#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2otd s ASN 3 N 0.00 5.37 -0.38 6.43 4.22 -1.26 -5.05 114.94 124.27 2otd s ASN 3 Ca 0.00 1.71 0.05 0.00 -2.14 0.00 0.00 52.86 52.48 2otd s ASN 3 Cb 0.00 -2.51 0.17 0.00 1.28 0.00 0.00 41.25 40.19 2otd s ASN 3 CO 0.00 -1.45 0.48 0.86 -2.04 0.00 0.00 177.10 174.95 2otd s TRP 4 N -2.85 -0.92 -2.44 1.54 -0.11 -1.26 -5.02 118.94 107.88 2otd s TRP 4 Ca 0.60 -0.31 0.28 0.00 1.22 0.00 0.00 56.10 57.89 2otd s TRP 4 Cb -0.15 -0.10 1.14 0.00 -1.50 0.00 0.00 33.47 32.86 2otd s TRP 4 CO 0.50 -1.05 1.79 -0.35 -4.62 0.00 0.00 176.95 173.22 2otd n PRO 5 N 4.39 1.59 -2.81 5.86 -0.04 -1.26 -4.97 135.00 137.77 2otd n PRO 5 Ca 0.10 -0.86 -0.38 0.00 -0.04 0.00 0.00 63.50 62.32 2otd n PRO 5 Cb 0.50 -1.48 -0.06 0.00 -0.04 0.00 0.00 33.50 32.42 2otd n PRO 5 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 2otd s TYR 6 N -2.00 3.76 0.83 0.54 2.02 -1.26 -5.03 117.35 116.21 2otd s TYR 6 Ca 0.39 1.77 -0.11 0.00 -0.37 0.00 0.00 57.07 58.75 2otd s TYR 6 Cb 0.21 -2.90 0.09 0.00 -0.40 0.00 0.00 41.96 38.96 2otd s TYR 6 CO 0.34 0.28 1.13 -2.14 -1.57 0.00 0.00 175.55 173.60 2otd s PRO 7 N -1.83 1.70 0.33 -1.71 0.02 -1.26 -4.96 135.00 127.29 2otd s PRO 7 Ca 0.47 1.44 0.01 0.00 0.02 0.00 0.00 61.00 62.94 2otd s PRO 7 Cb -0.20 -1.81 0.59 0.00 0.02 0.00 0.00 34.50 33.10 2otd s PRO 7 CO 0.25 -2.11 1.98 0.00 -0.33 0.00 0.00 177.00 176.80 2otd h ARG 8 N -1.30 0.90 -6.61 5.54 3.08 -1.88 -3.43 114.38 110.68 2otd h ARG 8 Ca -0.44 -0.05 -0.69 0.00 0.07 0.00 0.00 59.98 58.87 2otd h ARG 8 Cb 1.26 -0.20 -0.29 0.00 0.08 0.00 0.00 29.97 30.82 2otd h ARG 8 CO 0.47 0.60 -0.88 0.42 -1.07 0.00 0.00 179.97 179.50 2otd s ILE 9 N -5.79 2.05 -0.05 2.04 -1.09 -1.26 -0.97 121.20 116.13 2otd s ILE 9 Ca -0.11 -1.21 0.02 0.00 -2.23 0.00 0.00 60.65 57.13 2otd s ILE 9 Cb 0.18 -1.72 0.02 0.00 -1.58 0.00 0.00 42.46 39.36 2otd s ILE 9 CO 0.78 0.48 -0.08 -0.69 -1.23 0.00 0.00 174.94 174.20 2otd s VAL 10 N -0.68 0.80 -0.45 2.92 1.01 0.01 -4.66 120.40 119.34 2otd s VAL 10 Ca 0.10 -0.29 -0.25 0.00 0.00 0.00 0.00 61.98 61.54 2otd s VAL 10 Cb -0.10 -0.76 0.03 0.00 0.00 0.00 0.00 36.38 35.55 2otd s VAL 10 CO 0.00 0.28 0.91 0.00 0.00 0.00 0.00 175.10 176.29 2otd s ALA 11 N 0.71 3.25 -0.03 5.51 0.00 -1.26 -0.71 121.76 129.24 2otd s ALA 11 Ca -0.12 -0.79 -0.30 0.00 0.00 0.00 0.00 51.96 50.75 2otd s ALA 11 Cb -0.14 -3.61 -0.06 0.00 0.00 0.00 0.00 23.12 19.31 2otd s ALA 11 CO 0.02 -2.01 1.59 -1.58 0.00 0.00 0.00 175.76 173.78 2otd s HIS 12 N 3.68 2.25 -1.44 0.00 2.46 -0.81 -1.55 115.29 119.89 2otd s HIS 12 Ca 0.36 0.36 -0.05 0.00 0.47 0.00 0.00 55.06 56.21 2otd s HIS 12 Cb -0.10 -3.86 0.02 0.00 -0.13 0.00 0.00 32.58 28.51 2otd s HIS 12 CO 0.25 -3.51 0.40 0.54 -2.47 0.00 0.00 174.74 169.95 2otd n ARG 13 N 6.53 -3.63 0.00 2.88 1.74 0.92 -1.34 116.66 123.76 2otd n ARG 13 Ca 0.16 0.76 0.00 0.00 -0.77 0.00 0.00 57.85 58.00 2otd n ARG 13 Cb 0.43 -5.51 0.00 0.00 -1.02 0.00 0.00 32.46 26.36 2otd n ARG 13 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2otd n GLY 14 N -1.24 2.33 0.05 -0.13 0.00 -0.88 -1.52 105.19 103.80 2otd n GLY 14 Ca -0.11 -0.45 0.02 0.00 0.00 0.00 0.00 46.02 45.48 2otd n GLY 14 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2otd n GLY 15 N 0.00 2.39 7.00 -0.02 0.00 -1.15 -3.77 105.19 109.64 2otd n GLY 15 Ca 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 46.02 45.74 2otd n GLY 15 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2otd n GLY 16 N -0.62 3.06 0.75 -0.02 0.00 -0.45 -2.01 105.19 105.90 2otd n GLY 16 Ca 0.04 -0.22 0.13 0.00 0.00 0.00 0.00 46.02 45.97 2otd n GLY 16 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2otd n LYS 17 N 14.00 2.03 0.00 1.61 2.85 -0.87 -4.24 118.16 133.54 2otd n LYS 17 Ca 0.00 -1.51 0.13 0.00 -1.05 0.00 0.00 58.31 55.88 2otd n LYS 17 Cb 0.00 -1.47 0.60 0.00 -0.65 0.00 0.00 35.03 33.52 2otd n LYS 17 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63 2otd n LEU 18 N 0.81 0.00 -3.69 -5.58 4.77 -0.85 -4.88 117.00 107.58 2otd n LEU 18 Ca 0.17 0.39 -0.10 0.00 -0.03 0.00 0.00 56.01 56.44 2otd n LEU 18 Cb 0.48 -0.39 -0.03 0.00 -2.33 0.00 0.00 43.42 41.15 2otd n LEU 18 CO 0.15 -0.05 0.32 0.00 -1.33 0.00 0.00 177.39 176.48 2otd s ALA 19 N -2.77 -1.10 -0.12 -1.18 0.00 -1.24 -5.11 121.76 110.24 2otd s ALA 19 Ca 0.19 -0.10 -0.29 0.00 0.00 0.00 0.00 51.96 51.76 2otd s ALA 19 Cb 0.17 0.86 -0.04 0.00 0.00 0.00 0.00 23.12 24.11 2otd s ALA 19 CO 0.43 -0.83 1.61 -1.25 0.00 0.00 0.00 175.76 175.72 2otd s PRO 20 N -3.86 4.05 0.83 0.00 0.04 -1.26 -4.76 135.00 130.05 2otd s PRO 20 Ca 0.08 1.96 -0.15 0.00 0.04 0.00 0.00 61.00 62.93 2otd s PRO 20 Cb -0.02 -3.98 -0.01 0.00 0.04 0.00 0.00 34.50 30.54 2otd s PRO 20 CO -0.04 -0.99 0.45 -0.85 0.04 0.00 0.00 177.00 175.61 2otd n GLU 21 N 7.26 0.03 -4.01 4.56 0.28 -1.26 -3.47 120.64 124.03 2otd n GLU 21 Ca 0.18 0.06 -0.31 0.00 -0.16 0.00 0.00 57.16 56.92 2otd n GLU 21 Cb 0.44 -1.83 0.00 0.00 1.43 0.00 0.00 31.44 31.48 2otd n GLU 21 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 2otd n ASN 22 N -0.71 -3.30 -4.16 -1.84 5.03 -0.57 -4.96 115.26 104.75 2otd n ASN 22 Ca 0.08 -0.90 -0.20 0.00 0.87 0.00 0.00 54.58 54.44 2otd n ASN 22 Cb 0.52 -3.39 -0.13 0.00 -1.02 0.00 0.00 39.78 35.76 2otd n ASN 22 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 2otd s THR 23 N -3.43 1.15 0.22 3.41 2.01 -1.23 -4.57 115.64 113.20 2otd s THR 23 Ca 0.53 -1.10 -0.12 0.00 0.31 0.00 0.00 61.69 61.32 2otd s THR 23 Cb -0.28 -1.06 0.23 0.00 0.01 0.00 0.00 72.50 71.40 2otd s THR 23 CO 0.87 -0.05 1.64 -0.07 -0.69 0.00 0.00 174.62 176.32 2otd h LEU 24 N 4.74 -0.45 -1.73 4.42 4.07 -1.90 -1.74 115.31 122.71 2otd h LEU 24 Ca -0.39 0.18 0.02 0.00 0.08 0.00 0.00 57.88 57.77 2otd h LEU 24 Cb 1.18 0.35 -0.02 0.00 1.08 0.00 0.00 40.66 43.25 2otd h LEU 24 CO 0.43 -0.18 0.22 0.00 -1.08 0.00 0.00 178.44 177.84 2otd h ALA 25 N 1.62 1.87 -0.25 1.53 0.00 -1.95 -0.79 119.26 121.30 2otd h ALA 25 Ca 0.33 -0.02 -0.13 0.00 0.00 0.00 0.00 54.91 55.09 2otd h ALA 25 Cb 0.52 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.21 2otd h ALA 25 CO -0.61 0.09 -0.36 0.00 0.00 0.00 0.00 179.25 178.36 2otd h ALA 26 N 1.81 0.38 -0.87 0.00 0.00 -1.55 -0.69 119.26 118.34 2otd h ALA 26 Ca 0.13 -0.43 0.01 0.00 0.00 0.00 0.00 54.91 54.61 2otd h ALA 26 Cb 0.10 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.78 2otd h ALA 26 CO -0.03 0.45 0.56 0.82 0.00 0.00 0.00 179.25 181.05 2otd h ILE 27 N 0.40 1.23 -0.11 0.00 2.04 -0.82 0.43 117.51 120.69 2otd h ILE 27 Ca 0.03 -0.43 0.01 0.00 1.00 0.00 0.00 64.86 65.46 2otd h ILE 27 Cb 0.95 -0.04 -0.01 0.00 -0.74 0.00 0.00 36.82 36.98 2otd h ILE 27 CO 0.08 0.22 0.05 0.44 0.00 0.00 0.00 178.15 178.94 2otd h ASP 28 N 1.18 0.07 -0.73 1.72 3.32 -0.77 -1.68 116.42 119.52 2otd h ASP 28 Ca 0.32 0.01 0.06 0.00 0.02 0.00 0.00 57.03 57.43 2otd h ASP 28 Cb -0.12 -0.01 -0.04 0.00 0.22 0.00 0.00 39.33 39.38 2otd h ASP 28 CO -0.07 0.05 0.48 0.58 -1.72 0.00 0.00 179.24 178.57 2otd h VAL 29 N 0.10 1.04 -0.80 -1.35 2.07 0.22 0.09 116.25 117.62 2otd h VAL 29 Ca 0.04 -0.27 0.00 0.00 0.82 0.00 0.00 66.70 67.30 2otd h VAL 29 Cb 0.01 0.18 -0.04 0.00 -1.52 0.00 0.00 31.29 29.92 2otd h VAL 29 CO -0.03 0.14 0.52 1.23 0.02 0.00 0.00 177.57 179.45 2otd h GLY 30 N 0.79 1.14 1.38 2.17 0.00 -0.39 -2.30 103.07 105.85 2otd h GLY 30 Ca 0.31 -0.44 -0.12 0.00 0.00 0.00 0.00 47.33 47.08 2otd h GLY 30 CO -0.10 0.43 -0.30 0.00 0.00 0.00 0.00 176.54 176.57 2otd h ALA 31 N 1.28 0.85 -0.11 3.60 0.00 -0.14 -2.15 119.26 122.59 2otd h ALA 31 Ca 0.29 -0.40 0.03 0.00 0.00 0.00 0.00 54.91 54.84 2otd h ALA 31 Cb -0.10 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.55 2otd h ALA 31 CO -0.06 0.63 0.14 0.87 0.00 0.00 0.00 179.25 180.83 2otd h LYS 32 N 0.60 0.00 -0.64 0.00 1.57 -0.57 0.11 116.57 117.63 2otd h LYS 32 Ca 0.07 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 2otd h LYS 32 Cb 0.81 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.12 2otd h LYS 32 CO 0.07 0.00 0.00 0.66 -0.57 0.00 0.00 179.45 179.61 2otd n TYR 33 N -3.74 1.68 -1.00 -1.35 4.01 -1.06 -4.95 117.16 110.75 2otd n TYR 33 Ca -0.00 -0.64 0.00 0.00 -0.16 0.00 0.00 57.90 57.10 2otd n TYR 33 Cb 0.24 -0.32 0.00 0.00 -0.31 0.00 0.00 39.34 38.95 2otd n TYR 33 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2otd n GLY 34 N 1.03 0.58 3.77 2.72 0.00 0.37 -4.42 105.19 109.24 2otd n GLY 34 Ca 0.27 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.90 2otd n GLY 34 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2otd s HIS 35 N -2.36 3.03 -0.61 1.61 3.76 -0.83 -4.77 115.29 115.11 2otd s HIS 35 Ca 0.00 1.51 0.16 0.00 -0.15 0.00 0.00 55.06 56.58 2otd s HIS 35 Cb 0.00 -3.49 0.76 0.00 1.11 0.00 0.00 32.58 30.96 2otd s HIS 35 CO 0.00 -1.52 1.68 1.63 -0.85 0.00 0.00 174.74 175.67 2otd n LYS 36 N 0.23 4.27 -3.57 1.40 4.76 -1.26 -4.65 118.16 119.34 2otd n LYS 36 Ca 0.03 -3.02 -0.16 0.00 -2.87 0.00 0.00 58.31 52.29 2otd n LYS 36 Cb 0.45 -2.07 -0.06 0.00 -1.84 0.00 0.00 35.03 31.50 2otd n LYS 36 CO 0.00 0.00 0.00 0.96 -1.37 0.00 0.00 177.40 176.99 2otd s ILE 38 N -2.38 0.00 -0.03 -0.18 -4.36 -1.26 -4.84 121.20 108.14 2otd s ILE 38 Ca 0.52 0.00 -0.00 0.00 -0.26 0.00 0.00 60.65 60.91 2otd s ILE 38 Cb 0.37 -1.00 -0.04 0.00 1.25 0.00 0.00 42.46 43.05 2otd s ILE 38 CO 0.19 0.00 0.02 -0.70 0.24 