#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ook s LYS 5 N 0.00 3.85 -0.07 1.64 1.02 -1.26 -5.09 119.74 119.83 2ook s LYS 5 Ca 0.00 0.32 0.01 0.00 0.02 0.00 0.00 55.97 56.31 2ook s LYS 5 Cb 0.00 -3.14 0.02 0.00 -0.52 0.00 0.00 37.83 34.19 2ook s LYS 5 CO 0.00 0.65 -0.06 -1.01 -0.92 0.00 0.00 175.35 174.01 2ook s HIS 6 N -1.18 1.05 -4.96 3.18 3.76 -1.26 -3.78 115.29 112.09 2ook s HIS 6 Ca 0.26 -0.39 0.00 0.00 -0.15 0.00 0.00 55.06 54.78 2ook s HIS 6 Cb -0.16 -0.91 0.00 0.00 1.11 0.00 0.00 32.58 32.63 2ook s HIS 6 CO 0.14 -0.31 0.00 0.41 -0.85 0.00 0.00 174.74 174.13 2ook n GLY 7 N 4.42 -0.49 3.19 -2.22 0.00 0.18 -4.98 105.19 105.28 2ook n GLY 7 Ca -0.18 -1.06 -0.13 0.00 0.00 0.00 0.00 46.02 44.66 2ook n GLY 7 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ook s LEU 8 N 0.00 1.03 0.12 0.99 1.43 -1.26 -0.98 118.68 120.01 2ook s LEU 8 Ca 0.00 0.19 0.06 0.00 -1.03 0.00 0.00 54.13 53.35 2ook s LEU 8 Cb 0.00 1.03 -0.04 0.00 0.03 0.00 0.00 46.19 47.22 2ook s LEU 8 CO 0.00 -0.31 -0.15 -0.94 0.23 0.00 0.00 176.35 175.18 2ook s SER 9 N -0.83 2.12 0.00 2.29 1.04 -0.34 -4.98 113.70 113.01 2ook s SER 9 Ca -0.09 -0.78 0.03 0.00 0.48 0.00 0.00 55.95 55.59 2ook s SER 9 Cb -0.05 -0.09 -0.01 0.00 0.10 0.00 0.00 66.02 65.97 2ook s SER 9 CO 0.02 -0.10 -0.11 -0.51 0.98 0.00 0.00 173.24 173.53 2ook s ILE 10 N -1.90 0.85 0.25 -1.02 2.07 -1.26 -1.61 121.20 118.58 2ook s ILE 10 Ca 0.08 -0.59 -0.06 0.00 -1.41 0.00 0.00 60.65 58.67 2ook s ILE 10 Cb -0.06 -0.73 0.03 0.00 0.13 0.00 0.00 42.46 41.82 2ook s ILE 10 CO 0.04 0.15 0.45 0.61 -1.91 0.00 0.00 174.94 174.27 2ook n GLY 11 N 2.56 1.76 3.01 1.50 0.00 0.81 -4.98 105.19 109.85 2ook n GLY 11 Ca -0.15 -1.31 -0.28 0.00 0.00 0.00 0.00 46.02 44.28 2ook n GLY 11 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2ook s ILE 12 N -2.52 1.33 0.22 -0.61 1.01 -1.26 -0.71 121.20 118.66 2ook s ILE 12 Ca 0.14 -0.53 0.11 0.00 0.00 0.00 0.00 60.65 60.38 2ook s ILE 12 Cb -0.02 -1.24 -0.05 0.00 0.01 0.00 0.00 42.46 41.16 2ook s ILE 12 CO 0.10 0.41 -0.22 0.20 0.00 0.00 0.00 174.94 175.43 2ook s ASN 13 N 1.16 3.53 -0.07 3.58 0.02 -0.48 -4.94 114.94 117.74 2ook s ASN 13 Ca -0.04 -0.90 0.05 0.00 -1.02 0.00 0.00 52.86 50.95 2ook s ASN 13 Cb -0.14 -0.30 -0.01 0.00 0.02 0.00 0.00 41.25 40.83 2ook s ASN 13 CO -0.03 0.09 -0.23 -0.60 0.02 0.00 0.00 177.10 176.35 2ook s ARG 14 N -2.95 2.50 -0.13 -0.60 3.52 -1.26 -0.49 118.95 119.54 2ook s ARG 14 Ca 0.24 -0.83 0.02 0.00 -0.13 0.00 0.00 55.73 55.03 2ook s ARG 14 Cb -0.07 -2.06 0.00 0.00 -1.56 0.00 0.00 34.95 31.26 2ook s ARG 14 CO 0.12 0.30 -0.21 0.42 -0.81 0.00 0.00 175.30 175.12 2ook s ILE 15 N 0.02 2.23 0.00 4.11 1.01 -0.86 -4.95 121.20 122.76 2ook s ILE 15 Ca -0.08 -0.93 0.00 0.00 0.00 0.00 0.00 60.65 59.64 2ook s ILE 15 Cb -0.14 -1.89 0.00 0.00 0.01 0.00 0.00 42.46 40.43 2ook s ILE 15 CO 0.05 0.54 0.00 -1.84 0.00 0.00 0.00 174.94 173.69 2ook n GLU 16 N 3.90 0.00 -0.16 2.79 0.28 -1.26 -1.36 120.64 124.83 2ook n GLU 16 Ca -0.19 0.00 0.06 0.00 -0.16 0.00 0.00 57.16 56.86 2ook n GLU 16 Cb 0.52 0.00 0.14 0.00 1.43 0.00 0.00 31.44 33.53 2ook n GLU 16 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 177.13 175.84 2ook n SER 17 N 5.33 2.85 -4.26 -1.84 3.41 -1.26 -4.97 113.62 112.88 2ook n SER 17 Ca 0.00 -1.96 -0.35 0.00 -0.26 0.00 0.00 58.87 56.30 2ook n SER 17 Cb 0.00 -0.21 -0.14 0.00 -0.26 0.00 0.00 64.21 63.59 2ook n SER 17 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 2ook s VAL 18 N -0.99 3.12 0.16 -3.33 1.01 -0.46 -5.10 120.40 114.80 2ook s VAL 18 Ca 0.22 -0.68 -0.27 0.00 0.00 0.00 0.00 61.98 61.26 2ook s VAL 18 Cb 0.12 -2.46 -0.08 0.00 0.00 0.00 0.00 36.38 33.96 2ook s VAL 18 CO 0.16 0.37 0.82 -0.36 0.00 0.00 0.00 175.10 176.09 2ook s PHE 19 N 1.42 3.89 0.04 5.22 0.08 -1.26 -2.03 117.98 125.35 2ook s PHE 19 Ca 0.04 1.68 0.01 0.00 0.12 0.00 0.00 56.93 58.79 2ook s PHE 19 Cb -0.15 -2.85 -0.03 0.00 -0.57 0.00 0.00 43.02 39.43 2ook s PHE 19 CO -0.05 0.44 -0.06 -0.59 -0.10 0.00 0.00 175.22 