#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1cot s GLY 3 N 0.00 2.00 -0.36 0.00 0.00 -1.26 -4.93 107.32 102.77 1cot s GLY 3 Ca 0.00 0.17 -0.08 0.00 0.00 0.00 0.00 44.72 44.81 1cot s GLY 3 CO 0.00 0.45 0.15 -0.35 0.00 0.00 0.00 173.10 173.34 1cot s ASP 4 N -3.23 5.44 0.54 1.64 -1.08 -1.26 -4.86 116.67 113.87 1cot s ASP 4 Ca 0.59 -1.16 0.22 0.00 -0.52 0.00 0.00 52.55 51.67 1cot s ASP 4 Cb -0.11 -1.92 1.48 0.00 -1.46 0.00 0.00 42.92 40.92 1cot s ASP 4 CO 0.37 -0.37 2.18 0.00 0.52 0.00 0.00 175.17 177.87 1cot h ALA 5 N 8.28 1.78 -0.31 3.66 0.00 -1.84 0.17 119.26 131.01 1cot h ALA 5 Ca -0.23 -0.01 -0.07 0.00 0.00 0.00 0.00 54.91 54.60 1cot h ALA 5 Cb 1.09 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 1cot h ALA 5 CO 0.63 0.01 -0.07 0.00 0.00 0.00 0.00 179.25 179.83 1cot h ALA 6 N 1.99 0.42 -0.25 0.00 0.00 -1.94 -0.30 119.26 119.19 1cot h ALA 6 Ca -0.00 -0.28 -0.12 0.00 0.00 0.00 0.00 54.91 54.51 1cot h ALA 6 Cb 0.02 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1cot h ALA 6 CO 0.00 0.24 -0.36 0.87 0.00 0.00 0.00 179.25 180.01 1cot h LYS 7 N 0.36 0.56 -0.57 0.00 1.57 -1.76 -2.64 116.57 114.08 1cot h LYS 7 Ca 0.08 -0.26 0.01 0.00 -1.87 0.00 0.00 60.65 58.60 1cot h LYS 7 Cb 0.55 -0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.83 1cot h LYS 7 CO 0.03 0.84 0.38 0.78 -0.57 0.00 0.00 179.45 180.91 1cot h GLY 8 N 1.05 0.81 1.42 3.86 0.00 -0.27 -0.20 103.07 109.73 1cot h GLY 8 Ca 0.05 -0.30 -0.05 0.00 0.00 0.00 0.00 47.33 47.03 1cot h GLY 8 CO 0.07 0.30 0.11 -2.09 0.00 0.00 0.00 176.54 174.93 1cot h GLU 9 N 0.78 0.74 -0.20 4.80 4.81 -0.68 -0.51 114.58 124.31 1cot h GLU 9 Ca 0.21 -0.14 -0.18 0.00 -0.13 0.00 0.00 59.36 59.11 1cot h GLU 9 Cb -0.09 -0.12 0.01 0.00 0.63 0.00 0.00 28.75 29.18 1cot h GLU 9 CO -0.05 0.67 -0.59 0.87 -0.73 0.00 0.00 179.01 179.18 1cot h LYS 10 N 0.71 0.75 -0.25 1.92 1.57 -1.30 -2.96 116.57 117.02 1cot h LYS 10 Ca 0.16 -0.55 0.03 0.00 -1.87 0.00 0.00 60.65 58.42 1cot h LYS 10 Cb 0.27 0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.66 1cot h LYS 10 CO -0.00 1.17 0.17 0.93 -0.57 0.00 0.00 179.45 181.14 1cot h GLU 11 N 0.48 0.22 0.00 3.15 4.39 -0.47 -1.08 114.58 121.27 1cot h GLU 11 Ca -0.02 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.67 1cot h GLU 11 Cb 1.22 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.82 1cot h GLU 11 CO 0.13 0.15 0.05 0.35 -1.16 0.00 0.00 179.01 178.53 1cot h PHE 12 N 0.23 0.00 0.00 4.33 3.57 -0.93 -0.04 116.94 124.10 1cot h PHE 12 Ca 0.11 0.00 -0.00 0.00 3.53 0.00 0.00 57.97 61.60 1cot h PHE 12 Cb 0.14 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 38.88 1cot h PHE 12 CO -0.00 0.00 -0.01 -0.91 -2.23 0.00 0.00 178.31 175.16 1cot h ASN 13 N 0.00 0.00 1.89 0.41 2.35 -1.29 0.27 115.58 119.21 1cot h ASN 13 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1cot h ASN 13 Cb 0.11 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.48 1cot h ASN 13 CO 0.00 0.01 0.00 0.11 -1.65 0.00 0.00 177.43 175.90 1cot h LYS 14 N 0.00 0.00 0.00 0.81 6.56 -1.20 -3.32 116.57 119.42 1cot h LYS 14 Ca -0.00 0.00 -0.24 0.00 -1.06 0.00 0.00 60.65 59.35 1cot h LYS 14 Cb 0.11 0.00 -0.04 0.00 -0.57 0.00 0.00 32.23 31.72 1cot h LYS 14 CO 0.00 0.00 -2.22 0.00 -2.06 0.00 0.00 179.45 175.17 1cot h LYS 16 N 0.00 0.00 0.00 0.00 2.10 -1.11 -1.15 116.57 116.41 1cot h LYS 16 Ca -0.35 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.29 1cot h LYS 16 Cb 1.80 0.00 -0.00 0.00 -0.90 0.00 0.00 32.23 33.13 1cot h LYS 16 CO 0.02 0.00 -0.05 0.00 -2.00 0.00 0.00 179.45 177.42 1cot h ALA 17 N 1.51 1.85 0.00 0.07 0.00 -1.81 -0.13 119.26 120.76 1cot h ALA 17 Ca 0.17 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1cot h ALA 17 Cb 0.99 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.78 1cot h ALA 17 CO -0.00 0.06 -0.30 0.00 0.00 0.00 0.00 179.25 179.01 1cot s HIS 19 N -1.32 0.84 0.47 0.00 3.76 -0.54 0.90 115.29 119.39 1cot s HIS 19 Ca 0.00 -0.18 0.06 0.00 -0.15 0.00 