0.00 0.00 174.94 174.69 2otd s GLU 39 N -0.56 2.93 0.16 0.37 -6.30 -0.59 -0.92 118.70 113.80 2otd s GLU 39 Ca -0.06 -0.50 -0.20 0.00 -2.50 0.00 0.00 54.97 51.71 2otd s GLU 39 Cb -0.02 -2.77 0.05 0.00 0.00 0.00 0.00 34.13 31.39 2otd s GLU 39 CO 0.06 0.66 0.54 -0.59 0.02 0.00 0.00 175.26 175.95 2otd s PHE 40 N -1.04 -0.37 -0.21 5.30 -0.12 -0.94 -0.06 117.98 120.54 2otd s PHE 40 Ca 0.18 0.10 -0.06 0.00 -0.05 0.00 0.00 56.93 57.10 2otd s PHE 40 Cb -0.12 0.47 -0.03 0.00 -0.63 0.00 0.00 43.02 42.72 2otd s PHE 40 CO 0.08 -0.84 0.02 -0.51 -0.05 0.00 0.00 175.22 173.92 2otd s ASP 41 N -2.79 4.96 0.11 1.98 1.01 -1.26 -0.27 116.67 120.40 2otd s ASP 41 Ca 0.03 -0.18 0.10 0.00 0.71 0.00 0.00 52.55 53.21 2otd s ASP 41 Cb -0.01 -1.86 -0.04 0.00 1.01 0.00 0.00 42.92 42.03 2otd s ASP 41 CO -0.10 0.05 -0.26 0.00 0.21 0.00 0.00 175.17 175.06 2otd s ALA 42 N 1.10 2.36 0.24 5.23 0.00 0.30 -2.00 121.76 128.99 2otd s ALA 42 Ca 0.03 -1.41 -0.08 0.00 0.00 0.00 0.00 51.96 50.50 2otd s ALA 42 Cb -0.14 -0.42 -0.02 0.00 0.00 0.00 0.00 23.12 22.54 2otd s ALA 42 CO 0.02 0.54 0.35 0.15 0.00 0.00 0.00 175.76 176.82 2otd s LYS 43 N -1.84 1.45 -0.11 0.00 1.02 -0.83 -0.43 119.74 119.00 2otd s LYS 43 Ca 0.14 -1.43 -0.05 0.00 0.02 0.00 0.00 55.97 54.65 2otd s LYS 43 Cb -0.10 0.40 -0.04 0.00 -0.52 0.00 0.00 37.83 37.57 2otd s LYS 43 CO 0.05 -0.56 0.08 -0.51 -0.92 0.00 0.00 175.35 173.48 2otd s LEU 44 N -3.09 4.02 0.98 3.17 1.02 -1.26 -1.78 118.68 121.74 2otd s LEU 44 Ca 0.29 0.31 -0.15 0.00 0.02 0.00 0.00 54.13 54.61 2otd s LEU 44 Cb 0.02 -1.96 0.18 0.00 0.02 0.00 0.00 46.19 44.45 2otd s LEU 44 CO 0.11 0.38 1.18 -0.94 0.02 0.00 0.00 176.35 177.10 2otd s SER 45 N -0.90 2.92 0.33 2.29 1.04 0.09 -4.33 113.70 115.14 2otd s SER 45 Ca 0.14 0.72 0.03 0.00 0.48 0.00 0.00 55.95 57.31 2otd s SER 45 Cb -0.12 -1.09 0.62 0.00 0.10 0.00 0.00 66.02 65.53 2otd s SER 45 CO 0.03 -2.89 1.95 0.50 0.98 0.00 0.00 173.24 173.81 2otd h LYS 46 N -1.74 0.88 -0.08 4.02 3.64 -0.25 -1.24 116.57 121.81 2otd h LYS 46 Ca -0.48 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 58.85 2otd h LYS 46 Cb 1.30 -0.20 0.00 0.00 -0.41 0.00 0.00 32.23 32.92 2otd h LYS 46 CO 0.51 0.59 0.00 -0.40 -2.27 0.00 0.00 179.45 177.87 2otd n ASP 47 N -4.47 1.36 -0.06 4.20 5.75 -1.26 -4.96 116.55 117.11 2otd n ASP 47 Ca 0.11 -1.55 0.00 0.00 -0.01 0.00 0.00 54.79 53.34 2otd n ASP 47 Cb 0.16 -0.05 0.00 0.00 -1.03 0.00 0.00 41.12 40.20 2otd n ASP 47 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2otd n GLY 48 N 1.11 1.00 3.82 6.12 0.00 -0.47 -5.05 105.19 111.72 2otd n GLY 48 Ca 0.18 -0.52 -0.37 0.00 0.00 0.00 0.00 46.02 45.31 2otd n GLY 48 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2otd s GLU 49 N -2.87 4.20 -0.25 1.61 0.41 -1.26 -4.81 118.70 115.73 2otd s GLU 49 Ca 0.00 0.77 -0.15 0.00 -0.41 0.00 0.00 54.97 55.18 2otd s GLU 49 Cb 0.00 -3.00 -0.04 0.00 -1.78 0.00 0.00 34.13 29.31 2otd s GLU 49 CO 0.00 0.48 0.36 0.42 -0.49 0.00 0.00 175.26 176.04 2otd s ILE 50 N -1.39 5.20 0.28 -1.63 1.01 -1.26 -0.73 121.20 122.67 2otd s ILE 50 Ca 0.38 0.58 0.03 0.00 0.00 0.00 0.00 60.65 61.64 2otd s ILE 50 Cb -0.17 -3.69 -0.04 0.00 0.01 0.00 0.00 42.46 38.57 2otd s ILE 50 CO 0.21 0.20 0.17 0.72 0.00 0.00 0.00 174.94 176.24 2otd s PHE 51 N 1.74 1.51 -0.19 3.97 -0.71 -0.73 -0.69 117.98 122.87 2otd s PHE 51 Ca 0.16 -1.42 -0.07 0.00 -1.04 0.00 0.00 56.93 54.55 2otd s PHE 51 Cb -0.15 -0.75 -0.04 0.00 -1.21 0.00 0.00 43.02 40.87 2otd s PHE 51 CO 0.09 -0.62 0.06 -0.51 -1.34 0.00 0.00 175.22 172.90 2otd s LEU 52 N -3.31 3.77 -0.29 -1.99 1.43 -0.54 -1.96 118.68 115.80 2otd s LEU 52 Ca 0.38 0.06 -0.18 0.00 -1.03 0.00 0.00 54.13 53.35 2otd s LEU 52 Cb 0.05 -1.95 0.13 0.00 0.03 0.00 0.00 46.19 44.45 2otd s LEU 52 CO 0.18 0.16 0.96 -0.22 0.23 0.00 0.00 176.35 177.66 2otd s LEU 53 N 0.44 -0.54 -0.08 1.79 2.96 -0.85 -4.60 118.68 117.81 2otd s LEU 53 Ca 0.03 0.89 -0.23 0.00 -0.22 0.00 0.00 54.13 54.60 2otd s LEU 53 Cb -0.13 1.83 -0.19 0.00 0.50 0.00 0.00 46.19 48.21 2otd s LEU 53 CO 0.01 -0.14 0.83 -0.74 -1.32 0.00 0.00 176.35 174.98 2otd h HIS 54 N 5.77 -0.08 -4.23 5.38 -0.00 -1.93 -3.42 115.15 116.65 2otd h HIS 54 Ca -0.28 -0.00 -0.49 0.00 -0.00 0.00 0.00 60.37 59.59 2otd h HIS 54 Cb 1.19 0.03 0.07 0.00 -0.00 0.00 0.00 27.41 28.70 2otd h HIS 54 CO 0.15 0.52 0.35 -0.51 -0.00 0.00 0.00 177.93 178.44 2otd s ASP 55 N -5.77 5.70 0.37 3.26 1.01 -1.26 -4.95 116.67 115.02 2otd s ASP 55 Ca -0.14 1.09 0.06 0.00 0.71 0.00 0.00 52.55 54.27 2otd s ASP 55 Cb -0.01 -2.02 0.71 0.00 1.01 0.00 0.00 42.92 42.62 2otd s ASP 55 CO 0.54 -1.13 1.96 0.44 0.21 0.00 0.00 175.17 177.19 2otd h ASP 56 N -0.43 0.48 -3.50 0.27 