.00 -0.26 0.00 0.00 64.21 62.57 1uil n SER 5 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1uil s SER 6 N -0.87 3.48 0.00 4.04 0.01 -1.26 -5.13 113.70 113.97 1uil s SER 6 Ca 0.64 -0.35 0.00 0.00 1.31 0.00 0.00 55.95 57.54 1uil s SER 6 Cb -0.59 -0.61 0.00 0.00 0.21 0.00 0.00 66.02 65.03 1uil s SER 6 CO 0.57 0.32 0.00 0.61 0.41 0.00 0.00 173.24 175.15 1uil n GLY 7 N 2.44 1.41 1.03 3.44 0.00 -1.26 -5.04 105.19 107.21 1uil n GLY 7 Ca -0.17 -1.69 0.11 0.00 0.00 0.00 0.00 46.02 44.27 1uil n GLY 7 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1uil n LEU 8 N 0.00 -0.78 -3.25 0.99 4.77 -1.26 -5.02 117.00 112.45 1uil n LEU 8 Ca 0.00 1.76 0.03 0.00 -0.03 0.00 0.00 56.01 57.77 1uil n LEU 8 Cb 0.00 -2.13 -0.02 0.00 -2.33 0.00 0.00 43.42 38.94 1uil n LEU 8 CO 0.00 -1.43 0.31 -1.83 -1.33 0.00 0.00 177.39 173.12 1uil s GLU 9 N -4.04 0.46 -0.94 3.23 -1.05 -1.26 -5.09 118.70 110.01 1uil s GLU 9 Ca 0.00 0.91 -0.24 0.00 -0.15 0.00 0.00 54.97 55.49 1uil s GLU 9 Cb 0.00 0.52 0.00 0.00 -0.44 0.00 0.00 34.13 34.21 1uil s GLU 9 CO 0.00 -0.41 1.69 -1.12 0.95 0.00 0.00 175.26 176.37 1uil s SER 10 N 2.85 5.81 -0.45 0.83 0.01 -1.26 -4.79 113.70 116.70 1uil s SER 10 Ca 0.10 -0.99 0.06 0.00 1.31 0.00 0.00 55.95 56.42 1uil s SER 10 Cb -0.13 -2.56 0.19 0.00 0.21 0.00 0.00 66.02 63.73 1uil s SER 10 CO -0.18 -2.13 0.53 -0.62 0.41 0.00 0.00 173.24 171.25 1uil n GLU 11 N 8.90 0.41 0.00 12.44 -0.58 -1.26 -5.11 120.64 135.44 1uil n GLU 11 Ca 0.35 -2.71 0.00 0.00 -0.42 0.00 0.00 57.16 54.37 1uil n GLU 11 Cb 0.49 -1.53 0.00 0.00 -0.57 0.00 0.00 31.44 29.83 1uil n GLU 11 CO 0.00 0.00 0.00 -1.91 -0.48 0.00 0.00 177.13 174.74 1uil n GLU 12 N 2.59 2.55 -3.78 3.49 4.07 -1.26 -5.18 120.64 123.12 1uil n GLU 12 Ca 0.23 0.00 -0.10 0.00 -0.06 0.00 0.00 57.16 57.24 1uil n GLU 12 Cb 0.52 0.00 -0.07 0.00 -0.06 0.00 0.00 31.44 31.84 1uil n GLU 12 CO 0.00 0.00 0.00 0.54 -0.06 0.00 0.00 177.13 177.61 1uil s VAL 13 N 2.58 0.11 -0.18 6.31 0.11 -1.26 -5.08 120.40 122.99 1uil s VAL 13 Ca 0.00 -0.91 -0.18 0.00 -2.93 0.00 0.00 61.98 57.96 1uil s VAL 13 Cb 0.00 -1.20 -0.14 0.00 -1.53 0.00 0.00 36.38 33.51 1uil s VAL 13 CO 0.00 -0.51 0.13 0.44 -3.33 0.00 0.00 175.10 171.83 1uil h ASP 14 N 2.77 0.00 0.00 3.54 3.32 -2.03 -3.45 116.42 120.57 1uil h ASP 14 Ca -0.33 -0.38 0.00 0.00 0.02 0.00 0.00 57.03 56.34 1uil h ASP 14 Cb 1.21 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.76 1uil h ASP 14 CO 0.51 1.23 0.00 -0.11 -1.72 0.00 0.00 179.24 179.16 1uil n LEU 15 N -4.50 0.00 0.03 1.55 -0.00 -1.26 -3.14 117.00 109.67 1uil n LEU 15 Ca -0.23 0.00 0.07 0.00 -0.00 0.00 0.00 56.01 55.84 1uil n LEU 15 Cb 0.53 0.00 0.29 0.00 -0.00 0.00 0.00 43.42 44.24 1uil n LEU 15 CO 0.17 -0.09 0.71 -0.46 -0.00 0.00 0.00 177.39 177.72 1uil n ASN 16 N -0.51 0.13 -0.28 1.96 6.94 -1.26 -3.10 115.26 119.14 1uil n ASN 16 Ca 0.00 0.54 0.00 0.00 -0.02 0.00 0.00 54.58 55.10 1uil n ASN 16 Cb 0.00 -0.56 0.07 0.00 -2.36 0.00 0.00 39.78 36.93 1uil n ASN 16 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1uil h ALA 17 N 2.34 0.35 -0.19 -2.53 0.00 -1.96 0.14 119.26 117.41 1uil h ALA 17 Ca 0.00 0.28 0.05 0.00 0.00 0.00 0.00 54.91 55.24 1uil h ALA 17 Cb 0.21 0.72 -0.07 0.00 0.00 0.00 0.00 17.79 18.65 1uil h ALA 17 CO 0.00 -0.50 -0.34 0.78 0.00 0.00 0.00 179.25 179.19 1uil h GLY 18 N -0.04 -0.45 -0.73 0.00 0.00 -1.74 -1.82 103.07 98.29 1uil h GLY 18 Ca 0.35 0.43 0.10 0.00 0.00 0.00 0.00 47.33 48.20 1uil h GLY 18 CO -0.83 -0.22 -0.47 1.41 0.00 0.00 0.00 176.54 176.43 1uil h LEU 19 N -0.38 -1.68 -0.06 3.11 4.07 -0.97 -1.48 115.31 117.91 1uil h LEU 19 Ca 0.11 0.28 0.01 0.00 0.08 0.00 0.00 57.88 58.36 1uil h LEU 19 Cb 0.56 0.78 -0.01 0.00 1.08 0.00 0.00 40.66 43.07 1uil h LEU 19 CO -0.40 -0.30 -0.05 0.45 -1.08 0.00 0.00 178.44 177.05 1uil h HIS 20 N -0.13 -0.17 0.00 1.13 3.86 -0.69 -3.48 115.15 115.67 1uil h HIS 20 Ca 0.20 0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.42 1uil h HIS 20 Cb 0.54 0.08 0.00 0.00 1.06 0.00 0.00 27.41 29.09 1uil h HIS 20 CO -0.83 -0.04 0.00 0.41 0.86 0.00 0.00 177.93 178.33 1uil n GLY 21 N -1.03 2.78 2.80 2.45 0.00 -0.56 -4.99 105.19 106.65 1uil n GLY 21 Ca -0.00 -0.86 -0.42 0.00 0.00 0.00 0.00 46.02 44.73 1uil n GLY 21 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1uil n ASN 22 N 0.00 5.45 -4.18 1.61 3.02 -1.26 -4.88 115.26 115.02 1uil n ASN 22 Ca 0.00 -3.10 -0.40 0.00 -0.03 0.00 0.00 54.58 51.05 1uil n ASN 22 Cb 0.00 -1.47 -0.08 0.00 -0.61 0.00 0.00 39.78 37.62 1uil n ASN 22 CO 0.00 0.00 0.00 0.26 -2.62 0.00 0.00 177.26 174.90 1uil s TRP 23 N 0.27 3.49 0.22 3.10 0.23 -1.26 -4.39 118.94 120.60 1uil s TRP 23 Ca 0.42 -2.22 -0.10 0.00 -2.03 0.00 0.00 56.10 52.17 1uil s TRP 23 Cb 0.11 -3.41 -0.07 0.00 0.03 0.00 0.00 33.47 30.13 1uil s TRP 23 CO -0.01 -0.95 0.54 0.95 0.96 0.00 0.00 176.95 178.44 1uil s THR 24 N 0.74 4.94 0.24 2.01 -4.23 -1.26 -4.73 115.64 113.36 1uil s THR 24 Ca 0.11 0.46 0.09 0.00 -1.18 0.00 0.00 61.69 61.17 1uil s THR 24 Cb -0.22 -3.62 0.27 0.00 1.34 0.00 0.00 72.50 70.27 1uil s THR 24 CO -0.03 -0.05 1.10 0.18 -0.54 0.00 0.00 174.62 175.27 1uil n LEU 25 N -0.08 0.10 0.15 4.79 4.77 -1.26 0.44 117.00 125.90 1uil n LEU 25 Ca 0.00 1.17 -0.06 0.00 -0.03 0.00 0.00 56.01 57.09 1uil n LEU 25 Cb 0.52 -0.50 -0.03 0.00 -2.33 0.00 0.00 43.42 41.08 1uil n LEU 25 CO 0.45 -1.25 0.43 -0.33 -1.33 0.00 0.00 177.39 175.36 1uil h GLU 26 N 0.00 -0.38 -0.36 3.23 5.08 -1.92 -2.07 114.58 118.15 1uil h GLU 26 Ca 0.51 0.03 0.05 0.00 -1.00 0.00 0.00 59.36 58.95 1uil h GLU 26 Cb 1.25 0.09 -0.08 0.00 0.50 0.00 0.00 28.75 30.51 1uil h GLU 26 CO -0.59 -0.25 -0.53 -0.91 -1.00 0.00 0.00 179.01 175.73 1uil h ASN 27 N -0.45 -1.75 0.00 1.42 -0.26 -0.38 0.14 115.58 114.29 1uil h ASN 27 Ca -0.04 0.23 0.00 0.00 -0.56 0.00 0.00 56.30 55.93 1uil h ASN 27 Cb 0.30 0.72 0.00 0.00 -1.06 0.00 0.00 38.32 38.28 1uil h ASN 27 CO 0.07 -0.41 0.00 0.00 -1.06 0.00 0.00 177.43 176.03 1uil n ALA 28 N -3.07 0.00 -0.07 -0.83 0.00 0.15 0.11 120.51 116.80 1uil n ALA 28 Ca -0.03 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.38 1uil n ALA 28 Cb 0.35 0.40 -0.02 0.00 0.00 0.00 0.00 19.45 20.18 1uil n ALA 28 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1uil h LYS 29 N 0.00 -0.02 -0.07 0.00 1.57 -0.89 0.13 116.57 117.29 1uil h LYS 29 Ca 0.00 0.00 0.01 0.00 -1.87 0.00 0.00 60.65 58.79 1uil h LYS 29 Cb 0.00 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.31 1uil h LYS 29 CO 0.00 -0.01 -0.04 0.00 -0.57 0.00 0.00 179.45 178.83 1uil n ALA 30 N -2.99 -0.04 -0.32 3.86 0.00 -0.01 0.03 120.51 121.04 1uil n ALA 30 Ca 0.00 0.06 -0.01 0.00 0.00 0.00 0.00 53.44 53.49 1uil n ALA 30 Cb 0.06 0.42 0.03 0.00 0.00 0.00 0.00 19.45 19.96 1uil n ALA 30 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 1uil n ARG 31 N -3.10 -0.19 -0.24 0.00 3.00 0.31 0.77 116.66 117.20 1uil n ARG 31 Ca 0.00 1.28 -0.11 0.00 -0.00 0.00 0.00 57.85 59.02 1uil n ARG 31 Cb 0.02 -1.89 -0.07 0.00 0.00 0.00 0.00 32.46 30.51 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 -1.79 -1.82 6.15 5.85 0.23 1.66 115.31 125.59 1uil h LEU 32 Ca 0.29 0.27 0.13 0.00 0.84 0.00 0.00 