0.00 55.06 54.80 1cot s HIS 19 Cb 0.00 -0.57 -0.01 0.00 1.11 0.00 0.00 32.58 33.11 1cot s HIS 19 CO 0.02 -0.05 0.30 0.00 -0.85 0.00 0.00 174.74 174.17 1cot s MET 20 N -0.03 2.31 -0.30 1.40 0.00 -1.20 -4.11 119.30 117.37 1cot s MET 20 Ca 0.01 -1.87 0.00 0.00 0.00 0.00 0.00 55.69 53.83 1cot s MET 20 Cb -0.06 -2.10 0.09 0.00 0.00 0.00 0.00 34.83 32.77 1cot s MET 20 CO -0.00 -0.34 0.08 0.42 0.00 0.00 0.00 175.02 175.18 1cot s ILE 21 N -2.65 1.14 -0.07 3.16 1.01 -0.30 -1.10 121.20 122.39 1cot s ILE 21 Ca 0.38 -1.50 0.02 0.00 0.00 0.00 0.00 60.65 59.55 1cot s ILE 21 Cb -0.00 -1.81 0.02 0.00 0.01 0.00 0.00 42.46 40.67 1cot s ILE 21 CO 0.22 -0.60 -0.10 -1.58 0.00 0.00 0.00 174.94 172.89 1cot s GLN 22 N 1.49 1.47 0.74 2.79 0.74 -1.26 -0.53 119.66 125.10 1cot s GLN 22 Ca 0.08 -0.31 -0.14 0.00 0.05 0.00 0.00 55.36 55.04 1cot s GLN 22 Cb -0.18 -1.31 0.05 0.00 1.10 0.00 0.00 33.01 32.67 1cot s GLN 22 CO -0.20 -0.05 1.15 0.00 -0.55 0.00 0.00 175.29 175.65 1cot s ALA 23 N 0.90 2.14 0.54 1.58 0.00 0.11 -4.63 121.76 122.41 1cot s ALA 23 Ca -0.11 0.66 0.26 0.00 0.00 0.00 0.00 51.96 52.77 1cot s ALA 23 Cb -0.15 -3.40 1.43 0.00 0.00 0.00 0.00 23.12 21.00 1cot s ALA 23 CO 0.01 -1.82 2.01 -1.35 0.00 0.00 0.00 175.76 174.61 1cot h PRO 24 N -0.54 0.00 0.00 0.00 0.11 -1.98 0.48 132.00 130.06 1cot h PRO 24 Ca -0.46 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1cot h PRO 24 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 1cot h PRO 24 CO 0.50 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 177.89 1cot n ASP 25 N -4.25 0.00 0.00 -2.05 5.75 -1.26 -4.86 116.55 109.88 1cot n ASP 25 Ca 0.08 -0.62 0.00 0.00 -0.01 0.00 0.00 54.79 54.24 1cot n ASP 25 Cb 0.54 -0.09 0.00 0.00 -1.03 0.00 0.00 41.12 40.54 1cot n ASP 25 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1cot n GLY 26 N 0.80 0.71 3.68 6.12 0.00 0.17 -5.03 105.19 111.64 1cot n GLY 26 Ca 0.18 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.78 1cot n GLY 26 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1cot s THR 27 N -2.57 3.63 -0.06 2.61 2.01 -1.23 -4.75 115.64 115.28 1cot s THR 27 Ca 0.00 0.99 -0.30 0.00 0.31 0.00 0.00 61.69 62.70 1cot s THR 27 Cb 0.00 -3.64 -0.02 0.00 0.01 0.00 0.00 72.50 68.85 1cot s THR 27 CO 0.00 -0.01 1.07 -1.81 -0.69 0.00 0.00 174.62 173.17 1cot s ASP 28 N 2.09 7.21 -0.20 3.53 1.01 -1.26 -0.71 116.67 128.33 1cot s ASP 28 Ca 0.66 1.67 -0.16 0.00 0.71 0.00 0.00 52.55 55.43 1cot s ASP 28 Cb -0.32 -2.56 -0.09 0.00 1.01 0.00 0.00 42.92 40.96 1cot s ASP 28 CO 0.27 -0.45 -0.24 -0.38 0.21 0.00 0.00 175.17 174.58 1cot n ILE 29 N 4.39 1.50 -3.91 0.77 5.41 0.31 -4.87 119.36 122.96 1cot n ILE 29 Ca 0.09 -0.02 -0.28 0.00 1.00 0.00 0.00 62.75 63.54 1cot n ILE 29 Cb 0.48 -2.18 -0.16 0.00 -0.71 0.00 0.00 39.64 37.07 1cot n ILE 29 CO 0.00 0.00 0.00 -0.63 0.00 0.00 0.00 176.55 175.92 1cot s ILE 30 N -2.58 1.17 0.17 1.39 -1.09 -0.80 -4.98 121.20 114.47 1cot s ILE 30 Ca -0.29 -0.61 -0.30 0.00 -2.23 0.00 0.00 60.65 57.22 1cot s ILE 30 Cb 0.07 -1.30 -0.07 0.00 -1.58 0.00 0.00 42.46 39.58 1cot s ILE 30 CO 0.43 0.19 1.08 -0.75 -1.23 0.00 0.00 174.94 174.66 1cot s LYS 31 N 1.62 4.61 0.39 2.79 2.20 -1.26 -1.15 119.74 128.93 1cot s LYS 31 Ca 0.01 1.68 -0.11 0.00 -0.36 0.00 0.00 55.97 57.20 1cot s LYS 31 Cb -0.15 -3.29 0.04 0.00 -1.51 0.00 0.00 37.83 32.92 1cot s LYS 31 CO -0.08 0.09 0.70 0.41 -0.36 0.00 0.00 175.35 176.11 1cot n GLY 32 N 2.10 1.34 3.67 5.54 0.00 -1.26 -4.88 105.19 111.70 1cot n GLY 32 Ca 0.03 -1.38 -0.30 0.00 0.00 0.00 0.00 46.02 44.36 1cot n GLY 32 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1cot s GLY 33 N -3.14 1.64 0.00 -0.02 0.00 -0.06 -4.48 107.32 101.26 1cot s GLY 33 Ca 0.21 -1.10 0.03 0.00 0.00 0.00 0.00 44.72 43.86 1cot s GLY 33 CO 0.15 -0.20 1.01 0.58 0.00 0.00 0.00 173.10 174.63 1cot n LYS 34 N -4.60 2.45 -0.10 2.90 2.85 -1.25 -3.21 118.16 117.20 1cot n LYS 34 Ca 0.15 -1.52 0.02 0.00 -1.05 0.00 0.00 58.31 55.91 1cot n LYS 34 Cb 