3.32 -1.92 -3.45 116.42 111.20 2otd h ASP 56 Ca -0.45 -0.05 -0.66 0.00 0.02 0.00 0.00 57.03 55.88 2otd h ASP 56 Cb 1.24 -0.12 -0.15 0.00 0.22 0.00 0.00 39.33 40.52 2otd h ASP 56 CO 0.63 0.46 -0.72 0.20 -1.72 0.00 0.00 179.24 178.09 2otd s ASN 57 N -6.71 4.57 0.47 6.45 0.01 -1.26 -1.94 114.94 116.53 2otd s ASN 57 Ca -0.08 -0.33 0.27 0.00 -0.71 0.00 0.00 52.86 52.01 2otd s ASN 57 Cb 0.16 -0.94 0.78 0.00 0.41 0.00 0.00 41.25 41.66 2otd s ASN 57 CO 0.75 0.18 1.77 -0.07 -1.51 0.00 0.00 177.10 178.22 2otd h LEU 58 N 3.58 0.00 -0.53 0.60 3.38 -1.53 -3.40 115.31 117.41 2otd h LEU 58 Ca -0.49 0.00 0.05 0.00 0.09 0.00 0.00 57.88 57.53 2otd h LEU 58 Cb 1.17 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.87 2otd h LEU 58 CO 0.54 0.06 0.27 -0.33 0.09 0.00 0.00 178.44 179.07 2otd h GLU 59 N 0.00 0.51 -0.61 1.13 3.07 -1.80 -2.55 114.58 114.32 2otd h GLU 59 Ca -0.00 -0.03 -0.08 0.00 -0.50 0.00 0.00 59.36 58.74 2otd h GLU 59 Cb 0.81 -0.11 -0.02 0.00 -0.84 0.00 0.00 28.75 28.58 2otd h GLU 59 CO 0.01 0.34 0.05 -0.09 -1.40 0.00 0.00 179.01 177.91 2otd h ARG 60 N 0.53 1.05 -0.36 2.33 2.43 -1.89 -3.21 114.38 115.26 2otd h ARG 60 Ca 0.23 -0.31 -0.24 0.00 -0.81 0.00 0.00 59.98 58.85 2otd h ARG 60 Cb 0.14 -0.11 -0.17 0.00 -0.42 0.00 0.00 29.97 29.41 2otd h ARG 60 CO -0.16 1.00 -0.46 0.25 -1.51 0.00 0.00 179.97 179.09 2otd n THR 61 N -4.23 2.45 -3.85 0.20 -2.24 -1.20 -5.03 114.28 100.38 2otd n THR 61 Ca 0.03 -3.45 -0.00 0.00 -2.27 0.00 0.00 64.05 58.35 2otd n THR 61 Cb 0.31 -0.59 0.01 0.00 -2.10 0.00 0.00 70.33 67.97 2otd n THR 61 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2otd s SER 62 N -3.16 -0.03 0.00 3.42 1.04 -0.97 -4.45 113.70 109.56 2otd s SER 62 Ca 0.45 -0.38 0.15 0.00 0.48 0.00 0.00 55.95 56.65 2otd s SER 62 Cb 0.40 0.31 0.56 0.00 0.10 0.00 0.00 66.02 67.39 2otd s SER 62 CO -0.02 -0.61 1.41 -0.46 0.98 0.00 0.00 173.24 174.54 2otd n ASN 63 N -0.94 1.42 -4.86 7.02 6.94 -0.95 -4.59 115.26 119.29 2otd n ASN 63 Ca -0.02 -1.81 -0.21 0.00 -0.02 0.00 0.00 54.58 52.51 2otd n ASN 63 Cb 0.60 -0.13 0.07 0.00 -2.36 0.00 0.00 39.78 37.96 2otd n ASN 63 CO 0.00 0.00 0.00 -0.83 -1.03 0.00 0.00 177.26 175.40 2otd s GLY 64 N -1.31 1.78 0.00 4.83 0.00 -1.26 -4.96 107.32 106.40 2otd s GLY 64 Ca 0.26 -1.78 -0.01 0.00 0.00 0.00 0.00 44.72 43.18 2otd s GLY 64 CO 0.20 -1.33 0.01 -0.98 0.00 0.00 0.00 173.10 171.00 2otd s TRP 65 N -2.87 0.08 0.00 1.90 0.52 -1.26 -3.41 118.94 113.90 2otd s TRP 65 Ca 0.62 -0.15 0.00 0.00 0.02 0.00 0.00 56.10 56.59 2otd s TRP 65 Cb -0.07 -0.06 0.00 0.00 -1.15 0.00 0.00 33.47 32.19 2otd s TRP 65 CO 0.41 -0.09 0.00 0.41 0.02 0.00 0.00 176.95 177.69 2otd n GLY 66 N 2.45 -1.88 3.54 0.98 0.00 -1.26 -4.77 105.19 104.24 2otd n GLY 66 Ca -0.17 -1.67 -0.42 0.00 0.00 0.00 0.00 46.02 43.76 2otd n GLY 66 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2otd s VAL 67 N 0.00 4.16 0.25 1.61 1.01 -1.26 -1.46 120.40 124.71 2otd s VAL 67 Ca 0.00 0.46 -0.08 0.00 0.00 0.00 0.00 61.98 62.36 2otd s VAL 67 Cb 0.00 -4.67 0.33 0.00 0.00 0.00 0.00 36.38 32.05 2otd s VAL 67 CO 0.00 -1.32 1.60 0.00 0.00 0.00 0.00 175.10 175.38 2otd h ALA 68 N 9.51 0.67 0.00 5.51 0.00 -1.71 0.24 119.26 133.47 2otd h ALA 68 Ca -0.26 0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2otd h ALA 68 Cb 1.06 0.56 0.00 0.00 0.00 0.00 0.00 17.79 19.42 2otd h ALA 68 CO 1.16 -0.43 0.02 0.78 0.00 0.00 0.00 179.25 180.78 2otd h GLY 69 N 0.03 0.00 -0.49 0.00 0.00 -1.76 -0.67 103.07 100.18 2otd h GLY 69 Ca 0.42 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.75 2otd h GLY 69 CO -0.80 0.00 -0.02 1.18 0.00 0.00 0.00 176.54 176.90 2otd n GLU 70 N -2.46 1.64 -4.14 4.80 1.02 0.84 -2.35 120.64 119.99 2otd n GLU 70 Ca -0.02 -0.98 -0.27 0.00 -0.02 0.00 0.00 57.16 55.87 2otd n GLU 70 Cb 0.06 -1.48 -0.07 0.00 -0.02 0.00 0.00 31.44 29.93 2otd n GLU 70 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2otd s LEU 71 N -2.03 3.54 0.32 -4.62 1.43 -0.26 -4.81 118.68 112.25 2otd s LEU 71 Ca 0.37 -0.25 -0.12 0.00 -1.03 0.00 0.00 54.13 53.10 2otd s LEU 71 Cb 0.21 -2.19 -0.08 0.00 0.03 0.00 0.00 46.19 44.16 2otd s LEU 71 CO 0.35 0.10 0.69 0.20 0.23 0.00 0.00 176.35 177.91 2otd s ASN 72 N -2.90 6.66 0.26 2.29 0.01 -1.26 -0.28 114.94 119.73 2otd s ASN 72 Ca 0.29 1.13 -0.01 0.00 -0.71 0.00 0.00 52.86 53.55 2otd s ASN 72 Cb -0.10 -2.31 0.52 0.00 0.41 0.00 0.00 41.25 39.76 2otd s ASN 72 CO 0.21 -0.22 1.78 -0.25 -1.51 0.00 0.00 177.10 177.11 2otd h TRP 73 N 2.06 0.85 -0.27 2.20 2.91 -1.95 0.28 115.95 122.03 2otd h TRP 73 Ca -0.47 0.03 0.08 0.00 1.13 0.00 0.00 58.89 59.66 2otd h TRP 73 Cb 1.18 -0.25 -0.01 0.00 -0.51 0.00 0.00 29.16 29.57 2otd h TRP 73 