174.86 2ook s PHE 20 N -0.87 0.57 0.32 0.36 -0.71 0.36 -4.64 117.98 113.36 2ook s PHE 20 Ca 0.38 -0.63 -0.26 0.00 -1.04 0.00 0.00 56.93 55.39 2ook s PHE 20 Cb -0.23 -0.36 -0.10 0.00 -1.21 0.00 0.00 43.02 41.12 2ook s PHE 20 CO 0.27 -0.15 0.93 0.08 -1.34 0.00 0.00 175.22 175.01 2ook s VAL 21 N -1.98 4.23 -0.03 -2.49 1.01 0.07 -1.38 120.40 119.82 2ook s VAL 21 Ca -0.07 1.80 0.04 0.00 0.00 0.00 0.00 61.98 63.75 2ook s VAL 21 Cb -0.06 -4.00 -0.01 0.00 0.00 0.00 0.00 36.38 32.31 2ook s VAL 21 CO -0.02 0.15 -0.15 0.28 0.00 0.00 0.00 175.10 175.35 2ook s THR 22 N -1.61 1.26 -0.02 3.92 -1.32 0.11 -0.59 115.64 117.39 2ook s THR 22 Ca 0.50 -0.65 0.00 0.00 -1.21 0.00 0.00 61.69 60.33 2ook s THR 22 Cb -0.19 -1.07 0.02 0.00 -1.51 0.00 0.00 72.50 69.76 2ook s THR 22 CO 0.24 0.36 0.02 -0.22 -2.21 0.00 0.00 174.62 172.80 2ook s LEU 23 N -0.13 1.23 -0.09 9.08 2.96 -0.08 -0.13 118.68 131.52 2ook s LEU 23 Ca 0.01 0.01 0.03 0.00 -0.22 0.00 0.00 54.13 53.96 2ook s LEU 23 Cb -0.09 -0.11 0.01 0.00 0.50 0.00 0.00 46.19 46.49 2ook s LEU 23 CO 0.01 -0.10 -0.20 -0.75 -1.32 0.00 0.00 176.35 173.99 2ook s LYS 24 N 0.90 2.59 -0.08 1.98 2.20 -0.64 -0.20 119.74 126.50 2ook s LYS 24 Ca -0.08 -0.72 0.04 0.00 -0.36 0.00 0.00 55.97 54.85 2ook s LYS 24 Cb -0.11 -2.01 -0.01 0.00 -1.51 0.00 0.00 37.83 34.18 2ook s LYS 24 CO -0.02 0.11 -0.22 0.00 -0.36 0.00 0.00 175.35 174.85 2ook s ALA 25 N 0.50 2.27 0.02 3.13 0.00 -0.94 -1.20 121.76 125.55 2ook s ALA 25 Ca -0.16 -1.00 0.02 0.00 0.00 0.00 0.00 51.96 50.82 2ook s ALA 25 Cb -0.17 -0.81 -0.02 0.00 0.00 0.00 0.00 23.12 22.12 2ook s ALA 25 CO 0.06 0.36 -0.06 0.96 0.00 0.00 0.00 175.76 177.09 2ook s ILE 26 N 0.03 0.40 0.00 0.00 -4.36 -0.15 -2.96 121.20 114.16 2ook s ILE 26 Ca -0.08 -0.73 0.00 0.00 -0.26 0.00 0.00 60.65 59.57 2ook s ILE 26 Cb -0.15 -0.44 0.00 0.00 1.25 0.00 0.00 42.46 43.12 2ook s ILE 26 CO 0.05 -0.23 0.00 0.61 0.24 0.00 0.00 174.94 175.61 2ook n GLY 27 N 2.02 -0.13 3.11 6.27 0.00 -0.34 -0.65 105.19 115.48 2ook n GLY 27 Ca -0.19 -1.00 -0.33 0.00 0.00 0.00 0.00 46.02 44.50 2ook n GLY 27 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2ook s THR 28 N 0.00 2.33 -0.01 2.61 2.01 -1.26 -0.73 115.64 120.59 2ook s THR 28 Ca 0.00 -1.33 -0.25 0.00 0.31 0.00 0.00 61.69 60.43 2ook s THR 28 Cb 0.00 -2.24 -0.04 0.00 0.01 0.00 0.00 72.50 70.23 2ook s THR 28 CO 0.00 0.15 0.76 -0.76 -0.69 0.00 0.00 174.62 174.08 2ook s LEU 29 N 1.20 4.38 0.44 4.42 1.43 -0.40 -4.90 118.68 125.25 2ook s LEU 29 Ca -0.03 1.35 0.07 0.00 -1.03 0.00 0.00 54.13 54.49 2ook s LEU 29 Cb -0.18 -3.20 -0.02 0.00 0.03 0.00 0.00 46.19 42.83 2ook s LEU 29 CO -0.07 -0.08 0.32 0.42 0.23 0.00 0.00 176.35 177.17 2ook s THR 30 N 0.46 2.35 0.20 5.49 -4.23 -1.26 -0.80 115.64 117.85 2ook s THR 30 Ca 0.40 -1.49 -0.09 0.00 -1.18 0.00 0.00 61.69 59.33 2ook s THR 30 Cb -0.19 -2.84 0.14 0.00 1.34 0.00 0.00 72.50 70.95 2ook s THR 30 CO 0.21 0.00 1.77 -0.74 -0.54 0.00 0.00 174.62 175.32 2ook h HIS 31 N 1.11 1.14 -0.86 3.99 2.76 -1.96 -1.91 115.15 119.42 2ook h HIS 31 Ca -0.41 -0.08 0.07 0.00 -2.20 0.00 0.00 60.37 57.74 2ook h HIS 31 Cb 1.27 -0.34 -0.06 0.00 1.55 0.00 0.00 27.41 29.82 2ook h HIS 31 CO 0.64 0.86 0.53 1.49 -1.30 0.00 0.00 177.93 180.15 2ook h GLU 32 N 1.08 0.92 -0.59 5.26 4.22 -2.00 -1.74 114.58 121.73 2ook h GLU 32 Ca 0.25 -0.06 0.05 0.00 0.08 0.00 0.00 59.36 59.68 2ook h GLU 32 Cb 0.21 -0.21 -0.05 0.00 0.50 0.00 0.00 28.75 29.20 2ook h GLU 32 CO -0.02 0.61 0.32 -0.44 -2.18 0.00 0.00 179.01 177.30 2ook h ASP 33 N 0.95 0.48 -0.28 1.04 3.32 -1.83 -2.26 116.42 117.84 2ook h ASP 33 Ca 0.38 0.02 0.06 0.00 0.02 0.00 0.00 57.03 57.52 2ook h ASP 33 Cb 0.20 -0.07 -0.06 0.00 0.22 0.00 0.00 39.33 39.62 2ook h ASP 33 CO -0.18 0.33 -0.14 0.22 -1.72 0.00 0.00 179.24 177.74 2ook h TYR 34 N 0.62 -0.34 -0.24 4.55 5.03 -0.57 0.24 116.97 126.26 2ook h TYR 34 Ca 0.26 0.03 -0.01 0.00 2.58 0.00 0.00 58.73 61.58 2ook h TYR 34 Cb 0.13 0.19 -0.01 0.00 1.55 0.00 0.00 36.73 38.59 2ook h TYR 34 CO -0.08 -0.21 