0.60 -1.08 0.32 0.00 -0.65 0.00 0.00 35.03 34.22 1cot n LYS 34 CO 0.00 0.00 0.00 1.15 -0.05 0.00 0.00 177.40 178.50 1cot h THR 35 N 0.60 1.16 -1.63 0.58 2.02 -1.80 -3.43 112.91 110.41 1cot h THR 35 Ca 0.00 -0.38 -0.56 0.00 0.77 0.00 0.00 66.41 66.24 1cot h THR 35 Cb 0.50 0.41 -0.08 0.00 -1.74 0.00 0.00 68.15 67.24 1cot h THR 35 CO 0.00 0.17 -0.50 -0.83 0.37 0.00 0.00 175.52 174.73 1cot s GLY 36 N -3.57 2.28 0.74 2.16 0.00 0.26 -5.04 107.32 104.15 1cot s GLY 36 Ca -0.09 -2.07 -0.11 0.00 0.00 0.00 0.00 44.72 42.44 1cot s GLY 36 CO 0.76 -1.89 1.09 -4.14 0.00 0.00 0.00 173.10 168.92 1cot s PRO 37 N -3.90 2.44 0.22 2.90 0.02 -1.26 -4.62 135.00 130.79 1cot s PRO 37 Ca 0.41 1.19 -0.30 0.00 0.02 0.00 0.00 61.00 62.31 1cot s PRO 37 Cb 0.03 -1.92 -0.10 0.00 0.02 0.00 0.00 34.50 32.53 1cot s PRO 37 CO 0.23 -1.50 1.45 1.21 -0.33 0.00 0.00 177.00 178.05 1cot s ASN 38 N -3.28 6.67 0.00 2.53 3.84 -1.26 -4.38 114.94 119.06 1cot s ASN 38 Ca 0.62 2.61 0.26 0.00 0.21 0.00 0.00 52.86 56.56 1cot s ASN 38 Cb -0.17 -2.61 0.59 0.00 -0.55 0.00 0.00 41.25 38.50 1cot s ASN 38 CO 0.53 -0.71 1.47 0.18 -2.79 0.00 0.00 177.10 175.79 1cot n LEU 39 N 2.78 1.93 -4.75 3.21 4.77 -0.26 -4.85 117.00 119.83 1cot n LEU 39 Ca 0.08 -0.64 -0.41 0.00 -0.03 0.00 0.00 56.01 55.01 1cot n LEU 39 Cb 0.40 -0.02 -0.02 0.00 -2.33 0.00 0.00 43.42 41.45 1cot n LEU 39 CO 0.60 0.33 1.17 -0.47 -1.33 0.00 0.00 177.39 177.70 1cot s TYR 40 N -2.16 2.82 -1.84 -1.77 6.14 -1.26 -1.63 117.35 117.65 1cot s TYR 40 Ca 0.30 0.95 0.00 0.00 0.64 0.00 0.00 57.07 58.95 1cot s TYR 40 Cb 0.20 -3.97 0.00 0.00 0.42 0.00 0.00 41.96 38.61 1cot s TYR 40 CO 0.39 -3.13 0.00 0.41 0.64 0.00 0.00 175.55 173.86 1cot n GLY 41 N 1.85 0.63 0.24 8.97 0.00 0.10 -4.90 105.19 112.08 1cot n GLY 41 Ca 0.06 -0.08 -0.03 0.00 0.00 0.00 0.00 46.02 45.98 1cot n GLY 41 CO 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 173.32 173.08 1cot h VAL 42 N 0.00 1.25 -2.94 1.61 3.04 -1.56 -3.34 116.25 114.31 1cot h VAL 42 Ca -0.43 -1.17 -0.54 0.00 -1.01 0.00 0.00 66.70 63.55 1cot h VAL 42 Cb 1.30 1.27 -0.00 0.00 -2.01 0.00 0.00 31.29 31.85 1cot h VAL 42 CO 0.56 0.37 0.81 -0.69 -1.01 0.00 0.00 177.57 177.61 1cot s VAL 43 N -4.59 3.75 0.00 1.51 1.01 -1.26 -1.60 120.40 119.22 1cot s VAL 43 Ca -0.07 1.14 0.00 0.00 0.00 0.00 0.00 61.98 63.05 1cot s VAL 43 Cb 0.14 -3.73 0.00 0.00 0.00 0.00 0.00 36.38 32.79 1cot s VAL 43 CO 0.78 0.01 0.00 0.61 0.00 0.00 0.00 175.10 176.50 1cot n GLY 44 N 3.60 1.23 3.80 4.51 0.00 0.62 -4.52 105.19 114.43 1cot n GLY 44 Ca 0.13 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.79 1cot n GLY 44 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1cot s ARG 45 N -0.53 4.35 0.37 1.61 3.52 -0.63 -4.63 118.95 123.01 1cot s ARG 45 Ca 0.00 1.02 -0.28 0.00 -0.13 0.00 0.00 55.73 56.34 1cot s ARG 45 Cb 0.00 -2.81 -0.11 0.00 -1.56 0.00 0.00 34.95 30.47 1cot s ARG 45 CO 0.00 0.33 1.49 0.21 -0.81 0.00 0.00 175.30 176.52 1cot s LYS 46 N -2.08 4.12 0.41 5.12 2.20 -1.26 -0.76 119.74 127.48 1cot s LYS 46 Ca 0.46 2.56 -0.25 0.00 -0.36 0.00 0.00 55.97 58.38 1cot s LYS 46 Cb -0.17 -2.98 -0.11 0.00 -1.51 0.00 0.00 37.83 33.07 1cot s LYS 46 CO 0.21 -0.53 1.16 -0.89 -0.36 0.00 0.00 175.35 174.94 1cot n ILE 47 N 0.65 2.44 -4.07 5.43 2.08 -0.92 -2.95 119.36 122.02 1cot n ILE 47 Ca 0.02 -0.50 -0.36 0.00 0.56 0.00 0.00 62.75 62.47 1cot n ILE 47 Cb 0.39 -1.38 -0.02 0.00 -0.75 0.00 0.00 39.64 37.88 1cot n ILE 47 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1cot n ALA 48 N -0.24 -2.31 0.01 -1.39 0.00 -1.26 -4.83 120.51 110.50 1cot n ALA 48 Ca 0.08 -0.43 0.02 0.00 0.00 0.00 0.00 53.44 53.11 1cot n ALA 48 Cb 0.39 -2.07 0.04 0.00 0.00 0.00 0.00 19.45 17.81 1cot n ALA 48 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1cot n SER 49 N -2.61 2.00 -4.70 0.00 3.41 -1.15 -5.01 113.62 105.56 1cot n SER 49 Ca -0.21 -1.72 -0.42 0.00 -0.26 0.00 0.00 58.87 56.25 1cot n SER 49 Cb 0.63 -0.05 -0.03 0.00 -0.26 0.00 0.00 64.21 64.50 