CO 0.61 0.25 0.39 0.37 -1.03 0.00 0.00 178.44 179.03 2otd h GLN 74 N 0.71 0.00 0.03 2.65 4.15 -1.99 0.59 115.11 121.24 2otd h GLN 74 Ca 0.46 0.00 -0.35 0.00 0.77 0.00 0.00 58.65 59.53 2otd h GLN 74 Cb 0.58 0.00 -0.05 0.00 0.21 0.00 0.00 27.48 28.22 2otd h GLN 74 CO -0.33 0.00 -2.14 -0.25 -1.93 0.00 0.00 178.83 174.19 2otd n ASP 75 N -3.47 1.13 0.27 -0.69 10.43 0.94 -3.95 116.55 121.22 2otd n ASP 75 Ca 0.04 0.13 0.15 0.00 2.57 0.00 0.00 54.79 57.68 2otd n ASP 75 Cb 0.52 -0.00 0.75 0.00 1.84 0.00 0.00 41.12 44.22 2otd n ASP 75 CO 0.00 0.00 0.00 -0.07 -1.07 0.00 0.00 177.20 176.06 2otd h LEU 76 N 0.02 0.00 -2.13 0.64 3.38 -0.40 -2.11 115.31 114.70 2otd h LEU 76 Ca -0.46 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.51 2otd h LEU 76 Cb 2.06 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.81 2otd h LEU 76 CO 0.03 0.09 0.00 0.25 0.09 0.00 0.00 178.44 178.90 2otd h LEU 77 N 0.00 0.00 -0.86 1.67 5.85 -1.09 -2.55 115.31 118.33 2otd h LEU 77 Ca -0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 2otd h LEU 77 Cb 0.40 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.43 2otd h LEU 77 CO 0.01 0.00 -0.08 0.54 -0.34 0.00 0.00 178.44 178.58 2otd n ARG 78 N -2.85 1.45 -3.35 1.25 1.74 -0.79 -4.94 116.66 109.17 2otd n ARG 78 Ca -0.01 -0.86 -0.35 0.00 -0.77 0.00 0.00 57.85 55.85 2otd n ARG 78 Cb 0.13 -1.48 -0.06 0.00 -1.02 0.00 0.00 32.46 30.03 2otd n ARG 78 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2otd s VAL 79 N -2.14 4.85 -0.46 1.55 1.01 -0.96 -5.04 120.40 119.20 2otd s VAL 79 Ca 0.34 0.83 -0.14 0.00 0.00 0.00 0.00 61.98 63.01 2otd s VAL 79 Cb 0.20 -3.74 0.07 0.00 0.00 0.00 0.00 36.38 32.92 2otd s VAL 79 CO 0.39 0.23 0.36 -0.62 0.00 0.00 0.00 175.10 175.46 2otd s ASP 80 N -1.73 6.02 -0.22 3.32 -1.08 -1.26 -4.39 116.67 117.32 2otd s ASP 80 Ca 0.38 -1.38 0.11 0.00 -0.52 0.00 0.00 52.55 51.15 2otd s ASP 80 Cb -0.15 -2.13 0.69 0.00 -1.46 0.00 0.00 42.92 39.86 2otd s ASP 80 CO 0.19 -0.62 1.58 0.00 0.52 0.00 0.00 175.17 176.84 2otd n ALA 81 N 5.13 3.81 0.00 3.66 0.00 0.46 -2.25 120.51 131.33 2otd n ALA 81 Ca -0.12 -1.69 0.00 0.00 0.00 0.00 0.00 53.44 51.63 2otd n ALA 81 Cb 0.43 -1.13 0.00 0.00 0.00 0.00 0.00 19.45 18.75 2otd n ALA 81 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2otd n GLY 82 N 0.41 0.00 0.02 0.00 0.00 -1.18 -4.81 105.19 99.63 2otd n GLY 82 Ca 0.26 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.35 2otd n GLY 82 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2otd n SER 83 N -2.64 0.11 0.26 1.61 3.41 -1.17 -0.75 113.62 114.44 2otd n SER 83 Ca 0.00 0.53 0.11 0.00 -0.26 0.00 0.00 58.87 59.24 2otd n SER 83 Cb 0.40 -0.55 0.69 0.00 -0.26 0.00 0.00 64.21 64.49 2otd n SER 83 CO 0.00 0.00 0.00 4.11 -0.16 0.00 0.00 175.04 178.99 2otd h TRP 84 N 0.00 0.00 0.00 7.33 5.08 -1.88 -3.28 115.95 123.21 2otd h TRP 84 Ca 0.00 0.00 -0.11 0.00 1.08 0.00 0.00 58.89 59.86 2otd h TRP 84 Cb 0.26 0.00 -0.02 0.00 -3.00 0.00 0.00 29.16 26.40 2otd h TRP 84 CO 0.00 0.12 -0.62 -0.92 -1.28 0.00 0.00 178.44 175.73 2otd h TYR 85 N 0.00 0.00 -3.65 0.12 5.03 -1.29 -3.50 116.97 113.68 2otd h TYR 85 Ca -0.00 0.00 -0.07 0.00 2.58 0.00 0.00 58.73 61.24 2otd h TYR 85 Cb 0.26 0.00 -0.13 0.00 1.55 0.00 0.00 36.73 38.41 2otd h TYR 85 CO 0.00 1.11 -0.22 -1.12 -1.32 0.00 0.00 178.16 176.61 2otd s SER 86 N -6.45 -0.05 0.50 -2.11 0.01 -1.22 -5.02 113.70 99.35 2otd s SER 86 Ca -0.22 -0.60 0.33 0.00 1.31 0.00 0.00 55.95 56.77 2otd s SER 86 Cb 0.02 0.43 1.50 0.00 0.21 0.00 0.00 66.02 68.18 2otd s SER 86 CO 0.58 -0.85 1.98 0.11 0.41 0.00 0.00 173.24 175.47 2otd h LYS 87 N 2.52 0.00 0.00 12.44 1.57 -1.90 -3.03 116.57 128.17 2otd h LYS 87 Ca -0.33 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 58.36 2otd h LYS 87 Cb 1.23 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.53 2otd h LYS 87 CO 0.49 0.00 -0.42 0.00 -0.57 0.00 0.00 179.45 178.95 2otd h ALA 88 N 2.06 1.01 -0.73 3.86 0.00 -1.94 -3.26 119.26 120.26 2otd h ALA 88 Ca 0.00 -0.39 -0.37 0.00 0.00 0.00 0.00 54.91 54.16 2otd h ALA 88 Cb 0.33 -0.07 -0.22 0.00 0.00 0.00 0.00 17.79 17.83 2otd h ALA 88 CO 0.00 0.53 0.47 1.19 0.00 0.00 0.00 179.25 181.44 2otd n PHE 89 N -3.62 2.26 -0.28 0.00 3.01 -1.14 -4.69 117.46 113.00 2otd n PHE 89 Ca -0.01 -1.46 0.04 0.00 1.01 0.00 0.00 57.45 57.04 2otd n PHE 89 Cb 0.52 -0.75 0.13 0.00 -0.01 0.00 0.00 39.48 39.37 2otd n PHE 89 CO 0.00 0.00 0.00 -0.22 1.01 0.00 0.00 176.76 177.55 2otd h LYS 90 N 0.87 0.02 0.00 -1.08 1.63 -1.76 -1.73 116.57 114.52 2otd h LYS 90 Ca 0.45 -0.00 0.00 0.00 -0.85 0.00 0.00 60.65 60.25 2otd h LYS 90 Cb 2.36 -0.01 0.00 0.00 -0.60 0.00 0.00 32.23 33.99 2otd h LYS 90 CO 0.80 0.02 