0.08 -0.07 -1.32 0.00 0.00 178.16 176.56 2ook h LEU 35 N -0.10 0.29 0.18 2.82 3.38 -0.99 -1.54 115.31 119.34 2ook h LEU 35 Ca 0.15 -0.02 -0.35 0.00 0.09 0.00 0.00 57.88 57.75 2ook h LEU 35 Cb 0.33 -0.07 0.01 0.00 0.09 0.00 0.00 40.66 41.01 2ook h LEU 35 CO -0.35 0.28 -1.76 0.58 0.09 0.00 0.00 178.44 177.28 2ook h VAL 36 N 0.33 0.92 0.09 1.22 2.07 -1.00 -3.42 116.25 116.47 2ook h VAL 36 Ca 0.08 -2.52 -0.34 0.00 0.82 0.00 0.00 66.70 64.74 2ook h VAL 36 Cb 0.09 2.74 -0.02 0.00 -1.52 0.00 0.00 31.29 32.57 2ook h VAL 36 CO -0.01 0.86 -1.87 0.40 0.02 0.00 0.00 177.57 176.97 2ook h ILE 37 N 0.10 0.74 -0.39 4.57 2.04 -0.46 -3.40 117.51 120.72 2ook h ILE 37 Ca -0.34 -2.49 -0.07 0.00 1.00 0.00 0.00 64.86 62.96 2ook h ILE 37 Cb 2.09 2.52 -0.02 0.00 -0.74 0.00 0.00 36.82 40.67 2ook h ILE 37 CO 0.17 0.78 -0.03 0.71 0.00 0.00 0.00 178.15 179.77 2ook h THR 38 N 0.05 1.23 0.00 -0.27 1.35 -1.46 -1.64 112.91 112.17 2ook h THR 38 Ca -0.37 -0.95 0.00 0.00 -0.55 0.00 0.00 66.41 64.54 2ook h THR 38 Cb 2.03 0.97 0.00 0.00 -1.73 0.00 0.00 68.15 69.42 2ook h THR 38 CO 0.10 0.33 0.00 -2.65 -0.25 0.00 0.00 175.52 173.04 2ook n PRO 39 N -4.23 0.00 0.00 4.72 -0.02 -1.26 -1.00 135.00 133.21 2ook n PRO 39 Ca 0.02 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.50 2ook n PRO 39 Cb 0.29 -1.29 0.00 0.00 -0.02 0.00 0.00 33.50 32.49 2ook n PRO 39 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 2ook n LEU 41 N 0.79 0.00 -0.12 2.45 7.94 -0.62 -1.02 117.00 126.42 2ook n LEU 41 Ca 0.00 0.00 -0.08 0.00 -1.11 0.00 0.00 56.01 54.82 2ook n LEU 41 Cb 0.00 0.00 0.07 0.00 0.53 0.00 0.00 43.42 44.02 2ook n LEU 41 CO 0.00 0.00 0.74 -0.33 -1.11 0.00 0.00 177.39 176.69 2ook h GLU 42 N 0.00 0.87 -0.81 1.96 5.08 -1.34 -2.00 114.58 118.34 2ook h GLU 42 Ca 0.00 -0.33 0.02 0.00 -1.00 0.00 0.00 59.36 58.05 2ook h GLU 42 Cb 0.00 -0.05 -0.04 0.00 0.50 0.00 0.00 28.75 29.15 2ook h GLU 42 CO 0.00 0.97 0.53 0.78 -1.00 0.00 0.00 179.01 180.28 2ook h GLY 43 N 0.95 1.15 0.81 -3.84 0.00 -1.32 -1.93 103.07 98.90 2ook h GLY 43 Ca 0.12 -0.41 -0.00 0.00 0.00 0.00 0.00 47.33 47.03 2ook h GLY 43 CO 0.05 0.38 0.01 0.00 0.00 0.00 0.00 176.54 176.99 2ook h ALA 44 N 1.31 0.05 -0.29 3.60 0.00 -1.78 -3.25 119.26 118.90 2ook h ALA 44 Ca 0.31 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 55.07 2ook h ALA 44 Cb -0.07 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 2ook h ALA 44 CO -0.08 -0.34 0.02 -0.07 0.00 0.00 0.00 179.25 178.77 2ook h LEU 45 N -0.13 0.40 -0.71 0.00 3.38 -1.24 -2.20 115.31 114.81 2ook h LEU 45 Ca 0.01 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.92 2ook h LEU 45 Cb 0.20 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.85 2ook h LEU 45 CO -0.00 0.46 0.00 -1.54 0.09 0.00 0.00 178.44 177.45 2ook n SER 46 N -4.32 0.45 -0.96 -0.43 3.41 -0.74 -1.93 113.62 109.11 2ook n SER 46 Ca 0.01 0.65 0.12 0.00 -0.26 0.00 0.00 58.87 59.38 2ook n SER 46 Cb 0.21 -0.73 0.11 0.00 -0.26 0.00 0.00 64.21 63.54 2ook n SER 46 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2ook n GLN 47 N -2.04 2.28 -2.62 4.33 1.13 -0.83 -4.79 117.38 114.84 2ook n GLN 47 Ca 0.01 -1.94 -0.43 0.00 -1.94 0.00 0.00 57.00 52.70 2ook n GLN 47 Cb 0.14 -1.46 -0.02 0.00 0.11 0.00 0.00 30.24 29.01 2ook n GLN 47 CO 0.00 0.00 0.00 0.08 -1.44 0.00 0.00 177.06 175.70 2ook s VAL 48 N -1.89 4.28 -0.65 5.09 1.01 -0.81 -4.85 120.40 122.58 2ook s VAL 48 Ca 0.29 1.29 0.16 0.00 0.00 0.00 0.00 61.98 63.71 2ook s VAL 48 Cb 0.20 -4.56 -0.18 0.00 0.00 0.00 0.00 36.38 31.84 2ook s VAL 48 CO 0.29 -0.90 0.63 -0.67 0.00 0.00 0.00 175.10 174.45 2ook n ASP 49 N 7.62 0.81 -4.65 3.32 2.03 -1.26 -4.65 116.55 119.78 2ook n ASP 49 Ca 0.12 -0.76 -0.45 0.00 0.52 0.00 0.00 54.79 54.22 2ook n ASP 49 Cb 0.49 1.10 -0.04 0.00 -0.72 0.00 0.00 41.12 41.94 2ook n ASP 49 CO 0.00 0.00 0.00 1.67 -1.92 0.00 0.00 177.20 176.95 2ook n GLN 50 N -1.46 2.43 -0.27 -0.67 7.27 -1.26 -4.88 117.38 118.54 2ook n GLN 50 Ca 0.02 0.85 -0.05 0.00 0.07 0.00 0.00 57.00 57.90 2ook n