57.88 59.41 1uil h LEU 32 Cb 0.50 0.78 -0.03 0.00 0.37 0.00 0.00 40.66 42.28 1uil h LEU 32 CO -0.82 -0.33 0.39 -1.13 -0.34 0.00 0.00 178.44 176.20 1uil h ASN 33 N -0.22 0.18 0.57 1.25 -0.73 0.13 0.45 115.58 117.21 1uil h ASN 33 Ca 0.15 0.01 -0.14 0.00 1.87 0.00 0.00 56.30 58.18 1uil h ASN 33 Cb 0.54 -0.03 -0.02 0.00 0.27 0.00 0.00 38.32 39.08 1uil h ASN 33 CO -0.73 0.10 -0.66 1.56 -0.37 0.00 0.00 177.43 177.33 1uil h GLN 34 N 0.19 0.07 0.01 6.67 1.08 0.41 -0.87 115.11 122.69 1uil h GLN 34 Ca 0.27 -0.06 -0.20 0.00 -1.45 0.00 0.00 58.65 57.21 1uil h GLN 34 Cb 0.79 0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 28.22 1uil h GLN 34 CO -0.05 0.70 -0.91 -0.92 -0.95 0.00 0.00 178.83 176.71 1uil h TYR 35 N 0.05 0.25 0.00 2.96 3.20 0.53 0.13 116.97 124.09 1uil h TYR 35 Ca -0.01 -0.15 -0.07 0.00 3.14 0.00 0.00 58.73 61.65 1uil h TYR 35 Cb 1.17 -0.03 -0.01 0.00 1.54 0.00 0.00 36.73 39.40 1uil h TYR 35 CO 0.01 0.98 -0.45 0.74 -1.64 0.00 0.00 178.16 177.81 1uil h PHE 36 N 0.08 0.00 0.11 -3.82 0.04 -0.77 -2.41 116.94 110.17 1uil h PHE 36 Ca -0.04 0.00 -0.35 0.00 2.80 0.00 0.00 57.97 60.37 1uil h PHE 36 Cb 1.56 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 39.69 1uil h PHE 36 CO 0.03 0.30 -1.93 -0.56 -0.60 0.00 0.00 178.31 175.55 1uil h GLN 37 N 0.00 0.24 0.54 1.51 3.07 -1.13 0.81 115.11 120.15 1uil h GLN 37 Ca -0.02 -0.40 -0.03 0.00 0.09 0.00 0.00 58.65 58.29 1uil h GLN 37 Cb 1.24 0.15 0.01 0.00 0.08 0.00 0.00 27.48 28.96 1uil h GLN 37 CO 0.04 1.12 -0.26 0.87 0.09 0.00 0.00 178.83 180.68 1uil h LYS 38 N 0.06 -0.70 0.00 0.06 1.79 -0.83 -2.99 116.57 113.95 1uil h LYS 38 Ca -0.40 0.05 0.00 0.00 -2.18 0.00 0.00 60.65 58.12 1uil h LYS 38 Cb 2.04 0.16 0.00 0.00 -1.58 0.00 0.00 32.23 32.85 1uil h LYS 38 CO 0.10 -0.41 0.00 0.39 -1.08 0.00 0.00 179.45 178.44 1uil n GLU 39 N -5.28 0.17 -1.73 3.15 -0.58 -0.91 -4.85 120.64 110.61 1uil n GLU 39 Ca -0.10 0.36 -0.06 0.00 -0.42 0.00 0.00 57.16 56.94 1uil n GLU 39 Cb 0.32 -1.80 -0.01 0.00 -0.57 0.00 0.00 31.44 29.37 1uil n GLU 39 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 1uil n LYS 40 N -2.11 -0.43 -2.10 3.49 5.02 -0.94 -5.02 118.16 116.07 1uil n LYS 40 Ca 0.03 0.45 -0.28 0.00 -2.02 0.00 0.00 58.31 56.48 1uil n LYS 40 Cb 0.25 -4.23 0.05 0.00 -0.02 0.00 0.00 35.03 31.07 1uil n LYS 40 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1uil s ILE 41 N -2.25 3.34 -0.07 -0.18 1.01 0.28 -4.93 121.20 118.39 1uil s ILE 41 Ca 0.00 0.21 0.02 0.00 0.00 0.00 0.00 60.65 60.88 1uil s ILE 41 Cb 0.00 -3.39 0.01 0.00 0.01 0.00 0.00 42.46 39.09 1uil s ILE 41 CO 0.00 -0.47 -0.12 0.00 0.00 0.00 0.00 174.94 174.35 1uil s GLN 42 N -5.23 1.73 -0.28 2.79 0.00 -1.26 -4.40 119.66 113.00 1uil s GLN 42 Ca 0.57 -0.42 -0.18 0.00 -0.00 0.00 0.00 55.36 55.34 1uil s GLN 42 Cb -0.11 -1.44 0.10 0.00 0.00 0.00 0.00 33.01 31.56 1uil s GLN 42 CO 0.49 0.02 0.79 0.20 0.00 0.00 0.00 175.29 176.78 1uil s GLY 43 N 0.71 -0.43 0.22 2.60 0.00 -1.26 -5.06 107.32 104.09 1uil s GLY 43 Ca -0.14 2.58 0.00 0.00 0.00 0.00 0.00 44.72 47.17 1uil s GLY 43 CO 0.03 2.34 0.00 -1.84 0.00 0.00 0.00 173.10 173.63 1uil n GLU 44 N 3.82 1.47 -5.02 2.90 0.28 -1.26 -5.08 120.64 117.75 1uil n GLU 44 Ca -0.18 -1.57 -0.31 0.00 -0.16 0.00 0.00 57.16 54.93 1uil n GLU 44 Cb 0.58 0.43 -0.15 0.00 1.43 0.00 0.00 31.44 33.73 1uil n GLU 44 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 177.13 177.68 1uil s TYR 45 N -1.78 2.45 -0.36 -1.84 1.51 -1.26 -4.61 117.35 111.45 1uil s TYR 45 Ca 0.00 -0.34 -0.08 0.00 -1.01 0.00 0.00 57.07 55.64 1uil s TYR 45 Cb 0.00 -1.50 0.04 0.00 -0.11 0.00 0.00 41.96 40.40 1uil s TYR 45 CO 0.00 0.10 0.16 0.21 -1.11 0.00 0.00 175.55 174.91 1uil s LYS 46 N -0.92 2.66 -0.22 -0.62 2.36 0.10 -4.91 119.74 118.19 1uil s LYS 46 Ca 0.11 -1.20 -0.19 0.00 -2.55 0.00 0.00 55.97 52.14 1uil s LYS 46 Cb -0.10 -3.59 -0.03 0.00 -1.05 0.00 0.00 37.83 33.06 1uil s LYS 46 CO 0.01 -0.73 0.56 0.71 1.55 0.00 0.00 175.35 177.46 1uil s TYR 47 N 1.45 3.34 -0.26 4.03 2.02 -1.25 -0.18 117.35 126.49 1uil s TYR 47 Ca 0.00 0.79 -0.04 0.00 -0.37 0.00 0.00 57.07 57.46 1uil s TYR 47 Cb -0.20 -2.74 0.02 0.00 -0.40 0.00 0.00 41.96 38.64 1uil s TYR 47 CO 0.04 -0.20 -0.01 0.99 -1.57 0.00 0.00 175.55 174.80 1uil s THR 48 N 1.99 3.30 -0.15 -0.71 2.01 0.38 -4.81 115.64 117.64 1uil s THR 48 Ca 0.25 -0.87 -0.29 0.00 0.31 0.00 0.00 61.69 61.09 1uil s THR 48 Cb -0.16 -2.67 -0.01 0.00 0.01 0.00 0.00 72.50 69.67 1uil s THR 48 CO 0.09 0.17 1.10 -1.58 -0.69 0.00 0.00 174.62 173.72 1uil s GLN 49 N 1.40 4.32 0.41 4.92 -0.44 -1.26 0.19 119.66 129.19 1uil s GLN 49 Ca 0.01 1.48 0.04 0.00 -2.50 0.00 0.00 55.36 54.39 1uil s GLN 49 Cb -0.17 -3.62 -0.04 0.00 -1.64 0.00 0.00 33.01 27.54 1uil s GLN 49 CO -0.02 -0.53 0.07 0.14 0.50 0.00 0.00 175.29 175.45 1uil s VAL 50 N 2.76 1.05 0.31 1.34 -7.23 -0.53 -4.96 120.40 113.14 1uil s VAL 50 Ca 0.49 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.66 1uil s VAL 50 Cb -0.19 -2.51 0.00 0.00 0.56 0.00 0.00 36.38 34.25 1uil s VAL 50 CO 0.14 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.54 1uil n GLY 51 N -0.93 -1.97 3.81 2.32 0.00 -1.26 -2.15 105.19 105.02 1uil n GLY 51 Ca -0.08 -1.20 -0.30 0.00 0.00 0.00 0.00 46.02 44.44 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 -2.27 2.49 0.09 1.61 0.04 -1.13 -4.69 135.00 131.13 1uil s PRO 52 Ca 0.00 0.78 -0.29 0.00 0.04 0.00 0.00 61.00 61.54 1uil s PRO 52 Cb 0.00 -1.95 -0.15 0.00 0.04 0.00 0.00 34.50 32.44 1uil s PRO 52 CO 0.00 -1.37 1.66 -0.44 0.04 0.00 0.00 177.00 176.89 1uil h ASP 53 N -0.91 -0.56 -1.26 6.66 3.32 -1.97 0.35 116.42 122.05 1uil h ASP 53 Ca -0.45 0.04 0.40 0.00 0.02 0.00 0.00 57.03 57.03 1uil h ASP 53 Cb 1.24 0.17 -0.12 0.00 0.22 0.00 0.00 39.33 40.84 1uil h ASP 53 CO 0.58 -0.35 0.81 1.12 -1.72 0.00 0.00 179.24 179.68 1uil h HIS 54 N -0.55 0.55 -1.92 4.55 2.07 -1.99 -3.13 115.15 114.73 1uil h HIS 54 Ca -0.03 0.02 -0.39 0.00 -2.85 0.00 0.00 60.37 57.12 1uil h HIS 54 Cb 0.46 -0.14 -0.31 0.00 2.57 0.00 0.00 27.41 29.99 1uil h HIS 54 CO -0.10 -0.16 -0.72 1.21 -3.07 0.00 0.00 177.93 175.09 1uil s ASN 55 N -4.65 0.90 0.35 3.10 2.47 -0.55 -5.14 114.94 111.43 1uil s ASN 55 Ca -0.08 -1.93 0.09 0.00 0.42 0.00 0.00 52.86 51.36 1uil s ASN 55 Cb 0.29 0.52 -0.06 0.00 -1.45 0.00 0.00 41.25 40.54 1uil s ASN 55 CO 0.82 -0.21 -0.02 0.00 -3.72 0.00 0.00 177.10 173.96 1uil s ARG 56 N 1.06 1.97 -0.08 0.43 1.70 0.11 -2.82 118.95 121.31 1uil s ARG 56 Ca 0.22 -1.86 -0.03 0.00 -0.47 0.00 0.00 55.73 53.58 1uil s ARG 56 Cb -0.10 -1.82 0.04 0.00 -0.57 0.00 0.00 34.95 32.51 1uil s ARG 56 CO -0.06 0.11 0.17 -1.54 -1.08 0.00 0.00 175.30 172.90 1uil s SER 57 N -3.68 -0.04 -0.66 -2.89 1.04 -0.91 -4.97 113.70 101.59 1uil s SER 57 Ca 0.34 0.37 -0.24 0.00 0.48 0.00 0.00 55.95 56.90 1uil s SER 57 Cb 0.02 0.27 0.05 0.00 0.10 0.00 0.00 66.02 66.46 1uil s SER 57 CO 0.18 -0.17 1.06 -0.36 0.98 0.00 0.00 173.24 174.93 1uil s PHE 58 N 1.36 2.58 -0.39 5.02 0.08 -1.25 -1.46 117.98 123.92 1uil s PHE 58 Ca -0.08 -0.30 -0.28 0.00 0.12 0.00 0.00 56.93 56.39 1uil s PHE 58 Cb -0.11 -4.36 -0.01 0.00 -0.57 0.00 0.00 43.02 37.96 1uil s PHE 58 CO -0.07 -1.73 1.72 0.42 -0.10 0.00 0.00 175.22 175.47 1uil s ILE 59 N 4.55 3.55 -0.41 0.64 1.01 0.52 -4.14 121.20 126.93 1uil s ILE 59 Ca 0.28 0.54 -0.20 0.00 0.00 0.00 0.00 60.65 61.26 1uil s ILE 59 Cb -0.13 -3.81 0.02 0.00 0.01 0.00 0.00 42.46 38.54 1uil s ILE 59 CO 0.13 -0.56 0.61 0.00 0.00 0.00 0.00 174.94 175.13 1uil s ALA 60 N 6.85 3.39 -0.03 9.38 0.00 -1.02 0.14 121.76 140.47 1uil s ALA 60 Ca 0.74 -1.13 0.07 0.00 0.00 0.00 0.00 51.96 51.64 1uil s ALA 60 Cb -0.19 -3.23 -0.02 0.00 0.00 0.00 0.00 23.12 19.68 1uil s ALA 60 CO 0.32 -1.61 -0.25 -1.83 0.00 0.00 0.00 175.76 172.39 1uil s GLU 61 N 2.71 2.20 0.00 0.00 -1.05 0.74 -2.30 118.70 121.00 1uil s GLU 61 Ca 0.22 -0.90 -0.02 0.00 -0.15 0.00 0.00 54.97 54.11 1uil s GLU 61 Cb -0.14 -2.09 -0.01 0.00 -0.44 0.00 0.00 34.13 31.45 1uil s GLU 61 CO 0.17 0.55 0.03 1.41 0.95 0.00 0.00 175.26 178.37 1uil s MET 62 N -0.58 0.27 -0.02 -4.83 1.75 -0.49 0.02 119.30 115.43 1uil s MET 62 Ca 0.09 -0.35 0.01 0.00 -1.25 0.00 0.00 55.69 54.18 1uil s MET 62 Cb -0.10 0.11 0.01 0.00 2.84 0.00 0.00 34.83 37.68 1uil s MET 62 CO -0.00 -0.05 -0.03 0.99 -0.65 0.00 0.00 175.02 175.27 1uil s THR 63 N -0.99 0.32 0.07 10.11 2.01 -1.26 0.62 115.64 126.52 1uil s THR 63 Ca -0.11 -0.10 0.03 0.00 0.31 0.00 0.00 61.69 61.82 1uil s THR 63 Cb -0.07 -0.32 -0.03 0.00 0.01 0.00 0.00 72.50 72.09 1uil s THR 63 CO -0.00 0.13 -0.09 0.27 -0.69 0.00 0.00 174.62 174.24 1uil s ILE 64 N 0.34 0.71 -0.05 1.82 -4.36 -0.12 -4.91 121.20 114.64 1uil s ILE 64 Ca -0.03 -1.38 0.05 0.00 -0.26 0.00 0.00 60.65 59.03 1uil s ILE 64 Cb -0.07 -1.01 -0.02 0.00 1.25 0.00 0.00 42.46 42.61 1uil s ILE 64 CO -0.01 -0.50 -0.19 -0.47 0.24 0.00 0.00 174.94 174.02 1uil s TYR 65 N -2.01 2.56 -0.22 1.37 6.14 -1.26 0.01 117.35 123.93 1uil s TYR 65 Ca -0.02 -0.36 -0.04 0.00 0.64 0.00 0.00 57.07 57.29 1uil s TYR 65 Cb -0.06 -1.60 -0.01 0.00 0.42 0.00 0.00 41.96 40.71 1uil s TYR 65 CO -0.00 0.03 -0.04 0.42 0.64 0.00 0.00 175.55 176.60 1uil s ILE 66 N -0.53 3.42 0.06 3.14 -1.09 0.30 -4.95 121.20 121.55 1uil s ILE 66 Ca 0.07 -0.48 -0.11 0.00 -2.23 0.00 0.00 60.65 57.90 1uil s ILE 66 Cb -0.11 -2.56 -0.29 0.00 -1.58 0.00 0.00 42.46 37.91 1uil s ILE 66 CO 0.01 0.42 1.11 0.07 -1.23 0.00 0.00 174.94 175.32 1uil h LYS 67 N 8.10 0.49 0.00 2.79 2.10 -1.95 0.26 116.57 128.36 1uil h LYS 67 Ca -0.41 -0.72 -0.00 0.00 -2.00 0.00 0.00 60.65 57.51 1uil h LYS 67 Cb 1.16 0.25 -0.00 0.00 -0.90 0.00 0.00 32.23 32.74 1uil h LYS 67 CO 0.60 1.33 -0.00 -0.56 -2.00 0.00 0.00 179.45 178.82 1uil h GLN 68 N 0.19 0.00 0.00 0.07 3.07 -1.93 -2.30 115.11 114.21 1uil h GLN 68 Ca -0.18 0.00 -0.34 0.00 0.09 0.00 0.00 58.65 58.22 1uil h GLN 68 Cb 1.96 0.00 -0.06 0.00 0.08 0.00 0.00 27.48 29.46 1uil h GLN 68 CO 0.23 0.00 -2.28 1.28 0.09 0.00 0.00 178.83 178.15 1uil n LEU 69 N -3.13 1.91 0.00 0.06 4.77 -1.18 -5.01 117.00 114.42 1uil n LEU 69 Ca -0.02 -0.08 0.00 0.00 -0.03 0.00 0.00 56.01 55.88 1uil n LEU 69 Cb 0.12 -0.36 0.00 0.00 -2.33 0.00 0.00 43.42 40.85 1uil n LEU 69 CO 0.22 0.73 0.00 0.61 -1.33 0.00 0.00 177.39 177.62 1uil n GLY 70 N 2.22 0.83 0.62 -0.72 0.00 0.82 -5.05 105.19 103.91 1uil n GLY 70 Ca -0.37 -0.04 -0.04 0.00 0.00 0.00 0.00 46.02 45.57 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 -2.34 0.20 -3.91 1.61 -4.01 -0.71 -4.99 116.66 102.51 1uil n ARG 71 Ca 0.00 -0.64 -0.10 0.00 -1.04 0.00 0.00 57.85 56.06 1uil n ARG 71 Cb 0.00 0.50 -0.10 0.00 -3.04 0.00 0.00 32.46 29.82 1uil n ARG 71 CO 0.00 0.00 0.00 -0.98 -3.04 0.00 0.00 177.63 173.61 1uil s ARG 72 N -2.27 0.48 0.12 2.89 1.04 -1.26 