1cot n SER 49 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 1cot s GLU 50 N -0.78 4.23 0.19 4.33 2.12 -1.26 -4.94 118.70 122.59 1cot s GLU 50 Ca 0.07 2.25 -0.30 0.00 0.36 0.00 0.00 54.97 57.34 1cot s GLU 50 Cb 0.04 -3.44 -0.09 0.00 0.26 0.00 0.00 34.13 30.90 1cot s GLU 50 CO 0.05 -0.64 1.37 -2.00 -0.54 0.00 0.00 175.26 173.51 1cot s GLU 51 N 2.02 4.33 0.00 4.30 2.12 -1.26 -2.52 118.70 127.69 1cot s GLU 51 Ca 0.70 2.13 0.00 0.00 0.36 0.00 0.00 54.97 58.16 1cot s GLU 51 Cb -0.39 -3.19 0.00 0.00 0.26 0.00 0.00 34.13 30.81 1cot s GLU 51 CO 0.31 -0.36 0.00 0.41 -0.54 0.00 0.00 175.26 175.08 1cot n GLY 52 N 2.69 2.38 3.72 -1.50 0.00 -1.26 -4.99 105.19 106.23 1cot n GLY 52 Ca 0.08 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.69 1cot n GLY 52 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1cot s PHE 53 N -2.94 3.66 -0.84 1.61 5.36 -1.05 -4.98 117.98 118.81 1cot s PHE 53 Ca 0.00 1.55 -0.18 0.00 -0.96 0.00 0.00 56.93 57.34 1cot s PHE 53 Cb 0.00 -2.99 0.14 0.00 -0.34 0.00 0.00 43.02 39.83 1cot s PHE 53 CO 0.00 0.07 0.98 0.15 -1.46 0.00 0.00 175.22 174.96 1cot s LYS 54 N 0.73 3.49 0.70 10.12 1.02 -1.26 -4.92 119.74 129.61 1cot s LYS 54 Ca 0.46 -1.78 -0.11 0.00 0.02 0.00 0.00 55.97 54.55 1cot s LYS 54 Cb -0.20 -4.67 0.01 0.00 -0.52 0.00 0.00 37.83 32.45 1cot s LYS 54 CO 0.25 -1.64 1.06 0.71 -0.92 0.00 0.00 175.35 174.81 1cot s TYR 55 N 2.23 3.12 0.81 3.18 2.02 -1.26 -5.04 117.35 122.42 1cot s TYR 55 Ca 0.26 1.39 -0.12 0.00 -0.37 0.00 0.00 57.07 58.23 1cot s TYR 55 Cb -0.10 -2.89 0.08 0.00 -0.40 0.00 0.00 41.96 38.66 1cot s TYR 55 CO -0.06 -1.24 1.12 0.20 -1.57 0.00 0.00 175.55 174.00 1cot s GLY 56 N -3.83 1.61 0.21 0.71 0.00 -1.26 -4.91 107.32 99.85 1cot s GLY 56 Ca 0.58 -0.36 -0.09 0.00 0.00 0.00 0.00 44.72 44.85 1cot s GLY 56 CO 0.55 0.10 1.82 0.83 0.00 0.00 0.00 173.10 176.40 1cot h GLU 57 N -1.13 1.09 0.02 2.90 4.39 -1.97 -2.72 114.58 117.16 1cot h GLU 57 Ca -0.48 -0.13 -0.00 0.00 0.34 0.00 0.00 59.36 59.09 1cot h GLU 57 Cb 1.29 -0.21 0.00 0.00 -0.10 0.00 0.00 28.75 29.73 1cot h GLU 57 CO 0.61 0.81 -0.01 0.78 -1.16 0.00 0.00 179.01 180.05 1cot h GLY 58 N 1.08 -0.02 1.84 -3.84 0.00 -1.75 -0.68 103.07 99.69 1cot h GLY 58 Ca 0.27 0.01 -0.10 0.00 0.00 0.00 0.00 47.33 47.51 1cot h GLY 58 CO -0.04 -0.01 -0.39 1.19 0.00 0.00 0.00 176.54 177.29 1cot h ILE 59 N -0.05 1.30 -0.38 2.60 2.10 -1.71 -1.07 117.51 120.30 1cot h ILE 59 Ca -0.00 -1.44 -0.10 0.00 1.08 0.00 0.00 64.86 64.40 1cot h ILE 59 Cb 0.04 1.67 -0.02 0.00 -1.09 0.00 0.00 36.82 37.42 1cot h ILE 59 CO 0.00 0.43 -0.16 -0.07 -1.08 0.00 0.00 178.15 177.27 1cot h LEU 60 N 0.15 0.68 -0.61 2.19 3.38 -1.32 -1.48 115.31 118.31 1cot h LEU 60 Ca 0.02 -0.21 -0.11 0.00 0.09 0.00 0.00 57.88 57.66 1cot h LEU 60 Cb 0.76 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.31 1cot h LEU 60 CO 0.06 0.85 -0.13 -0.08 0.09 0.00 0.00 178.44 179.23 1cot h GLU 61 N 0.62 0.96 -0.50 1.13 4.81 -0.43 -1.26 114.58 119.90 1cot h GLU 61 Ca 0.10 -0.36 0.00 0.00 -0.13 0.00 0.00 59.36 58.97 1cot h GLU 61 Cb 0.62 -0.06 -0.02 0.00 0.63 0.00 0.00 28.75 29.92 1cot h GLU 61 CO 0.04 1.03 0.32 0.28 -0.73 0.00 0.00 179.01 179.95 1cot h VAL 62 N 0.85 1.14 -0.60 0.32 2.07 -0.67 -0.20 116.25 119.17 1cot h VAL 62 Ca 0.13 -0.30 0.01 0.00 0.82 0.00 0.00 66.70 67.36 1cot h VAL 62 Cb 0.68 0.44 -0.03 0.00 -1.52 0.00 0.00 31.29 30.86 1cot h VAL 62 CO 0.05 0.14 0.39 0.00 0.02 0.00 0.00 177.57 178.17 1cot h ALA 63 N 1.16 0.77 -0.36 1.67 0.00 -0.96 0.05 119.26 121.59 1cot h ALA 63 Ca 0.18 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.04 1cot h ALA 63 Cb -0.04 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 1cot h ALA 63 CO -0.04 0.16 0.15 1.49 0.00 0.00 0.00 179.25 181.02 1cot h GLU 64 N 0.78 0.54 0.00 0.00 4.81 -0.96 -2.73 114.58 117.02 1cot h GLU 64 Ca 0.23 -0.09 -0.04 0.00 -0.13 0.00 0.00 59.36 59.32 1cot h GLU 64 Cb -0.05 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.24 1cot h GLU 64 