GLN 50 Cb 0.27 -2.92 0.06 0.00 2.41 0.00 0.00 30.24 30.06 2ook n GLN 50 CO 0.00 0.00 0.00 -1.35 0.07 0.00 0.00 177.06 175.78 2ook h PRO 51 N 11.08 0.98 -4.76 3.69 0.11 -2.00 -3.36 132.00 137.74 2ook h PRO 51 Ca -0.47 -0.06 -0.68 0.00 0.11 0.00 0.00 66.00 64.90 2ook h PRO 51 Cb 1.25 -0.22 -0.28 0.00 0.11 0.00 0.00 31.00 31.87 2ook h PRO 51 CO 0.95 0.65 -0.63 0.21 -0.21 0.00 0.00 178.00 178.97 2ook s LYS 52 N -6.13 2.87 -0.05 1.05 2.36 -1.26 -4.69 119.74 113.89 2ook s LYS 52 Ca -0.13 -1.00 -0.12 0.00 -2.55 0.00 0.00 55.97 52.17 2ook s LYS 52 Cb 0.15 -3.37 0.02 0.00 -1.05 0.00 0.00 37.83 33.58 2ook s LYS 52 CO 0.78 -0.53 0.29 0.54 1.55 0.00 0.00 175.35 177.97 2ook s VAL 53 N 1.44 0.04 0.41 4.02 0.11 -1.26 -5.03 120.40 120.13 2ook s VAL 53 Ca 0.01 -0.33 0.07 0.00 -2.93 0.00 0.00 61.98 58.80 2ook s VAL 53 Cb -0.18 -0.52 -0.08 0.00 -1.53 0.00 0.00 36.38 34.07 2ook s VAL 53 CO 0.02 -0.18 0.01 -0.44 -3.33 0.00 0.00 175.10 171.18 2ook s SER 54 N -0.78 3.83 -0.06 3.54 0.01 -1.26 -1.08 113.70 117.90 2ook s SER 54 Ca -0.09 -1.37 0.04 0.00 1.31 0.00 0.00 55.95 55.84 2ook s SER 54 Cb -0.04 -0.39 0.00 0.00 0.21 0.00 0.00 66.02 65.80 2ook s SER 54 CO 0.02 -0.45 -0.16 -0.22 0.41 0.00 0.00 173.24 172.84 2ook s LEU 55 N -3.70 1.84 -0.23 2.44 2.96 -0.24 -0.76 118.68 121.00 2ook s LEU 55 Ca 0.35 -0.36 -0.09 0.00 -0.22 0.00 0.00 54.13 53.81 2ook s LEU 55 Cb 0.10 -0.97 -0.04 0.00 0.50 0.00 0.00 46.19 45.78 2ook s LEU 55 CO 0.18 0.11 0.11 0.12 -1.32 0.00 0.00 176.35 175.55 2ook s PHE 56 N 0.30 3.21 -0.30 5.38 5.36 0.24 -1.34 117.98 130.83 2ook s PHE 56 Ca -0.10 -0.02 0.01 0.00 -0.96 0.00 0.00 56.93 55.87 2ook s PHE 56 Cb -0.14 -2.22 0.07 0.00 -0.34 0.00 0.00 43.02 40.39 2ook s PHE 56 CO 0.04 -0.07 -0.02 -1.17 -1.46 0.00 0.00 175.22 172.54 2ook s LEU 57 N 1.13 3.99 -0.61 6.12 0.20 0.67 -0.90 118.68 129.28 2ook s LEU 57 Ca 0.06 -1.55 -0.21 0.00 0.69 0.00 0.00 54.13 53.11 2ook s LEU 57 Cb -0.14 -1.64 0.07 0.00 -0.43 0.00 0.00 46.19 44.05 2ook s LEU 57 CO 0.04 -0.28 0.86 -0.62 -0.29 0.00 0.00 176.35 176.07 2ook s ASP 58 N 1.18 6.20 -0.23 3.68 -1.08 0.72 -0.60 116.67 126.54 2ook s ASP 58 Ca -0.03 -1.01 0.14 0.00 -0.52 0.00 0.00 52.55 51.13 2ook s ASP 58 Cb -0.20 -2.38 0.55 0.00 -1.46 0.00 0.00 42.92 39.43 2ook s ASP 58 CO -0.04 -1.28 1.48 0.00 0.52 0.00 0.00 175.17 175.85 2ook n ALA 59 N 7.18 3.56 0.05 3.66 0.00 0.34 -2.22 120.51 133.08 2ook n ALA 59 Ca -0.05 -2.56 0.03 0.00 0.00 0.00 0.00 53.44 50.87 2ook n ALA 59 Cb 0.45 -0.79 0.42 0.00 0.00 0.00 0.00 19.45 19.53 2ook n ALA 59 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 2ook h THR 60 N 1.64 1.12 -0.47 0.00 1.35 -1.78 -2.42 112.91 112.36 2ook h THR 60 Ca 0.10 -0.38 0.00 0.00 -0.55 0.00 0.00 66.41 65.58 2ook h THR 60 Cb 1.62 0.75 0.00 0.00 -1.73 0.00 0.00 68.15 68.79 2ook h THR 60 CO 0.34 0.14 0.00 -0.62 -0.25 0.00 0.00 175.52 175.13 2ook n GLU 61 N -4.41 3.28 -2.93 4.72 1.02 -1.26 -4.66 120.64 116.40 2ook n GLU 61 Ca 0.02 -2.63 -0.41 0.00 -0.02 0.00 0.00 57.16 54.11 2ook n GLU 61 Cb 0.13 -1.70 -0.04 0.00 -0.02 0.00 0.00 31.44 29.81 2ook n GLU 61 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 2ook s LEU 62 N -1.83 4.20 -0.09 -4.62 2.96 -0.91 -1.20 118.68 117.19 2ook s LEU 62 Ca 0.41 1.15 0.16 0.00 -0.22 0.00 0.00 54.13 55.64 2ook s LEU 62 Cb 0.27 -3.19 -0.23 0.00 0.50 0.00 0.00 46.19 43.54 2ook s LEU 62 CO 0.18 -0.34 0.41 0.47 -1.32 0.00 0.00 176.35 175.75 2ook n ASP 63 N 4.97 0.41 0.00 3.68 8.00 0.09 -4.86 116.55 128.85 2ook n ASP 63 Ca 0.03 0.19 0.00 0.00 0.71 0.00 0.00 54.79 55.72 2ook n ASP 63 Cb 0.49 0.61 0.00 0.00 -0.02 0.00 0.00 41.12 42.20 2ook n ASP 63 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2ook n GLY 64 N 1.59 0.53 3.38 0.44 0.00 -1.03 -4.94 105.19 105.17 2ook n GLY 64 Ca -0.22 -1.68 -0.09 0.00 0.00 0.00 0.00 46.02 44.03 2ook n GLY 64 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 2ook s TRP 65 N -2.88 0.25 -0.05 1.61 -2.14 -1.26 -1.27 118.94 113.19 2ook s TRP 65 Ca 0.00 -0.61 -0.30 0.00 