0.11 118.95 120.07 1uil s ARG 72 Ca 0.07 -0.54 0.09 0.00 -1.04 0.00 0.00 55.73 54.31 1uil s ARG 72 Cb 0.00 0.19 -0.04 0.00 -2.04 0.00 0.00 34.95 33.07 1uil s ARG 72 CO 0.05 -0.11 -0.18 0.96 -0.04 0.00 0.00 175.30 175.98 1uil s ILE 73 N -1.76 2.85 0.17 4.99 -4.36 0.10 -4.96 121.20 118.24 1uil s ILE 73 Ca -0.12 -1.52 0.08 0.00 -0.26 0.00 0.00 60.65 58.83 1uil s ILE 73 Cb -0.06 -2.31 -0.04 0.00 1.25 0.00 0.00 42.46 41.29 1uil s ILE 73 CO -0.01 0.09 -0.16 0.12 0.24 0.00 0.00 174.94 175.22 1uil s PHE 74 N -1.18 1.71 0.04 1.37 5.36 -1.26 -0.94 117.98 123.08 1uil s PHE 74 Ca 0.18 -0.52 -0.05 0.00 -0.96 0.00 0.00 56.93 55.58 1uil s PHE 74 Cb -0.10 -0.84 -0.01 0.00 -0.34 0.00 0.00 43.02 41.73 1uil s PHE 74 CO 0.10 0.31 0.09 0.00 -1.46 0.00 0.00 175.22 174.27 1uil s ALA 75 N -2.39 -0.04 -0.30 11.12 0.00 0.20 -4.87 121.76 125.48 1uil s ALA 75 Ca 0.17 -0.59 -0.07 0.00 0.00 0.00 0.00 51.96 51.47 1uil s ALA 75 Cb -0.04 0.26 0.19 0.00 0.00 0.00 0.00 23.12 23.53 1uil s ALA 75 CO 0.06 -0.33 0.95 0.50 0.00 0.00 0.00 175.76 176.94 1uil s ARG 76 N -2.73 0.23 0.55 0.00 3.52 -1.26 -1.40 118.95 117.86 1uil s ARG 76 Ca -0.04 0.21 0.04 0.00 -0.13 0.00 0.00 55.73 55.81 1uil s ARG 76 Cb -0.00 0.10 0.03 0.00 -1.56 0.00 0.00 34.95 33.52 1uil s ARG 76 CO -0.05 -0.43 0.30 -1.21 -0.81 0.00 0.00 175.30 173.09 1uil s GLU 77 N 2.89 2.23 -0.53 5.12 0.41 -0.97 -4.97 118.70 122.88 1uil s GLU 77 Ca 0.24 -2.17 0.06 0.00 -0.41 0.00 0.00 54.97 52.68 1uil s GLU 77 Cb -0.03 -1.92 0.22 0.00 -1.78 0.00 0.00 34.13 30.61 1uil s GLU 77 CO -0.23 -0.60 0.55 -2.39 -0.49 0.00 0.00 175.26 172.10 1uil n HIS 78 N -1.67 1.42 -1.50 1.61 1.44 -1.26 -2.45 115.22 112.82 1uil n HIS 78 Ca -0.08 -3.83 -0.29 0.00 -2.01 0.00 0.00 57.72 51.51 1uil n HIS 78 Cb 0.65 -0.34 0.14 0.00 0.12 0.00 0.00 29.99 30.56 1uil n HIS 78 CO 0.00 0.00 0.00 0.20 -2.81 0.00 0.00 176.34 173.73 1uil s GLY 79 N -1.39 1.58 -0.05 -1.39 0.00 -1.26 -4.96 107.32 99.86 1uil s GLY 79 Ca 0.34 -0.55 -0.20 0.00 0.00 0.00 0.00 44.72 44.32 1uil s GLY 79 CO -0.11 0.03 0.82 1.76 0.00 0.00 0.00 173.10 175.60 1uil h SER 80 N -1.58 -0.23 -1.47 1.64 0.02 -1.91 -3.34 113.55 106.67 1uil h SER 80 Ca -0.51 -0.28 -0.59 0.00 -0.84 0.00 0.00 61.79 59.58 1uil h SER 80 Cb 1.33 0.06 -0.10 0.00 0.14 0.00 0.00 62.40 63.83 1uil h SER 80 CO 0.60 0.30 -0.51 0.54 -1.14 0.00 0.00 176.83 176.62 1uil s ASN 81 N -5.37 4.30 0.13 3.07 2.20 -1.26 -4.34 114.94 113.66 1uil s ASN 81 Ca -0.12 -1.19 -0.29 0.00 -0.94 0.00 0.00 52.86 50.32 1uil s ASN 81 Cb 0.01 -0.35 -0.06 0.00 -2.00 0.00 0.00 41.25 38.85 1uil s ASN 81 CO 0.42 -0.57 1.58 0.11 -2.94 0.00 0.00 177.10 175.70 1uil h LYS 82 N 1.46 -0.47 0.00 3.55 1.57 -1.90 0.24 116.57 121.02 1uil h LYS 82 Ca -0.43 0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.38 1uil h LYS 82 Cb 1.26 0.11 0.00 0.00 0.08 0.00 0.00 32.23 33.67 1uil h LYS 82 CO 0.72 -0.31 0.00 1.17 -0.57 0.00 0.00 179.45 180.46 1uil n LYS 83 N -5.44 0.00 -0.20 3.15 0.00 -1.26 0.01 118.16 114.42 1uil n LYS 83 Ca -0.04 0.69 -0.05 0.00 0.00 0.00 0.00 58.31 58.90 1uil n LYS 83 Cb 0.36 -1.31 -0.05 0.00 0.00 0.00 0.00 35.03 34.04 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 -2.03 -0.51 -0.31 3.14 4.77 -1.10 0.93 117.00 121.88 1uil n LEU 84 Ca 0.00 1.35 -0.03 0.00 -0.03 0.00 0.00 56.01 57.30 1uil n LEU 84 Cb 0.00 -0.36 0.01 0.00 -2.33 0.00 0.00 43.42 40.74 1uil n LEU 84 CO 0.00 -0.94 0.45 0.00 -1.33 0.00 0.00 177.39 175.57 1uil n ALA 85 N -3.12 -0.19 0.34 -1.18 0.00 0.84 0.68 120.51 117.89 1uil n ALA 85 Ca 0.01 0.77 -0.17 0.00 0.00 0.00 0.00 53.44 