CO -0.07 0.52 -0.20 0.87 -0.73 0.00 0.00 179.01 179.40 1cot h LYS 65 N 0.44 0.00 -2.42 1.92 1.57 -0.81 -3.36 116.57 113.90 1cot h LYS 65 Ca 0.12 0.00 -0.59 0.00 -1.87 0.00 0.00 60.65 58.31 1cot h LYS 65 Cb 0.17 0.00 -0.39 0.00 0.08 0.00 0.00 32.23 32.09 1cot h LYS 65 CO -0.01 0.20 -0.89 0.09 -0.57 0.00 0.00 179.45 178.26 1cot n ASN 66 N -3.28 0.67 0.24 0.86 3.02 -0.01 -4.98 115.26 111.76 1cot n ASN 66 Ca 0.01 -2.68 0.12 0.00 -0.03 0.00 0.00 54.58 51.99 1cot n ASN 66 Cb 0.46 -0.62 0.73 0.00 -0.61 0.00 0.00 39.78 39.74 1cot n ASN 66 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 1cot h PRO 67 N 5.15 0.00 -0.14 3.52 0.14 -1.66 -1.15 132.00 137.85 1cot h PRO 67 Ca 0.20 0.00 0.00 0.00 0.14 0.00 0.00 66.00 66.34 1cot h PRO 67 Cb 0.85 0.00 0.00 0.00 0.14 0.00 0.00 31.00 31.99 1cot h PRO 67 CO 0.49 0.00 0.00 -0.40 0.14 0.00 0.00 178.00 178.23 1cot n ASP 68 N -4.29 1.86 -4.69 1.44 5.75 -1.26 -4.89 116.55 110.47 1cot n ASP 68 Ca -0.01 -1.70 -0.42 0.00 -0.01 0.00 0.00 54.79 52.64 1cot n ASP 68 Cb 0.17 -0.09 -0.03 0.00 -1.03 0.00 0.00 41.12 40.14 1cot n ASP 68 CO 0.00 0.00 0.00 -0.22 -0.11 0.00 0.00 177.20 176.87 1cot s LEU 69 N -1.68 4.27 0.15 -2.12 2.96 -0.44 -5.01 118.68 116.80 1cot s LEU 69 Ca 0.34 1.78 0.09 0.00 -0.22 0.00 0.00 54.13 56.12 1cot s LEU 69 Cb 0.19 -3.56 -0.04 0.00 0.50 0.00 0.00 46.19 43.28 1cot s LEU 69 CO 0.29 -0.59 -0.20 0.42 -1.32 0.00 0.00 176.35 174.96 1cot s THR 70 N 2.29 1.83 0.03 3.68 -4.23 -1.26 -2.17 115.64 115.82 1cot s THR 70 Ca 0.55 -1.82 -0.30 0.00 -1.18 0.00 0.00 61.69 58.94 1cot s THR 70 Cb -0.24 -1.79 -0.06 0.00 1.34 0.00 0.00 72.50 71.76 1cot s THR 70 CO 0.21 -0.22 1.35 0.26 -0.54 0.00 0.00 174.62 175.68 1cot s TRP 71 N -1.76 3.07 0.28 3.99 0.52 0.06 -4.85 118.94 120.24 1cot s TRP 71 Ca 0.13 0.96 0.08 0.00 0.02 0.00 0.00 56.10 57.29 1cot s TRP 71 Cb -0.07 -3.61 -0.04 0.00 -1.15 0.00 0.00 33.47 28.60 1cot s TRP 71 CO 0.06 -2.15 0.18 0.95 0.02 0.00 0.00 176.95 176.01 1cot s THR 72 N 1.86 3.99 0.23 2.01 -4.23 -1.26 -0.28 115.64 117.96 1cot s THR 72 Ca 0.63 -1.50 -0.07 0.00 -1.18 0.00 0.00 61.69 59.56 1cot s THR 72 Cb -0.32 -3.23 0.21 0.00 1.34 0.00 0.00 72.50 70.50 1cot s THR 72 CO 0.27 -0.31 1.89 -0.33 -0.54 0.00 0.00 174.62 175.61 1cot h GLU 73 N 1.51 1.10 -0.49 3.99 5.08 -1.96 0.07 114.58 123.87 1cot h GLU 73 Ca -0.47 -0.07 -0.00 0.00 -1.00 0.00 0.00 59.36 57.83 1cot h GLU 73 Cb 1.24 -0.25 -0.02 0.00 0.50 0.00 0.00 28.75 30.22 1cot h GLU 73 CO 0.60 0.73 0.30 0.00 -1.00 0.00 0.00 179.01 179.64 1cot h ALA 74 N 1.34 0.62 -0.61 3.43 0.00 -1.99 -0.13 119.26 121.93 1cot h ALA 74 Ca 0.34 -0.06 -0.08 0.00 0.00 0.00 0.00 54.91 55.11 1cot h ALA 74 Cb -0.05 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.51 1cot h ALA 74 CO -0.10 0.10 0.07 -0.44 0.00 0.00 0.00 179.25 178.88 1cot h ASP 75 N 0.66 0.98 -0.63 0.00 5.19 -1.87 -1.45 116.42 119.30 1cot h ASP 75 Ca 0.18 -0.24 -0.03 0.00 -0.62 0.00 0.00 57.03 56.32 1cot h ASP 75 Cb -0.02 -0.26 -0.03 0.00 0.18 0.00 0.00 39.33 39.20 1cot h ASP 75 CO -0.03 0.99 0.28 -0.07 -3.12 0.00 0.00 179.24 177.29 1cot h LEU 76 N 0.95 0.84 -0.53 1.55 3.38 -0.52 0.95 115.31 121.93 1cot h LEU 76 Ca 0.18 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 58.00 1cot h LEU 76 Cb 0.45 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.96 1cot h LEU 76 CO 0.02 0.76 0.31 0.40 0.09 0.00 0.00 178.44 180.02 1cot h ILE 77 N 0.87 1.17 -0.06 1.22 2.04 -0.67 -0.98 117.51 121.10 1cot h ILE 77 Ca 0.21 -0.39 -0.00 0.00 1.00 0.00 0.00 64.86 65.68 1cot h ILE 77 Cb 0.16 0.46 -0.00 0.00 -0.74 0.00 0.00 36.82 36.70 1cot h ILE 77 CO -0.02 0.17 0.03 -0.08 0.00 0.00 0.00 178.15 178.25 1cot h GLU 78 N 0.71 0.09 -0.28 2.37 4.81 -0.79 -2.70 114.58 118.78 1cot h GLU 78 Ca 0.19 -0.01 0.01 0.00 -0.13 0.00 0.00 59.36 59.42 1cot h GLU 78 Cb 0.01 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.35 1cot h GLU 78 CO -0.03 0.19 0.16 -0.92 -0.73 0.00 0.00 179.01 177.68 1cot h TYR 79 N -0.04 0.29 