2.66 0.00 0.00 56.10 57.85 2ook s TRP 65 Cb 0.00 0.06 -0.04 0.00 -3.10 0.00 0.00 33.47 30.39 2ook s TRP 65 CO 0.00 -0.76 1.38 -0.51 -2.66 0.00 0.00 176.95 174.40 2ook s ASP 66 N -2.94 6.87 0.45 -2.66 1.01 0.02 -4.89 116.67 114.53 2ook s ASP 66 Ca 0.15 2.00 0.31 0.00 0.71 0.00 0.00 52.55 55.71 2ook s ASP 66 Cb 0.02 -2.55 1.35 0.00 1.01 0.00 0.00 42.92 42.76 2ook s ASP 66 CO -0.01 -0.74 1.92 -0.07 0.21 0.00 0.00 175.17 176.48 2ook h LEU 67 N 8.92 0.00 -1.11 1.23 3.38 -2.00 -1.57 115.31 124.16 2ook h LEU 67 Ca -0.35 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.62 2ook h LEU 67 Cb 1.16 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.91 2ook h LEU 67 CO 0.92 0.00 -0.03 0.54 0.09 0.00 0.00 178.44 179.97 2ook n ARG 68 N -2.75 1.72 -2.48 1.13 5.12 -1.26 -4.82 116.66 113.32 2ook n ARG 68 Ca 0.01 -1.11 -0.26 0.00 -1.93 0.00 0.00 57.85 54.55 2ook n ARG 68 Cb 0.23 -1.48 0.02 0.00 -1.16 0.00 0.00 32.46 30.08 2ook n ARG 68 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 2ook s ALA 69 N -2.04 3.36 -1.11 7.54 0.00 -0.59 -4.98 121.76 123.93 2ook s ALA 69 Ca 0.35 -0.70 0.14 0.00 0.00 0.00 0.00 51.96 51.75 2ook s ALA 69 Cb 0.21 -2.56 0.61 0.00 0.00 0.00 0.00 23.12 21.38 2ook s ALA 69 CO 0.35 -0.69 1.42 0.00 0.00 0.00 0.00 175.76 176.83 2ook n ALA 70 N -2.49 1.66 -0.33 0.00 0.00 -1.26 -3.55 120.51 114.54 2ook n ALA 70 Ca 0.04 -0.05 0.08 0.00 0.00 0.00 0.00 53.44 53.51 2ook n ALA 70 Cb 0.57 -1.22 0.25 0.00 0.00 0.00 0.00 19.45 19.05 2ook n ALA 70 CO 0.00 0.00 0.00 -1.49 0.00 0.00 0.00 177.50 176.01 2ook h TRP 71 N 0.00 0.97 -0.88 0.00 4.06 -1.94 -1.30 115.95 116.86 2ook h TRP 71 Ca 0.00 0.03 0.16 0.00 2.06 0.00 0.00 58.89 61.14 2ook h TRP 71 Cb 0.21 -0.29 -0.10 0.00 -1.00 0.00 0.00 29.16 27.98 2ook h TRP 71 CO 0.00 0.30 0.46 -0.44 -3.56 0.00 0.00 178.44 175.20 2ook h ASP 72 N 0.79 0.55 0.10 -3.49 5.19 -1.86 -2.68 116.42 115.02 2ook h ASP 72 Ca 0.50 0.10 0.00 0.00 -0.62 0.00 0.00 57.03 57.00 2ook h ASP 72 Cb 0.63 0.01 0.00 0.00 0.18 0.00 0.00 39.33 40.15 2ook h ASP 72 CO -0.32 0.21 -0.13 0.47 -3.12 0.00 0.00 179.24 176.35 2ook n ASP 73 N -4.87 1.34 -4.75 6.45 8.00 -0.52 -4.95 116.55 117.26 2ook n ASP 73 Ca 0.19 -1.24 -0.41 0.00 0.71 0.00 0.00 54.79 54.03 2ook n ASP 73 Cb 0.48 0.07 -0.02 0.00 -0.02 0.00 0.00 41.12 41.63 2ook n ASP 73 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 2ook s LEU 74 N -2.24 4.34 -0.14 0.64 2.96 -1.01 -5.00 118.68 118.22 2ook s LEU 74 Ca 0.31 2.96 -0.00 0.00 -0.22 0.00 0.00 54.13 57.18 2ook s LEU 74 Cb 0.20 -3.63 0.03 0.00 0.50 0.00 0.00 46.19 43.29 2ook s LEU 74 CO 0.42 -0.93 -0.08 -0.54 -1.32 0.00 0.00 176.35 173.90 2ook s LYS 75 N -0.48 1.70 -0.05 1.98 -0.14 -1.26 -4.28 119.74 117.20 2ook s LYS 75 Ca 0.64 -0.45 -0.01 0.00 -1.36 0.00 0.00 55.97 54.79 2ook s LYS 75 Cb -0.48 -1.90 -0.03 0.00 -1.68 0.00 0.00 37.83 33.74 2ook s LYS 75 CO 0.48 -0.33 0.01 -0.51 -0.76 0.00 0.00 175.35 174.24 2ook s LEU 76 N 1.61 3.60 0.00 3.17 1.43 0.01 -5.05 118.68 123.46 2ook s LEU 76 Ca 0.03 0.10 -0.08 0.00 -1.03 0.00 0.00 54.13 53.16 2ook s LEU 76 Cb -0.14 -1.93 0.03 0.00 0.03 0.00 0.00 46.19 44.19 2ook s LEU 76 CO -0.09 0.34 0.54 0.61 0.23 0.00 0.00 176.35 177.98 2ook n GLY 77 N 1.81 1.64 3.76 -3.19 0.00 -1.26 -4.43 105.19 103.51 2ook n GLY 77 Ca -0.17 -1.36 -0.22 0.00 0.00 0.00 0.00 46.02 44.27 2ook n GLY 77 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ook s LEU 78 N 0.00 3.42 0.37 0.99 1.43 -1.26 -4.69 118.68 118.93 2ook s LEU 78 Ca 0.17 -0.60 0.27 0.00 -1.03 0.00 0.00 54.13 52.94 2ook s LEU 78 Cb -0.03 -1.94 1.29 0.00 0.03 0.00 0.00 46.19 45.54 2ook s LEU 78 CO 0.13 -0.21 1.81 0.50 0.23 0.00 0.00 176.35 178.81 2ook h LYS 79 N 1.54 0.00 0.00 1.70 3.11 -1.82 -3.46 116.57 117.64 2ook h LYS 79 Ca -0.45 0.00 -0.01 0.00 -2.81 0.00 0.00 60.65 57.38 2ook h LYS 79 Cb 1.25 0.00 -0.01 0.00 -1.00 0.00 0.00 32.23 32.47 2ook h LYS 79 CO 0.61 0.00 -0.03 0.45 -2.81 0.00 0.00 179.45 177.67 2ook n SER 82 N -2.47 -0.11 -3.81 4.20 2.88 -1.26 -5.20 113.62 