54.05 1uil n ALA 85 Cb 0.13 -0.30 -0.09 0.00 0.00 0.00 0.00 19.45 19.18 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 0.95 -0.84 -0.36 0.00 0.00 0.36 -1.62 119.26 117.76 1uil h ALA 86 Ca 0.25 -0.18 0.03 0.00 0.00 0.00 0.00 54.91 55.00 1uil h ALA 86 Cb 0.45 0.32 -0.04 0.00 0.00 0.00 0.00 17.79 18.52 1uil h ALA 86 CO -0.79 -0.97 -0.21 1.04 0.00 0.00 0.00 179.25 178.33 1uil n GLN 87 N -5.45 -0.16 0.02 0.00 1.13 0.26 0.49 117.38 113.68 1uil n GLN 87 Ca -0.13 1.01 -0.13 0.00 -1.94 0.00 0.00 57.00 55.81 1uil n GLN 87 Cb 0.34 -1.50 -0.07 0.00 0.11 0.00 0.00 30.24 29.12 1uil n GLN 87 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 1uil h SER 88 N 0.00 -1.36 -0.84 1.08 0.87 -0.92 -0.18 113.55 112.20 1uil h SER 88 Ca 0.06 0.17 0.08 0.00 -1.23 0.00 0.00 61.79 60.87 1uil h SER 88 Cb 0.15 0.54 -0.11 0.00 -0.44 0.00 0.00 62.40 62.54 1uil h SER 88 CO -0.33 -0.45 -0.57 0.00 -0.53 0.00 0.00 176.83 174.94 1uil h ALA 90 N 0.39 -0.42 -1.69 0.00 0.00 0.92 0.59 119.26 119.05 1uil h ALA 90 Ca 0.14 -0.00 0.52 0.00 0.00 0.00 0.00 54.91 55.56 1uil h ALA 90 Cb 0.46 0.75 -0.10 0.00 0.00 0.00 0.00 17.79 18.90 1uil h ALA 90 CO -0.85 -0.47 1.18 1.25 0.00 0.00 0.00 179.25 180.36 1uil h LEU 91 N -0.08 0.08 0.40 0.00 5.85 0.32 1.16 115.31 123.04 1uil h LEU 91 Ca 0.01 0.06 -0.02 0.00 0.84 0.00 0.00 57.88 58.77 1uil h LEU 91 Cb 0.11 0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.20 1uil h LEU 91 CO -0.10 -0.09 -0.19 -1.28 -0.34 0.00 0.00 178.44 176.44 1uil h SER 92 N 0.02 -0.46 -0.63 1.25 0.87 0.47 0.40 113.55 115.47 1uil h SER 92 Ca 0.88 -0.05 -0.07 0.00 -1.23 0.00 0.00 61.79 61.32 1uil h SER 92 Cb 3.28 0.12 -0.02 0.00 -0.44 0.00 0.00 62.40 65.33 1uil h SER 92 CO -0.18 -0.24 0.10 -0.07 -0.53 0.00 0.00 176.83 175.92 1uil h LEU 93 N -0.66 1.00 0.34 2.23 -0.00 0.23 -2.57 115.31 115.88 1uil h LEU 93 Ca -0.06 -0.26 -0.01 0.00 -0.00 0.00 0.00 57.88 57.55 1uil h LEU 93 Cb 0.48 -0.26 -0.00 0.00 -0.00 0.00 0.00 40.66 40.87 1uil h LEU 93 CO 0.09 1.00 -0.23 0.58 -0.00 0.00 0.00 178.44 179.89 1uil h VAL 94 N 0.95 0.00 -0.95 1.22 2.07 -0.26 0.44 116.25 119.72 1uil h VAL 94 Ca 0.19 0.00 0.17 0.00 0.82 0.00 0.00 66.70 67.88 1uil h VAL 94 Cb 0.43 0.00 -0.16 0.00 -1.52 0.00 0.00 31.29 30.04 1uil h VAL 94 CO 0.01 0.00 -0.31 0.54 0.02 0.00 0.00 177.57 177.83 1uil n ARG 95 N -3.71 -0.16 0.28 1.57 1.74 0.14 0.05 116.66 116.56 1uil n ARG 95 Ca -0.07 1.47 -0.16 0.00 -0.77 0.00 0.00 57.85 58.32 1uil n ARG 95 Cb 0.23 -2.19 -0.08 0.00 -1.02 0.00 0.00 32.46 29.40 1uil n ARG 95 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 1uil h GLN 96 N 0.00 -0.65 -0.79 5.56 7.50 -1.22 0.01 115.11 125.52 1uil h GLN 96 Ca 0.38 0.04 0.14 0.00 0.50 0.00 0.00 58.65 59.72 1uil h GLN 96 Cb 0.62 0.15 -0.14 0.00 0.05 0.00 0.00 27.48 28.16 1uil h GLN 96 CO -0.96 -0.43 -0.31 -0.07 -1.50 0.00 0.00 178.83 175.56 1uil h LEU 97 N -0.67 -1.11 0.81 1.46 3.38 0.38 0.53 115.31 120.09 1uil h LEU 97 Ca -0.06 0.26 -0.04 0.00 0.09 0.00 0.00 57.88 58.13 1uil h LEU 97 Cb 0.53 0.61 -0.00 0.00 0.09 0.00 0.00 40.66 41.89 1uil h LEU 97 CO 0.09 -0.29 -0.47 0.22 0.09 0.00 0.00 178.44 178.08 1uil h TYR 98 N -0.06 -1.25 -0.32 1.13 3.20 -0.49 0.92 116.97 120.10 1uil h TYR 98 Ca 0.32 -0.02 0.04 0.00 3.14 0.00 0.00 58.73 62.22 1uil h TYR 98 Cb 0.58 0.44 -0.07 0.00 1.54 0.00 0.00 36.73 39.23 1uil h TYR 98 CO -0.71 -0.72 -0.46 1.12 -1.64 0.00 0.00 178.16 175.75 1uil h HIS 99 N -1.19 -1.41 -0.58 -3.82 2.07 0.46 0.30 115.15 110.98 1uil h HIS 99 Ca -0.11 0.07 0.12 0.00 -2.85 0.00 0.00 60.37 57.60 1uil h HIS 99 Cb 0.95 