0.00 0.92 3.20 -0.64 -2.38 116.97 118.32 1cot h TYR 79 Ca 0.02 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.90 1cot h TYR 79 Cb 0.14 -0.09 0.00 0.00 1.54 0.00 0.00 36.73 38.31 1cot h TYR 79 CO -0.03 0.17 0.00 -0.39 -1.64 0.00 0.00 178.16 176.27 1cot h VAL 80 N 0.32 0.00 -0.68 1.81 -1.51 -1.18 -0.93 116.25 114.08 1cot h VAL 80 Ca 0.11 -0.31 -0.03 0.00 -1.23 0.00 0.00 66.70 65.24 1cot h VAL 80 Cb 0.01 1.20 -0.03 0.00 -2.13 0.00 0.00 31.29 30.34 1cot h VAL 80 CO -0.06 0.00 0.31 0.74 -1.23 0.00 0.00 177.57 177.34 1cot h THR 81 N 0.00 1.23 -0.15 7.19 2.02 -1.08 0.27 112.91 122.39 1cot h THR 81 Ca 0.00 -0.67 0.25 0.00 0.77 0.00 0.00 66.41 66.76 1cot h THR 81 Cb 0.34 0.41 -0.19 0.00 -1.74 0.00 0.00 68.15 66.98 1cot h THR 81 CO 0.00 0.28 0.08 -0.62 0.37 0.00 0.00 175.52 175.63 1cot s ASP 82 N -6.12 -0.24 0.33 4.18 -1.08 -0.74 -2.88 116.67 110.11 1cot s ASP 82 Ca -0.13 0.05 0.06 0.00 -0.52 0.00 0.00 52.55 52.01 1cot s ASP 82 Cb 0.14 1.16 0.70 0.00 -1.46 0.00 0.00 42.92 43.47 1cot s ASP 82 CO 0.80 -0.04 1.86 -0.65 0.52 0.00 0.00 175.17 177.66 1cot h PRO 83 N 7.35 0.80 -0.07 4.34 0.11 -1.43 -3.23 132.00 139.87 1cot h PRO 83 Ca -0.11 -0.05 0.02 0.00 0.11 0.00 0.00 66.00 65.97 1cot h PRO 83 Cb 1.17 -0.18 -0.03 0.00 0.11 0.00 0.00 31.00 32.07 1cot h PRO 83 CO -0.14 0.53 -0.28 -0.22 -0.21 0.00 0.00 178.00 177.68 1cot h LYS 84 N 0.82 -0.29 -0.27 1.05 1.63 -1.87 0.07 116.57 117.72 1cot h LYS 84 Ca 0.46 0.02 -0.01 0.00 -0.85 0.00 0.00 60.65 60.27 1cot h LYS 84 Cb 0.59 0.07 -0.01 0.00 -0.60 0.00 0.00 32.23 32.27 1cot h LYS 84 CO -0.22 -0.19 0.13 -1.35 -3.45 0.00 0.00 179.45 174.36 1cot h PRO 85 N -0.30 0.36 -0.26 1.90 0.10 -1.97 -0.98 132.00 130.85 1cot h PRO 85 Ca 0.02 -0.03 -0.01 0.00 0.10 0.00 0.00 66.00 66.07 1cot h PRO 85 Cb 0.35 -0.08 -0.01 0.00 0.10 0.00 0.00 31.00 31.36 1cot h PRO 85 CO -0.22 0.28 0.10 2.35 0.10 0.00 0.00 178.00 180.61 1cot h TRP 86 N 0.37 0.39 -0.71 0.65 7.01 -1.47 0.42 115.95 122.61 1cot h TRP 86 Ca 0.10 -0.03 -0.03 0.00 2.11 0.00 0.00 58.89 61.03 1cot h TRP 86 Cb 0.04 -0.12 -0.03 0.00 -2.10 0.00 0.00 29.16 26.95 1cot h TRP 86 CO 0.00 0.40 0.31 -0.07 -2.79 0.00 0.00 178.44 176.29 1cot h LEU 87 N 0.26 0.96 -0.59 0.65 3.38 -0.28 -0.47 115.31 119.22 1cot h LEU 87 Ca 0.09 -0.16 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 1cot h LEU 87 Cb 0.18 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.65 1cot h LEU 87 CO -0.01 0.85 0.35 0.58 0.09 0.00 0.00 178.44 180.30 1cot h VAL 88 N 1.00 1.18 -0.03 1.22 2.07 -0.90 -1.46 116.25 119.34 1cot h VAL 88 Ca 0.24 -0.42 0.01 0.00 0.82 0.00 0.00 66.70 67.36 1cot h VAL 88 Cb 0.17 0.39 -0.02 0.00 -1.52 0.00 0.00 31.29 30.31 1cot h VAL 88 CO -0.02 0.19 -0.05 0.50 0.02 0.00 0.00 177.57 178.20 1cot h LYS 89 N 0.80 -0.08 0.00 1.57 3.64 -0.48 0.70 116.57 122.72 1cot h LYS 89 Ca 0.21 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.60 1cot h LYS 89 Cb -0.00 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 31.83 1cot h LYS 89 CO -0.04 -0.05 0.00 0.52 -2.27 0.00 0.00 179.45 177.61 1cot h MET 90 N -0.08 0.00 0.00 1.90 2.86 -0.87 -3.22 114.93 115.52 1cot h MET 90 Ca 0.03 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.67 1cot h MET 90 Cb 0.13 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.79 1cot h MET 90 CO -0.08 0.00 -0.69 0.25 1.06 0.00 0.00 176.91 177.45 1cot n THR 91 N -2.47 0.00 -2.11 2.22 -2.24 -0.57 -4.77 114.28 104.33 1cot n THR 91 Ca 0.03 -0.26 -0.18 0.00 -2.27 0.00 0.00 64.05 61.37 1cot n THR 91 Cb 0.34 0.71 -0.03 0.00 -2.10 0.00 0.00 70.33 69.25 1cot n THR 91 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1cot n ASP 92 N -1.37 -5.29 -4.05 3.42 8.00 0.24 -4.94 116.55 112.56 1cot n ASP 92 Ca 0.00 0.12 -0.32 0.00 0.71 0.00 0.00 54.79 55.30 1cot n ASP 92 Cb 0.09 -4.37 -0.15 0.00 -0.02 0.00 0.00 41.12 36.67 1cot n ASP 92 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1cot s ASP 93 N -2.35 4.41 0.54 -2.24 2.15 -1.09 -4.96 116.67 113.12 