107.86 2ook n SER 82 Ca -0.00 -0.29 -0.12 0.00 -1.33 0.00 0.00 58.87 57.13 2ook n SER 82 Cb 0.15 0.03 -0.10 0.00 -0.75 0.00 0.00 64.21 63.54 2ook n SER 82 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 2ook s GLU 83 N 0.00 0.50 0.39 -1.46 2.02 -1.26 -5.05 118.70 113.84 2ook s GLU 83 Ca 0.00 -0.15 -0.26 0.00 0.02 0.00 0.00 54.97 54.58 2ook s GLU 83 Cb 0.00 0.22 -0.09 0.00 0.10 0.00 0.00 34.13 34.36 2ook s GLU 83 CO 0.00 -0.12 1.20 -0.06 0.02 0.00 0.00 175.26 176.30 2ook s PHE 84 N -1.00 3.04 -0.05 1.61 0.08 -1.23 -4.68 117.98 115.75 2ook s PHE 84 Ca -0.11 1.52 -0.24 0.00 0.12 0.00 0.00 56.93 58.22 2ook s PHE 84 Cb -0.05 -3.47 -0.23 0.00 -0.57 0.00 0.00 43.02 38.70 2ook s PHE 84 CO 0.02 -1.48 1.03 0.93 -0.10 0.00 0.00 175.22 175.63 2ook h GLU 85 N 2.75 0.19 -4.00 0.44 4.39 -1.45 -2.84 114.58 114.08 2ook h GLU 85 Ca -0.49 -0.20 -0.17 0.00 0.34 0.00 0.00 59.36 58.83 2ook h GLU 85 Cb 1.24 0.06 -0.21 0.00 -0.10 0.00 0.00 28.75 29.73 2ook h GLU 85 CO 0.63 0.94 -0.70 1.03 -1.16 0.00 0.00 179.01 179.74 2ook s ARG 86 N -3.13 0.31 -0.11 2.33 0.52 -1.26 -2.07 118.95 115.54 2ook s ARG 86 Ca -0.16 -0.61 -0.00 0.00 -0.52 0.00 0.00 55.73 54.44 2ook s ARG 86 Cb 0.01 0.09 0.02 0.00 0.52 0.00 0.00 34.95 35.60 2ook s ARG 86 CO 0.75 -0.05 -0.07 0.08 0.02 0.00 0.00 175.30 176.03 2ook s VAL 87 N -1.44 0.99 -0.25 3.52 1.01 -0.27 -1.08 120.40 122.88 2ook s VAL 87 Ca -0.16 -0.27 -0.06 0.00 0.00 0.00 0.00 61.98 61.49 2ook s VAL 87 Cb -0.10 -1.01 -0.02 0.00 0.00 0.00 0.00 36.38 35.26 2ook s VAL 87 CO -0.01 0.36 0.05 0.00 0.00 0.00 0.00 175.10 175.50 2ook s ALA 88 N 1.64 3.06 -0.21 5.51 0.00 -0.45 -1.29 121.76 130.02 2ook s ALA 88 Ca 0.03 -1.21 -0.08 0.00 0.00 0.00 0.00 51.96 50.70 2ook s ALA 88 Cb -0.13 -2.01 -0.04 0.00 0.00 0.00 0.00 23.12 20.94 2ook s ALA 88 CO -0.07 -0.57 0.10 0.42 0.00 0.00 0.00 175.76 175.64 2ook s ILE 89 N 1.56 4.89 -0.20 0.00 1.01 0.23 -0.24 121.20 128.45 2ook s ILE 89 Ca 0.05 0.01 -0.05 0.00 0.00 0.00 0.00 60.65 60.67 2ook s ILE 89 Cb -0.15 -3.25 -0.02 0.00 0.01 0.00 0.00 42.46 39.05 2ook s ILE 89 CO 0.02 0.40 0.00 -0.22 0.00 0.00 0.00 174.94 175.14 2ook s LEU 90 N 0.83 3.25 0.27 2.97 2.96 0.23 0.08 118.68 129.27 2ook s LEU 90 Ca 0.05 -0.21 -0.21 0.00 -0.22 0.00 0.00 54.13 53.54 2ook s LEU 90 Cb -0.13 -1.83 0.02 0.00 0.50 0.00 0.00 46.19 44.75 2ook s LEU 90 CO 0.02 0.06 0.70 -0.83 -1.32 0.00 0.00 176.35 174.99 2ook s GLY 91 N 1.04 -0.10 -0.02 7.98 0.00 -0.25 -0.50 107.32 115.46 2ook s GLY 91 Ca 0.02 -0.28 0.16 0.00 0.00 0.00 0.00 44.72 44.62 2ook s GLY 91 CO 0.02 -0.09 0.35 0.70 0.00 0.00 0.00 173.10 174.07 2ook n ASN 92 N -0.45 1.43 -4.90 1.64 3.02 -1.26 -4.12 115.26 110.62 2ook n ASN 92 Ca -0.05 -0.01 -0.28 0.00 -0.03 0.00 0.00 54.58 54.21 2ook n ASN 92 Cb 0.59 1.70 0.00 0.00 -0.61 0.00 0.00 39.78 41.47 2ook n ASN 92 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2ook s LYS 93 N -3.07 3.52 0.19 3.52 1.02 -1.26 -5.01 119.74 118.65 2ook s LYS 93 Ca -0.05 0.27 -0.32 0.00 0.02 0.00 0.00 55.97 55.89 2ook s LYS 93 Cb 0.10 -2.33 -0.15 0.00 -0.52 0.00 0.00 37.83 34.93 2ook s LYS 93 CO 0.65 -0.29 1.14 -0.25 -0.92 0.00 0.00 175.35 175.68 2ook n ASP 94 N -2.35 1.32 0.18 2.83 8.00 -1.26 -4.81 116.55 120.46 2ook n ASP 94 Ca 0.02 1.15 0.06 0.00 0.71 0.00 0.00 54.79 56.72 2ook n ASP 94 Cb 0.55 -1.23 0.55 0.00 -0.02 0.00 0.00 41.12 40.97 2ook n ASP 94 CO 0.00 0.00 0.00 4.11 -0.39 0.00 0.00 177.20 180.92 2ook h TRP 95 N 3.16 0.14 0.00 1.24 5.08 -2.00 -2.43 115.95 121.14 2ook h TRP 95 Ca -0.42 -0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.54 2ook h TRP 95 Cb 1.34 -0.04 0.00 0.00 -3.00 0.00 0.00 29.16 27.46 2ook h TRP 95 CO 0.53 0.14 0.00 -0.56 -1.28 0.00 0.00 178.44 177.27 2ook h GLN 96 N 0.14 0.00 0.56 0.12 -0.00 -1.99 -1.90 115.11 112.04 2ook h GLN 96 Ca 0.04 0.00 -0.03 0.00 -0.00 0.00 0.00 58.65 58.66 2ook h GLN 96 Cb 0.08 0.00 0.01 0.00 -0.00 0.00 0.00 27.48 27.57 2ook h GLN 96 CO -0.00 0.00 -0.27 0.93 -0.00 0.00 0.00 178.83 179.49 2ook h GLU 97 N 