0.66 -0.10 0.00 2.57 0.00 0.00 27.41 31.48 1uil h HIS 99 CO -0.08 -0.41 -0.06 -0.07 -3.07 0.00 0.00 177.93 174.23 1uil h LEU 100 N -0.34 -0.38 0.00 6.12 3.38 0.04 -3.46 115.31 120.66 1uil h LEU 100 Ca 0.06 0.16 0.00 0.00 0.09 0.00 0.00 57.88 58.18 1uil h LEU 100 Cb 0.50 0.30 0.00 0.00 0.09 0.00 0.00 40.66 41.55 1uil h LEU 100 CO -0.48 -0.14 0.00 0.61 0.09 0.00 0.00 178.44 178.51 1uil n GLY 101 N -1.37 0.55 0.41 0.83 0.00 0.87 -5.08 105.19 101.41 1uil n GLY 101 Ca 0.07 -0.51 -0.04 0.00 0.00 0.00 0.00 46.02 45.55 1uil n GLY 101 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1uil n VAL 102 N 0.00 0.25 -3.60 1.61 0.31 0.28 -4.98 118.33 112.20 1uil n VAL 102 Ca 0.00 -0.08 -0.23 0.00 -0.01 0.00 0.00 64.34 64.02 1uil n VAL 102 Cb 0.00 -1.08 -0.01 0.00 -0.91 0.00 0.00 33.84 31.84 1uil n VAL 102 CO 0.00 0.00 0.00 0.27 -1.32 0.00 0.00 176.83 175.78 1uil s ILE 103 N -2.09 2.18 0.05 2.52 -4.36 -1.23 -4.95 121.20 113.33 1uil s ILE 103 Ca -0.06 -1.34 0.07 0.00 -0.26 0.00 0.00 60.65 59.05 1uil s ILE 103 Cb 0.02 -2.53 -0.03 0.00 1.25 0.00 0.00 42.46 41.18 1uil s ILE 103 CO 0.09 0.00 -0.19 -1.83 0.24 0.00 0.00 174.94 173.25 1uil s GLU 104 N -4.28 1.22 0.69 0.37 -1.05 -1.26 -4.58 118.70 109.81 1uil s GLU 104 Ca 0.45 -0.91 -0.16 0.00 -0.15 0.00 0.00 54.97 54.19 1uil s GLU 104 Cb -0.03 -1.32 -0.14 0.00 -0.44 0.00 0.00 34.13 32.20 1uil s GLU 104 CO 0.27 0.33 -0.41 0.00 0.95 0.00 0.00 175.26 176.40 1uil n ALA 105 N 1.77 -4.06 -2.01 -0.84 0.00 -1.26 -4.96 120.51 109.15 1uil n ALA 105 Ca -0.18 -0.32 -0.23 0.00 0.00 0.00 0.00 53.44 52.71 1uil n ALA 105 Cb 0.54 -1.21 0.12 0.00 0.00 0.00 0.00 19.45 18.90 1uil n ALA 105 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 1uil s TYR 106 N -1.88 1.24 -0.07 0.00 5.04 -1.26 -4.96 117.35 115.46 1uil s TYR 106 Ca 0.46 -0.43 -0.02 0.00 -2.44 0.00 0.00 57.07 54.64 1uil s TYR 106 Cb -0.33 -2.89 0.03 0.00 0.35 0.00 0.00 41.96 39.12 1uil s TYR 106 CO 0.69 -1.79 0.02 0.45 -1.34 0.00 0.00 175.55 173.58 1uil s SER 107 N -4.79 1.53 0.02 4.32 0.15 -1.26 -4.54 113.70 109.12 1uil s SER 107 Ca 0.67 -0.08 0.00 0.00 0.70 0.00 0.00 55.95 57.25 1uil s SER 107 Cb -0.04 -0.38 0.00 0.00 -1.71 0.00 0.00 66.02 63.89 1uil s SER 107 CO 0.45 -0.21 0.00 -0.24 1.20 0.00 0.00 173.24 174.43 1uil n SER 108 N 5.18 0.11 0.00 5.45 2.88 -1.26 -5.13 113.62 120.85 1uil n SER 108 Ca -0.06 0.03 0.00 0.00 -1.33 0.00 0.00 58.87 57.51 1uil n SER 108 Cb 0.50 -0.02 0.00 0.00 -0.75 0.00 0.00 64.21 63.94 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 3.10 0.73 3.77 0.46 0.00 -1.26 -5.07 105.19 106.92 1uil n GLY 109 Ca 0.00 -2.10 -0.38 0.00 0.00 0.00 0.00 46.02 43.53 1uil n GLY 109 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1uil s PRO 110 N -0.93 4.39 0.00 1.61 0.04 -1.26 -4.72 135.00 134.13 1uil s PRO 110 Ca 0.00 1.64 0.00 0.00 0.04 0.00 0.00 61.00 62.68 1uil s PRO 110 Cb 0.00 -2.85 0.00 0.00 0.04 0.00 0.00 34.50 31.69 1uil s PRO 110 CO 0.00 0.03 0.00 0.45 0.04 0.00 0.00 177.00 177.52 1uil n SER 111 N 0.53 0.00 -2.73 6.66 2.88 -1.26 -5.10 113.62 114.60 1uil n SER 111 Ca 0.02 0.00 -0.02 0.00 -1.33 0.00 0.00 58.87 57.54 1uil n SER 111 Cb 0.47 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.91 1uil n SER 111 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 1uil n SER 112 N 0.00 -4.82 0.00 -3.46 2.88 -1.26 -5.34 113.62 101.62 1uil n SER 112 Ca 0.00 1.31 0.00 0.00 -1.33 0.00 0.00 58.87 58.85 1uil n SER 112 Cb 0.00 -4.84 0.00 0.00 -0.75 0.00 0.00 64.21 58.62 1uil n SER 112 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42