1cot s ASP 93 Ca 0.00 -1.46 0.27 0.00 0.43 0.00 0.00 52.55 51.79 1cot s ASP 93 Cb 0.00 -1.51 1.43 0.00 -0.30 0.00 0.00 42.92 42.54 1cot s ASP 93 CO 0.00 -0.22 1.97 0.50 -0.17 0.00 0.00 175.17 177.25 1cot h LYS 94 N 7.78 0.00 -0.49 4.34 3.64 -1.92 0.43 116.57 130.35 1cot h LYS 94 Ca -0.17 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.21 1cot h LYS 94 Cb 1.04 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.86 1cot h LYS 94 CO 0.46 0.00 0.00 0.41 -2.27 0.00 0.00 179.45 178.05 1cot n GLY 95 N -1.65 1.52 3.66 5.01 0.00 -1.26 -4.97 105.19 107.51 1cot n GLY 95 Ca 0.11 -0.62 -0.61 0.00 0.00 0.00 0.00 46.02 44.90 1cot n GLY 95 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1cot n ALA 96 N 1.14 -1.54 -2.67 4.61 0.00 0.15 -4.92 120.51 117.28 1cot n ALA 96 Ca 0.19 0.50 -0.37 0.00 0.00 0.00 0.00 53.44 53.75 1cot n ALA 96 Cb 0.49 -1.98 -0.06 0.00 0.00 0.00 0.00 19.45 17.90 1cot n ALA 96 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1cot s LYS 97 N 2.13 3.70 -0.03 0.00 1.02 -1.26 -4.84 119.74 120.46 1cot s LYS 97 Ca 0.98 0.16 0.06 0.00 0.02 0.00 0.00 55.97 57.19 1cot s LYS 97 Cb -1.27 -3.19 -0.02 0.00 -0.52 0.00 0.00 37.83 32.82 1cot s LYS 97 CO 0.68 0.72 -0.21 -0.08 -0.92 0.00 0.00 175.35 175.54 1cot s THR 98 N -1.08 2.45 -0.54 2.17 -1.32 -1.26 -1.99 115.64 114.07 1cot s THR 98 Ca 0.21 -0.96 0.23 0.00 -1.21 0.00 0.00 61.69 59.96 1cot s THR 98 Cb -0.15 -1.90 -0.02 0.00 -1.51 0.00 0.00 72.50 68.93 1cot s THR 98 CO 0.10 0.58 1.16 0.29 -2.21 0.00 0.00 174.62 174.54 1cot n LYS 99 N 2.38 0.36 -3.52 7.08 5.02 -1.26 -4.68 118.16 123.54 1cot n LYS 99 Ca -0.16 0.06 -0.42 0.00 -2.02 0.00 0.00 58.31 55.77 1cot n LYS 99 Cb 0.51 -1.68 -0.09 0.00 -0.02 0.00 0.00 35.03 33.75 1cot n LYS 99 CO 0.00 0.00 0.00 1.41 -0.52 0.00 0.00 177.40 178.29 1cot s MET 100 N -3.22 2.79 0.02 1.97 1.75 -1.26 -4.91 119.30 116.44 1cot s MET 100 Ca 0.04 -1.34 0.23 0.00 -1.25 0.00 0.00 55.69 53.37 1cot s MET 100 Cb 0.13 -3.91 0.04 0.00 2.84 0.00 0.00 34.83 33.93 1cot s MET 100 CO 0.76 -0.93 1.05 0.25 -0.65 0.00 0.00 175.02 175.50 1cot n THR 101 N 5.05 0.06 -1.80 10.11 -2.24 -1.26 -4.65 114.28 119.55 1cot n THR 101 Ca -0.11 -0.11 -0.41 0.00 -2.27 0.00 0.00 64.05 61.14 1cot n THR 101 Cb 0.44 0.49 -0.01 0.00 -2.10 0.00 0.00 70.33 69.14 1cot n THR 101 CO 0.00 0.00 0.00 0.12 -0.57 0.00 0.00 175.07 174.62 1cot s PHE 102 N -3.10 2.73 0.04 4.78 5.36 -1.26 -4.91 117.98 121.63 1cot s PHE 102 Ca 0.06 0.90 0.07 0.00 -0.96 0.00 0.00 56.93 57.00 1cot s PHE 102 Cb 0.16 -4.04 -0.02 0.00 -0.34 0.00 0.00 43.02 38.77 1cot s PHE 102 CO 0.81 -3.37 -0.20 0.15 -1.46 0.00 0.00 175.22 171.14 1cot s LYS 103 N -0.90 1.38 -0.28 10.12 1.02 -1.26 -4.51 119.74 125.30 1cot s LYS 103 Ca 0.60 -0.91 0.02 0.00 0.02 0.00 0.00 55.97 55.70 1cot s LYS 103 Cb -0.47 -1.48 0.08 0.00 -0.52 0.00 0.00 37.83 35.44 1cot s LYS 103 CO 0.51 0.38 -0.02 1.41 -0.92 0.00 0.00 175.35 176.71 1cot s MET 104 N -1.12 1.68 0.00 1.68 1.75 0.95 -4.99 119.30 119.24 1cot s MET 104 Ca 0.07 -1.38 0.27 0.00 -1.25 0.00 0.00 55.69 53.41 1cot s MET 104 Cb -0.09 -2.81 0.93 0.00 2.84 0.00 0.00 34.83 35.70 1cot s MET 104 CO 0.02 -0.73 1.69 0.41 -0.65 0.00 0.00 175.02 175.75 1cot n GLY 105 N 4.49 -1.11 3.32 2.11 0.00 -1.26 -3.85 105.19 108.89 1cot n GLY 105 Ca -0.07 -0.28 -0.11 0.00 0.00 0.00 0.00 46.02 45.56 1cot n GLY 105 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1cot s LYS 106 N -2.76 1.04 -1.64 1.61 -2.85 -1.26 -4.91 119.74 108.98 1cot s LYS 106 Ca 0.19 -0.62 0.00 0.00 -1.00 0.00 0.00 55.97 54.54 1cot s LYS 106 Cb 0.19 0.46 0.00 0.00 -2.06 0.00 0.00 37.83 36.42 1cot s LYS 106 CO 0.57 -0.40 0.00 0.09 0.10 0.00 0.00 175.35 175.71 1cot n ASN 107 N -0.06 -4.92 -0.22 0.03 3.02 -1.26 -4.90 115.26 106.95 1cot n ASN 107 Ca -0.17 0.30 -0.05 0.00 -0.03 0.00 0.00 54.58 54.63 1cot n ASN 107 Cb 0.63 -3.90 0.05 0.00 -0.61 0.00 0.00 39.78 35.95 1cot n ASN 107 CO 0.00 0.00 0.00 1.56 -2.62 0.00 0.00 177.26 176.20 1cot h GLN 