0.00 -0.72 0.00 0.06 5.08 -1.79 -3.45 114.58 113.76 2ook h GLU 97 Ca 0.00 0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 2ook h GLU 97 Cb 0.35 0.16 0.00 0.00 0.50 0.00 0.00 28.75 29.76 2ook h GLU 97 CO 0.00 -0.42 0.00 0.91 -1.00 0.00 0.00 179.01 178.50 2ook n TRP 98 N -5.30 0.00 -0.12 4.33 7.02 -1.23 -4.86 117.44 117.29 2ook n TRP 98 Ca -0.11 0.00 -0.12 0.00 -1.02 0.00 0.00 57.50 56.25 2ook n TRP 98 Cb 0.33 0.00 -0.02 0.00 -2.42 0.00 0.00 31.31 29.19 2ook n TRP 98 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2ook h ALA 99 N 0.00 0.52 -0.42 6.99 0.00 -1.62 0.16 119.26 124.89 2ook h ALA 99 Ca 0.00 -0.37 -0.13 0.00 0.00 0.00 0.00 54.91 54.41 2ook h ALA 99 Cb 0.00 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 2ook h ALA 99 CO 0.00 0.48 -0.25 0.00 0.00 0.00 0.00 179.25 179.48 2ook h ALA 100 N 0.79 0.76 -0.31 0.00 0.00 -1.87 0.55 119.26 119.18 2ook h ALA 100 Ca 0.08 -0.40 -0.02 0.00 0.00 0.00 0.00 54.91 54.57 2ook h ALA 100 Cb 0.76 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 2ook h ALA 100 CO 0.06 0.66 0.11 0.87 0.00 0.00 0.00 179.25 180.95 2ook h LYS 101 N 0.76 0.46 0.00 0.00 1.57 -1.73 -1.24 116.57 116.40 2ook h LYS 101 Ca 0.09 -0.09 -0.18 0.00 -1.87 0.00 0.00 60.65 58.60 2ook h LYS 101 Cb 0.80 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 33.02 2ook h LYS 101 CO 0.07 0.49 -0.83 0.97 -0.57 0.00 0.00 179.45 179.57 2ook h ILE 102 N 0.34 1.54 -0.95 1.86 2.10 -0.68 -3.02 117.51 118.70 2ook h ILE 102 Ca 0.10 -2.69 0.06 0.00 1.08 0.00 0.00 64.86 63.41 2ook h ILE 102 Cb 0.20 2.47 -0.06 0.00 -1.09 0.00 0.00 36.82 38.34 2ook h ILE 102 CO -0.01 0.78 0.62 1.23 -1.08 0.00 0.00 178.15 179.69 2ook h GLY 103 N 2.15 1.41 1.73 8.18 0.00 -0.68 -2.35 103.07 113.51 2ook h GLY 103 Ca -0.02 -0.45 0.00 0.00 0.00 0.00 0.00 47.33 46.86 2ook h GLY 103 CO 0.12 0.34 0.00 -1.14 0.00 0.00 0.00 176.54 175.85 2ook n SER 104 N -4.48 0.00 0.26 0.19 3.41 -0.48 -2.05 113.62 110.47 2ook n SER 104 Ca 0.14 0.25 0.17 0.00 -0.26 0.00 0.00 58.87 59.17 2ook n SER 104 Cb 0.17 -0.36 0.73 0.00 -0.26 0.00 0.00 64.21 64.49 2ook n SER 104 CO 0.00 0.00 0.00 -0.50 -0.16 0.00 0.00 175.04 174.38 2ook h TRP 105 N 0.00 0.00 -3.09 7.33 6.55 -1.52 -3.46 115.95 121.77 2ook h TRP 105 Ca 0.00 0.00 -0.63 0.00 0.95 0.00 0.00 58.89 59.21 2ook h TRP 105 Cb 0.15 0.00 -0.15 0.00 -0.86 0.00 0.00 29.16 28.30 2ook h TRP 105 CO 0.00 0.00 -0.74 -0.06 -1.05 0.00 0.00 178.44 176.59 2ook s PHE 106 N -3.68 2.57 -0.17 0.49 0.08 -0.87 -0.81 117.98 115.59 2ook s PHE 106 Ca 0.01 -0.25 -0.03 0.00 0.12 0.00 0.00 56.93 56.78 2ook s PHE 106 Cb 0.09 -1.27 -0.02 0.00 -0.57 0.00 0.00 43.02 41.26 2ook s PHE 106 CO 0.49 0.50 -0.05 0.42 -0.10 0.00 0.00 175.22 176.48 2ook s ILE 107 N -1.66 3.60 0.13 0.64 1.01 -1.26 -5.03 121.20 118.63 2ook s ILE 107 Ca 0.24 -0.45 -0.21 0.00 0.00 0.00 0.00 60.65 60.23 2ook s ILE 107 Cb -0.09 -2.59 0.06 0.00 0.01 0.00 0.00 42.46 39.85 2ook s ILE 107 CO 0.14 0.47 0.54 0.00 0.00 0.00 0.00 174.94 176.09 2ook s ALA 108 N 0.70 -1.38 0.13 9.38 0.00 -1.26 -3.47 121.76 125.86 2ook s ALA 108 Ca -0.03 0.38 -0.19 0.00 0.00 0.00 0.00 51.96 52.12 2ook s ALA 108 Cb -0.15 0.74 -0.02 0.00 0.00 0.00 0.00 23.12 23.69 2ook s ALA 108 CO 0.02 -0.68 1.75 0.78 0.00 0.00 0.00 175.76 177.62 2ook h GLY 109 N 2.24 0.28 -5.40 0.00 0.00 -1.15 -3.43 103.07 95.61 2ook h GLY 109 Ca -0.33 -0.04 -0.31 0.00 0.00 0.00 0.00 47.33 46.65 2ook h GLY 109 CO 0.41 0.02 -0.75 -0.54 0.00 0.00 0.00 176.54 175.68 2ook s GLU 110 N -6.18 0.36 -0.13 4.80 2.02 -1.07 -5.04 118.70 113.47 2ook s GLU 110 Ca -0.13 -0.16 -0.00 0.00 0.02 0.00 0.00 54.97 54.70 2ook s GLU 110 Cb 0.10 -0.35 0.03 0.00 0.10 0.00 0.00 34.13 34.00 2ook s GLU 110 CO 0.69 0.09 -0.08 0.42 0.02 0.00 0.00 175.26 176.40 2ook s ILE 111 N -0.10 1.12 0.02 -1.63 1.01 -1.26 -1.11 121.20 119.25 2ook s ILE 111 Ca 0.02 -0.39 0.03 0.00 0.00 0.00 0.00 60.65 60.31 2ook s ILE 111 Cb -0.02 -1.15 -0.02 0.00 0.01 0.00 0.00 42.46 41.29 2ook s ILE 111 CO -0.00 0.35 -0.10 -0.75 0.00 0.00 0.00 174.94 174.43 2ook s LYS 112 N 1.66 0.72 -0.14 2.79 2.20 -0.41 -5.00 119.74 121.57 2ook s LYS 112 Ca 0.04 -0.58 -0.05 0.00 -0.36 0.00 0.00 55.97 55.02 2ook s LYS 112 Cb -0.13 -0.66 -0.04 0.00 -1.51 0.00 0.00 37.83 35.49 2ook s LYS 112 CO -0.09 0.16 0.05 -0.47 -0.36 0.00 0.00 175.35 174.65 2ook s TYR 113 N -0.72 3.28 0.08 4.03 5.04 -1.26 -0.60 117.35 127.19 2ook s TYR 113 Ca -0.01 0.19 0.04 0.00 -2.44 0.00 0.00 57.07 54.85 2ook s TYR 113 Cb -0.07 -1.95 -0.03 0.00 0.35 0.00 0.00 41.96 40.27 2ook s TYR 113 CO 0.00 0.37 -0.10 -0.06 -1.34 0.00 0.00 175.55 174.42 2ook s PHE 114 N -0.34 1.00 -0.53 4.97 0.40 0.11 -4.95 117.98 118.64 2ook s PHE 114 Ca 0.08 -0.60 0.14 0.00 -0.60 0.00 0.00 56.93 55.95 2ook s PHE 114 Cb -0.12 -0.56 -0.17 0.00 0.51 0.00 0.00 43.02 42.68 2ook s PHE 114 CO 0.02 -0.02 0.54 -0.85 0.70 0.00 0.00 175.22 175.62 2ook n GLU 115 N 0.83 1.87 -4.46 0.44 0.00 -1.26 -1.09 120.64 116.97 2ook n GLU 115 Ca -0.18 -0.03 -0.34 0.00 0.00 0.00 0.00 57.16 56.61 2ook n GLU 115 Cb 0.57 -1.21 -0.14 0.00 0.00 0.00 0.00 31.44 30.65 2ook n GLU 115 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.13 177.47 2ook s ASP 116 N -2.65 4.20 0.11 -1.84 2.15 -1.26 -4.82 116.67 112.57 2ook s ASP 116 Ca 0.03 -0.32 -0.16 0.00 0.43 0.00 0.00 52.55 52.54 2ook s ASP 116 Cb 0.10 -1.67 -0.04 0.00 -0.30 0.00 0.00 42.92 41.01 2ook s ASP 116 CO 0.59 0.11 1.54 -0.08 -0.17 0.00 0.00 175.17 177.17 2ook h GLU 117 N 7.12 0.65 -0.55 4.34 4.81 -2.00 -2.41 114.58 126.54 2ook h GLU 117 Ca -0.31 -0.22 0.00 0.00 -0.13 0.00 0.00 59.36 58.70 2ook h GLU 117 Cb 1.19 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 30.49 2ook h GLU 117 CO 0.58 0.77 0.36 0.22 -0.73 0.00 0.00 179.01 180.22 2ook h ASP 118 N 0.45 0.63 -0.74 1.04 3.58 -1.99 -1.10 116.42 118.29 2ook h ASP 118 Ca 0.10 -0.02 -0.06 0.00 0.42 0.00 0.00 57.03 57.47 2ook h ASP 118 Cb 0.50 -0.16 -0.03 0.00 1.72 0.00 0.00 39.33 41.36 2ook h ASP 118 CO 0.02 0.46 0.24 0.44 -2.88 0.00 0.00 179.24 177.52 2ook h ASP 119 N 0.74 1.08 -0.42 2.28 3.32 -1.98 -1.35 116.42 120.09 2ook h ASP 119 Ca 0.20 -0.21 -0.00 0.00 0.02 0.00 0.00 57.03 57.04 2ook h ASP 119 Cb -0.08 -0.28 -0.02 0.00 0.22 0.00 0.00 39.33 39.17 2ook h ASP 119 CO -0.04 1.00 0.25 0.00 -1.72 0.00 0.00 179.24 178.72 2ook h ALA 120 N 1.12 0.53 -0.31 3.45 0.00 -0.90 -1.51 119.26 121.64 2ook h ALA 120 Ca 0.24 -0.06 -0.18 0.00 0.00 0.00 0.00 54.91 54.91 2ook h ALA 120 Cb 0.30 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 2ook h ALA 120 CO -0.01 0.03 -0.50 -0.07 0.00 0.00 0.00 179.25 178.70 2ook h LEU 121 N 0.55 0.98 -0.78 0.00 3.38 -1.06 -1.80 115.31 116.58 2ook h LEU 121 Ca 0.15 -0.52 0.00 0.00 0.09 0.00 0.00 57.88 57.60 2ook h LEU 121 Cb 0.01 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.44 2ook h LEU 121 CO -0.03 1.31 0.50 0.11 0.09 0.00 0.00 178.44 180.42 2ook h LYS 122 N 0.68 1.04 -0.57 1.13 1.57 -1.22 -2.55 116.57 116.65 2ook h LYS 122 Ca 0.02 -0.08 -0.07 0.00 -1.87 0.00 0.00 60.65 58.66 2ook h LYS 122 Cb 1.11 -0.23 -0.02 0.00 0.08 0.00 0.00 32.23 33.17 2ook h LYS 122 CO 0.12 0.71 0.08 2.35 -0.57 0.00 0.00 179.45 182.13 2ook h TRP 123 N 1.06 0.97 -0.33 -1.35 7.01 -0.99 -2.61 115.95 119.71 2ook h TRP 123 Ca 0.28 -0.12 -0.05 0.00 2.11 0.00 0.00 58.89 61.12 2ook h TRP 123 Cb -0.09 -0.27 -0.02 0.00 -2.10 0.00 0.00 29.16 26.68 2ook h TRP 123 CO -0.01 0.84 0.01 -0.07 -2.79 0.00 0.00 178.44 176.42 2ook h LEU 124 N 0.87 0.48 -1.82 0.65 3.38 -1.02 -3.12 115.31 114.73 2ook h LEU 124 Ca 0.18 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.06 2ook h LEU 124 Cb 0.40 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.03 2ook h LEU 124 CO 0.01 0.54 0.00 -2.11 0.09 0.00 0.00 178.44 176.97 2ook n ARG 125 N -4.29 2.21 0.00 1.13 1.85 -0.99 -4.93 116.66 111.64 2ook n ARG 125 Ca 0.01 -1.80 0.13 0.00 -1.00 0.00 0.00 57.85 55.20 2ook n ARG 125 Cb 0.23 -1.47 0.40 0.00 -1.05 0.00 0.00 32.46 30.57 2ook n ARG 125 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 177.63 178.28