108 N 0.00 0.80 -0.45 3.52 7.50 -1.91 -2.68 115.11 121.89 1cot h GLN 108 Ca -0.35 -0.05 -0.00 0.00 0.50 0.00 0.00 58.65 58.75 1cot h GLN 108 Cb 1.11 -0.18 -0.02 0.00 0.05 0.00 0.00 27.48 28.44 1cot h GLN 108 CO 0.48 0.53 0.27 0.00 -1.50 0.00 0.00 178.83 178.61 1cot h ALA 109 N 1.24 1.62 -0.05 3.87 0.00 -1.94 -0.81 119.26 123.19 1cot h ALA 109 Ca 0.24 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 1cot h ALA 109 Cb -0.07 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.54 1cot h ALA 109 CO -0.06 0.33 -0.01 -0.44 0.00 0.00 0.00 179.25 179.06 1cot h ASP 110 N 0.62 0.10 -0.75 0.00 3.32 -1.74 0.56 116.42 118.54 1cot h ASP 110 Ca 0.16 -0.38 -0.03 0.00 0.02 0.00 0.00 57.03 56.81 1cot h ASP 110 Cb -0.02 -0.03 -0.04 0.00 0.22 0.00 0.00 39.33 39.47 1cot h ASP 110 CO -0.03 0.46 0.36 1.62 -1.72 0.00 0.00 179.24 179.93 1cot h VAL 111 N -0.25 1.24 -0.58 -1.35 3.04 -1.28 -1.74 116.25 115.33 1cot h VAL 111 Ca 0.01 -0.68 -0.07 0.00 -1.01 0.00 0.00 66.70 64.96 1cot h VAL 111 Cb 0.41 0.27 -0.02 0.00 -2.01 0.00 0.00 31.29 29.94 1cot h VAL 111 CO 0.01 0.29 0.09 0.58 -1.01 0.00 0.00 177.57 177.52 1cot h VAL 112 N 1.08 1.25 -0.85 1.51 2.07 -1.00 -1.15 116.25 119.16 1cot h VAL 112 Ca 0.26 -0.96 0.00 0.00 0.82 0.00 0.00 66.70 66.82 1cot h VAL 112 Cb 0.11 0.71 -0.04 0.00 -1.52 0.00 0.00 31.29 30.55 1cot h VAL 112 CO -0.03 0.35 0.54 0.00 0.02 0.00 0.00 177.57 178.45 1cot h ALA 113 N 1.21 1.36 -0.31 1.67 0.00 -0.15 0.62 119.26 123.65 1cot h ALA 113 Ca 0.18 -0.07 -0.15 0.00 0.00 0.00 0.00 54.91 54.87 1cot h ALA 113 Cb 0.40 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1cot h ALA 113 CO 0.01 0.58 -0.41 0.35 0.00 0.00 0.00 179.25 179.78 1cot h PHE 114 N 1.16 0.90 -0.51 0.00 3.57 -0.81 -0.58 116.94 120.67 1cot h PHE 114 Ca 0.31 -0.27 -0.05 0.00 3.53 0.00 0.00 57.97 61.49 1cot h PHE 114 Cb -0.10 -0.19 -0.02 0.00 2.79 0.00 0.00 35.95 38.43 1cot h PHE 114 CO 0.00 1.03 0.11 -0.07 -2.23 0.00 0.00 178.31 177.15 1cot h LEU 115 N 0.61 0.73 -0.76 0.59 3.38 -0.24 -2.20 115.31 117.42 1cot h LEU 115 Ca 0.05 -0.13 -0.09 0.00 0.09 0.00 0.00 57.88 57.79 1cot h LEU 115 Cb 0.96 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.50 1cot h LEU 115 CO 0.09 0.73 -0.04 0.00 0.09 0.00 0.00 178.44 179.31 1cot h ALA 116 N 1.36 0.96 -0.31 1.53 0.00 -0.47 -1.89 119.26 120.45 1cot h ALA 116 Ca 0.17 -0.30 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 1cot h ALA 116 Cb 0.30 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 1cot h ALA 116 CO 0.00 0.62 0.15 0.37 0.00 0.00 0.00 179.25 180.40 1cot h GLN 117 N 0.82 0.43 -0.81 0.00 4.15 -0.57 -1.12 115.11 118.00 1cot h GLN 117 Ca 0.15 -0.04 -0.12 0.00 0.77 0.00 0.00 58.65 59.40 1cot h GLN 117 Cb 0.55 -0.09 -0.07 0.00 0.21 0.00 0.00 27.48 28.08 1cot h GLN 117 CO 0.03 0.33 0.15 0.09 -1.93 0.00 0.00 178.83 177.51 1cot n ASN 118 N -4.44 4.02 -3.12 -0.69 3.02 -0.74 -4.13 115.26 109.18 1cot n ASN 118 Ca 0.02 -2.80 -0.21 0.00 -0.03 0.00 0.00 54.58 51.55 1cot n ASN 118 Cb 0.11 -0.67 -0.04 0.00 -0.61 0.00 0.00 39.78 38.58 1cot n ASN 118 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 1cot n SER 119 N 0.07 1.93 0.03 6.41 7.64 -0.42 -0.72 113.62 128.55 1cot n SER 119 Ca 0.27 -3.20 0.17 0.00 1.01 0.00 0.00 58.87 57.11 1cot n SER 119 Cb 1.04 -0.61 0.65 0.00 -1.01 0.00 0.00 64.21 64.28 1cot n SER 119 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 1cot h PRO 120 N 3.08 0.07 -0.66 1.43 0.13 -1.72 -0.80 132.00 133.54 1cot h PRO 120 Ca 0.11 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 1cot h PRO 120 Cb 0.82 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 31.93 1cot h PRO 120 CO 0.60 0.05 0.00 -0.25 -0.23 0.00 0.00 178.00 178.17 1cot n ASP 121 N -4.42 4.72 0.00 1.44 8.00 -1.26 -5.16 116.55 119.86 1cot n ASP 121 Ca 0.08 -2.41 0.03 0.00 0.71 0.00 0.00 54.79 53.19 1cot n ASP 121 Cb 0.48 -0.57 0.18 0.00 -0.02 0.00 0.00 41.12 41.18 1cot n ASP 121 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81