0.02 0.78 -3.45 0.00 0.00 179.45 177.62 2otd h GLY 91 N 0.02 0.00 -5.51 5.01 0.00 -1.93 -3.42 103.07 97.25 2otd h GLY 91 Ca 0.41 0.00 -0.56 0.00 0.00 0.00 0.00 47.33 47.18 2otd h GLY 91 CO -0.80 0.00 0.98 1.85 0.00 0.00 0.00 176.54 178.57 2otd s GLU 92 N -4.03 4.07 0.32 4.80 2.56 -0.66 -4.83 118.70 120.93 2otd s GLU 92 Ca -0.04 1.64 -0.04 0.00 0.00 0.00 0.00 54.97 56.52 2otd s GLU 92 Cb 0.12 -3.87 -0.05 0.00 2.00 0.00 0.00 34.13 32.33 2otd s GLU 92 CO 0.36 -0.93 0.58 -1.25 -0.56 0.00 0.00 175.26 173.47 2otd s PRO 93 N 3.94 3.61 0.11 4.30 0.04 -1.26 0.18 135.00 145.90 2otd s PRO 93 Ca 0.61 -0.02 -0.31 0.00 0.04 0.00 0.00 61.00 61.32 2otd s PRO 93 Cb -0.23 -2.62 -0.10 0.00 0.04 0.00 0.00 34.50 31.60 2otd s PRO 93 CO 0.21 0.16 1.81 -0.51 0.04 0.00 0.00 177.00 178.72 2otd s LEU 94 N -3.78 4.40 -0.02 -3.56 1.43 -1.26 -4.69 118.68 111.20 2otd s LEU 94 Ca 0.44 2.71 -0.17 0.00 -1.03 0.00 0.00 54.13 56.08 2otd s LEU 94 Cb -0.10 -3.56 -0.06 0.00 0.03 0.00 0.00 46.19 42.50 2otd s LEU 94 CO 0.32 -0.99 0.47 -2.16 0.23 0.00 0.00 176.35 174.22 2otd s PRO 95 N 2.86 4.11 0.71 1.29 0.04 -1.26 -4.93 135.00 137.82 2otd s PRO 95 Ca 0.80 0.50 -0.14 0.00 0.04 0.00 0.00 61.00 62.20 2otd s PRO 95 Cb -0.45 -3.29 0.03 0.00 0.04 0.00 0.00 34.50 30.83 2otd s PRO 95 CO 0.36 0.53 1.15 -0.51 0.04 0.00 0.00 177.00 178.57 2otd s LEU 96 N -0.60 3.31 0.34 -3.56 1.43 -1.26 -1.46 118.68 116.87 2otd s LEU 96 Ca 0.26 2.13 0.11 0.00 -1.03 0.00 0.00 54.13 55.60 2otd s LEU 96 Cb -0.17 -4.56 0.60 0.00 0.03 0.00 0.00 46.19 42.09 2otd s LEU 96 CO 0.14 -1.98 1.76 0.25 0.23 0.00 0.00 176.35 176.75 2otd h LEU 97 N -0.28 0.05 -0.89 1.79 5.85 -1.23 -2.65 115.31 117.94 2otd h LEU 97 Ca -0.47 -0.02 -0.03 0.00 0.84 0.00 0.00 57.88 58.20 2otd h LEU 97 Cb 1.26 -0.01 -0.04 0.00 0.37 0.00 0.00 40.66 42.24 2otd h LEU 97 CO 0.51 0.47 0.36 0.77 -0.34 0.00 0.00 178.44 180.22 2otd h SER 98 N 0.04 1.06 -0.49 1.25 4.64 -1.93 -1.25 113.55 116.87 2otd h SER 98 Ca 0.00 -0.14 -0.10 0.00 -0.47 0.00 0.00 61.79 61.08 2otd h SER 98 Cb 0.76 -0.27 -0.02 0.00 -0.31 0.00 0.00 62.40 62.56 2otd h SER 98 CO 0.06 0.91 -0.07 1.56 -0.87 0.00 0.00 176.83 178.42 2otd h GLN 99 N 1.15 0.96 -0.54 4.77 4.20 -1.87 -2.53 115.11 121.25 2otd h GLN 99 Ca 0.27 -0.32 -0.09 0.00 0.06 0.00 0.00 58.65 58.57 2otd h GLN 99 Cb 0.15 -0.08 -0.02 0.00 0.30 0.00 0.00 27.48 27.83 2otd h GLN 99 CO -0.03 0.99 -0.01 0.28 -0.67 0.00 0.00 178.83 179.38 2otd h VAL 100 N 0.86 1.26 -0.71 -0.54 2.07 -1.17 -0.94 116.25 117.08 2otd h VAL 100 Ca 0.15 -1.13 0.08 0.00 0.82 0.00 0.00 66.70 66.61 2otd h VAL 100 Cb 0.60 0.92 -0.05 0.00 -1.52 0.00 0.00 31.29 31.25 2otd h VAL 100 CO 0.04 0.40 0.47 0.00 0.02 0.00 0.00 177.57 178.50 2otd h ALA 101 N 0.95 1.77 0.11 1.67 0.00 -1.11 -0.59 119.26 122.06 2otd h ALA 101 Ca 0.15 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 2otd h ALA 101 Cb 0.55 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.17 2otd h ALA 101 CO 0.03 0.10 -0.05 1.49 0.00 0.00 0.00 179.25 180.82 2otd h GLU 102 N 0.69 -0.15 -0.54 0.00 4.57 -0.94 -2.00 114.58 116.21 2otd h GLU 102 Ca 0.32 0.01 0.09 0.00 -1.18 0.00 0.00 59.36 58.60 2otd h GLU 102 Cb 0.35 0.03 -0.08 0.00 -0.16 0.00 0.00 28.75 28.89 2otd h GLU 102 CO -0.11 0.29 0.12 0.00 -1.18 0.00 0.00 179.01 178.13 2otd h ARG 103 N -0.65 0.25 -0.63 1.92 2.47 -0.80 -1.17 114.38 115.78 2otd h ARG 103 Ca -0.02 -0.02 0.13 0.00 -1.26 0.00 0.00 59.98 58.82 2otd h ARG 103 Cb 0.50 -0.06 -0.10 0.00 -1.65 0.00 0.00 29.97 28.67 2otd h ARG 103 CO 0.03 0.17 0.07 0.00 0.56 0.00 0.00 179.97 180.79 2otd h ARG 105 N 0.19 -0.12 -0.83 0.00 2.43 -0.47 -0.75 114.38 114.83 2otd h ARG 105 Ca 0.33 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.51 2otd h ARG 105 Cb 0.53 0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 30.07 2otd h ARG 105 CO -0.48 -0.07 0.53 0.93 -1.51 0.00 0.00 179.97 179.37 2otd h GLU 106 N -0.14 1.11 -0.28 0.20 5.08 -0.78 -2.36 114.58 117.41 2otd h GLU 106 Ca -0.01 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.27 2otd h GLU 106 Cb 0.11 -0.24 0.00 0.00 0.50 0.00 0.00 28.75 29.12 2otd h GLU 106 CO 0.02 0.76 0.00 0.72 -1.00 0.00 0.00 179.01 179.51 2otd n HIS 107 N -4.39 0.37 -2.95 4.33 8.25 -0.07 -5.11 115.22 115.65 2otd n HIS 107 Ca 0.09 -0.18 -0.00 0.00 -0.26 0.00 0.00 57.72 57.37 2otd n HIS 107 Cb 0.04 0.00 -0.00 0.00 1.12 0.00 0.00 29.99 31.15 2otd n HIS 107 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2otd n GLY 108 N 1.19 -2.12 3.59 -1.41 0.00 -0.29 -5.03 105.19 101.12 2otd n GLY 108 Ca 0.16 0.29 -0.02 0.00 0.00 0.00 0.00 46.02 46.45 2otd n GLY 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2otd s ALA 111 N -1.21 -2.30 -0.46 4.61 0.00 -1.26 -4.92 121.76 116.22 2otd s ALA 111 Ca -0.01 2.21 -0.11 0.00 0.00 0.00 0.00 51.96 54.04 2otd s ALA 111 Cb 0.00 -1.75 0.09 0.00 0.00 0.00 0.00 23.12 21.46 2otd s ALA 111 CO 0.38 -0.52 0.34 1.21 0.00 0.00 0.00 175.76 177.17 2otd s ASN 112 N 1.72 5.82 -0.49 0.00 3.04 -0.09 -0.54 114.94 124.40 2otd s ASN 112 Ca -0.08 -1.61 -0.26 0.00 0.04 0.00 0.00 52.86 50.95 2otd s ASN 112 Cb -0.05 -2.06 0.03 0.00 -1.54 0.00 0.00 41.25 37.63 2otd s ASN 112 CO -0.16 -0.64 1.00 -0.63 -3.04 0.00 0.00 177.10 173.62 2otd s ILE 113 N 1.47 4.36 -0.28 -5.21 1.01 -0.34 -2.21 121.20 120.01 2otd s ILE 113 Ca 0.04 0.80 -0.26 0.00 0.00 0.00 0.00 60.65 61.23 2otd s ILE 113 Cb -0.25 -4.51 0.00 0.00 0.01 0.00 0.00 42.46 37.71 2otd s ILE 113 CO 0.02 -0.96 0.90 -0.70 0.00 0.00 0.00 174.94 174.21 2otd s GLU 114 N 4.04 4.09 -0.38 2.79 2.12 0.62 -0.89 118.70 131.08 2otd s GLU 114 Ca 0.39 0.90 -0.29 0.00 0.36 0.00 0.00 54.97 56.33 2otd s GLU 114 Cb -0.09 -3.70 0.01 0.00 0.26 0.00 0.00 34.13 30.61 2otd s GLU 114 CO 0.27 -0.68 1.37 0.42 -0.54 0.00 0.00 175.26 176.10 2otd s ILE 115 N 3.12 3.98 -0.63 -3.70 1.01 0.85 -0.54 121.20 125.28 2otd s ILE 115 Ca 0.38 1.03 0.05 0.00 0.00 0.00 0.00 60.65 62.10 2otd s ILE 115 Cb -0.14 -4.21 0.18 0.00 0.01 0.00 0.00 42.46 38.30 2otd s ILE 115 CO 0.11 -0.69 0.48 1.17 0.00 0.00 0.00 174.94 176.00 2otd n LYS 116 N 7.86 1.49 -2.29 2.79 0.00 0.42 -4.54 118.16 123.90 2otd n LYS 116 Ca 0.16 -4.19 -0.34 0.00 0.00 0.00 0.00 58.31 53.94 2otd n LYS 116 Cb 0.48 -2.13 -0.01 0.00 0.00 0.00 0.00 35.03 33.37 2otd n LYS 116 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.40 176.15 2otd s PRO 117 N -1.18 3.46 0.28 1.64 0.04 -1.26 -4.32 135.00 133.67 2otd s PRO 117 Ca 0.28 1.45 -0.30 0.00 0.04 0.00 0.00 61.00 62.46 2otd s PRO 117 Cb -0.01 -2.04 -0.12 0.00 0.04 0.00 0.00 34.50 32.37 2otd s PRO 117 CO -0.17 -0.73 1.50 2.41 0.04 0.00 0.00 177.00 180.05 2otd n THR 118 N -1.38 1.12 -1.63 1.26 -1.04 -1.26 -4.87 114.28 106.48 2otd n THR 118 Ca 0.10 -0.28 -0.50 0.00 -2.04 0.00 0.00 64.05 61.33 2otd n THR 118 Cb 0.52 -1.76 -0.05 0.00 -1.82 0.00 0.00 70.33 67.22 2otd n THR 118 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 2otd n THR 119 N 1.84 0.05 -0.04 12.58 -1.04 -1.26 -1.24 114.28 125.17 2otd n THR 119 Ca 0.09 -0.01 0.00 0.00 -2.04 0.00 0.00 64.05 62.09 2otd n THR 119 Cb 0.35 -1.11 0.00 0.00 -1.82 0.00 0.00 70.33 67.75 2otd n THR 119 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2otd n GLY 120 N 2.99 0.44 0.26 3.41 0.00 -1.26 -4.97 105.19 106.06 2otd n GLY 120 Ca 0.19 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.29 2otd n GLY 120 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2otd n THR 121 N -2.00 2.00 0.32 2.61 -2.24 -0.37 -4.87 114.28 109.73 2otd n THR 121 Ca 0.00 -2.44 -0.18 0.00 -2.27 0.00 0.00 64.05 59.16 2otd n THR 121 Cb 0.00 -0.24 -0.09 0.00 -2.10 0.00 0.00 70.33 67.90 2otd n THR 121 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 2otd h GLY 122 N 0.35 -1.07 0.49 3.38 0.00 -1.93 0.20 103.07 104.50 2otd h GLY 122 Ca 0.01 0.47 0.05 0.00 0.00 0.00 0.00 47.33 47.85 2otd h GLY 122 CO 0.03 -0.36 -0.09 -2.55 0.00 0.00 0.00 176.54 173.56 2otd h PRO 123 N -0.94 -0.07 -0.59 4.80 0.11 -1.90 0.99 132.00 134.40 2otd h PRO 123 Ca -0.06 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.05 2otd h PRO 123 Cb 0.79 0.02 -0.03 0.00 0.11 0.00 0.00 31.00 31.89 2otd h PRO 123 CO 0.01 -0.04 0.38 1.25 -0.21 0.00 0.00 178.00 179.39 2otd h LEU 124 N -0.07 0.69 -0.47 2.35 5.85 -1.91 -2.21 115.31 119.54 2otd h LEU 124 Ca 0.11 -0.03 -0.08 0.00 0.84 0.00 0.00 57.88 58.72 2otd h LEU 124 Cb 0.23 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.07 2otd h LEU 124 CO -0.25 0.52 -0.01 0.74 -0.34 0.00 0.00 178.44 179.10 2otd h THR 125 N 0.80 1.26 -0.62 1.05 2.02 0.48 -3.00 112.91 114.91 2otd h THR 125 Ca 0.21 -1.08 0.04 0.00 0.77 0.00 0.00 66.41 66.36 2otd h THR 125 Cb -0.07 1.01 -0.05 0.00 -1.74 0.00 0.00 68.15 67.31 2otd h THR 125 CO -0.04 0.37 0.36 1.23 0.37 0.00 0.00 175.52 177.81 2otd h GLY 126 N 0.70 0.89 -0.91 2.16 0.00 0.11 -1.76 103.07 104.26 2otd h GLY 126 Ca 0.13 -0.26 0.00 0.00 0.00 0.00 0.00 47.33 47.21 2otd h GLY 126 CO 0.03 0.19 0.00 1.17 0.00 0.00 0.00 176.54 177.92 2otd n LYS 127 N -4.77 0.51 0.00 4.80 4.81 -0.85 -1.89 118.16 120.77 2otd n LYS 127 Ca 0.07 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.51 2otd n LYS 127 Cb 0.12 -1.23 0.00 0.00 0.02 0.00 0.00 35.03 33.94 2otd n LYS 127 CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 2otd n VAL 129 N 0.18 0.00 -0.13 3.15 0.31 -0.66 -1.75 118.33 119.42 2otd n VAL 129 Ca 0.00 0.00 -0.04 0.00 -0.01 0.00 0.00 64.34 64.29 2otd n VAL 129 Cb 0.12 0.00 0.04 0.00 -0.91 0.00 0.00 33.84 33.09 2otd n VAL 129 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2otd h ALA 130 N 0.00 0.47 -0.34 3.52 0.00 -1.60 0.36 119.26 121.67 2otd h ALA 130 Ca 0.00 0.08 -0.13 0.00 0.00 0.00 0.00 54.91 54.86 2otd h ALA 130 Cb 0.00 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 2otd h ALA 130 CO 0.00 -0.31 -0.32 -0.07 0.00 0.00 0.00 179.25 178.55 2otd h LEU 131 N 0.22 0.78 -0.53 0.00 -0.00 -1.60 -2.43 115.31 111.75 2otd h LEU 131 Ca 0.21 -0.32 -0.13 0.00 -0.00 0.00 0.00 57.88 57.63 2otd h LEU 131 Cb 0.25 -0.22 -0.01 0.00 -0.00 0.00 0.00 40.66 40.68 2otd h LEU 131 CO -0.27 1.04 -0.24 0.00 -0.00 0.00 0.00 178.44 178.97 2otd h ALA 132 N 1.01 0.72 -0.21 1.53 0.00 -1.62 -2.37 119.26 118.32 2otd h ALA 132 Ca 0.07 -0.40 0.04 0.00 0.00 0.00 0.00 54.91 54.62 2otd h ALA 132 Cb 0.85 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.44 2otd h ALA 132 CO 0.07 0.67 -0.02 0.00 0.00 0.00 0.00 179.25 179.97 2otd h ALA 133 N 0.91 0.17 -0.92 0.00 0.00 -0.26 -0.41 119.26 118.75 2otd h ALA 133 Ca 0.10 0.07 0.17 0.00 0.00 0.00 0.00 54.91 55.25 2otd h ALA 133 Cb 0.81 0.12 -0.10 0.00 0.00 0.00 0.00 17.79 18.62 2otd h ALA 133 CO 0.07 -0.45 0.50 -0.09 0.00 0.00 0.00 179.25 179.28 2otd h ARG 134 N 0.04 0.64 0.27 0.00 2.43 -1.22 -1.16 114.38 115.37 2otd h ARG 134 Ca 0.10 -0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.22 2otd h ARG 134 Cb 0.14 -0.14 0.00 0.00 -0.42 0.00 0.00 29.97 29.55 2otd h ARG 134 CO -0.19 0.42 -0.13 0.37 -1.51 0.00 0.00 179.97 178.93 2otd h GLN 135 N 0.65 -0.35 0.00 0.20 4.15 -0.85 -3.28 115.11 115.62 2otd h GLN 135 Ca 0.52 0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.97 2otd h GLN 135 Cb 0.80 0.08 0.00 0.00 0.21 0.00 0.00 27.48 28.57 2otd h GLN 135 CO -0.39 -0.13 0.00 -0.07 -1.93 0.00 0.00 178.83 176.31 2otd h LEU 136 N -1.05 0.00 -2.67 -2.39 3.38 -0.95 -2.51 115.31 109.11 2otd h LEU 136 Ca -0.04 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.93 2otd h LEU 136 Cb 0.39 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.14 2otd h LEU 136 CO 0.06 0.00 0.00 0.79 0.09 0.00 0.00 178.44 179.38 2otd n TRP 137 N -2.82 0.65 -1.62 1.13 8.01 -0.45 -4.92 117.44 117.42 2otd n TRP 137 Ca 0.01 -0.44 -0.45 0.00 -1.31 0.00 0.00 57.50 55.31 2otd n TRP 137 Cb 0.26 -0.01 -0.02 0.00 -2.01 0.00 0.00 31.31 29.53 2otd n TRP 137 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.69 176.68 2otd n ALA 138 N 1.11 0.17 -1.74 6.99 0.00 -0.95 -4.61 120.51 121.49 2otd n ALA 138 Ca 0.18 0.41 0.00 0.00 0.00 0.00 0.00 53.44 54.02 2otd n ALA 138 Cb 0.52 -2.11 0.00 0.00 0.00 0.00 0.00 19.45 17.86 2otd n ALA 138 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2otd n GLY 139 N 1.56 0.41 3.71 0.00 0.00 -1.26 -5.12 105.19 104.50 2otd n GLY 139 Ca 0.11 -0.91 -0.42 0.00 0.00 0.00 0.00 46.02 44.80 2otd n GLY 139 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2otd s THR 141 N -2.00 3.84 0.35 2.61 2.01 -1.26 -5.21 115.64 115.98 2otd s THR 141 Ca 0.00 1.32 -0.28 0.00 0.31 0.00 0.00 61.69 63.03 2otd s THR 141 Cb 0.00 -3.84 -0.11 0.00 0.01 0.00 0.00 72.50 68.56 2otd s THR 141 CO 0.00 0.10 1.40 -2.84 -0.69 0.00 0.00 174.62 172.59 2otd s PRO 142 N 1.08 4.24 0.43 4.92 0.02 -1.26 -4.86 135.00 139.57 2otd s PRO 142 Ca 0.60 2.38 -0.21 0.00 0.02 0.00 0.00 61.00 63.79 2otd s PRO 142 Cb -0.31 -3.03 -0.10 0.00 0.02 0.00 0.00 34.50 31.08 2otd s PRO 142 CO 0.29 -0.36 0.97 -1.25 -0.33 0.00 0.00 177.00 176.33 2otd s PRO 143 N -1.85 4.17 -0.46 5.54 0.04 -1.26 -4.85 135.00 136.33 2otd s PRO 143 Ca 0.51 1.19 -0.22 0.00 0.04 0.00 0.00 61.00 62.51 2otd s PRO 143 Cb -0.43 -2.21 0.03 0.00 0.04 0.00 0.00 34.50 31.93 2otd s PRO 143 CO 0.57 -0.09 0.75 -1.17 0.04 0.00 0.00 177.00 177.11 2otd s LEU 144 N -3.16 4.34 -0.02 -3.56 2.96 0.30 -4.36 118.68 115.18 2otd s LEU 144 Ca 0.62 -0.23 -0.30 0.00 -0.22 0.00 0.00 54.13 54.00 2otd s LEU 144 Cb -0.11 -2.87 -0.03 0.00 0.50 0.00 0.00 46.19 43.68 2otd s LEU 144 CO 0.15 -0.91 1.05 -0.76 -1.32 0.00 0.00 176.35 174.57 2otd s LEU 145 N 3.19 4.33 0.16 -0.68 1.02 -0.74 -1.19 118.68 124.77 2otd s LEU 145 Ca 0.27 1.72 0.09 0.00 0.02 0.00 0.00 54.13 56.23 2otd s LEU 145 Cb -0.13 -3.57 -0.04 0.00 0.02 0.00 0.00 46.19 42.47 2otd s LEU 145 CO 0.21 -0.38 -0.18 -0.44 0.02 0.00 0.00 176.35 175.58 2otd s SER 146 N 1.09 2.70 -0.17 2.29 0.01 -0.07 -0.25 113.70 119.30 2otd s SER 146 Ca 0.53 -0.86 -0.31 0.00 1.31 0.00 0.00 55.95 56.62 2otd s SER 146 Cb -0.22 -0.16 0.14 0.00 0.21 0.00 0.00 66.02 65.99 2otd s SER 146 CO 0.25 -0.03 1.10 -0.55 0.41 0.00 0.00 173.24 174.42 2otd s SER 147 N -2.66 -0.26 0.34 2.44 0.15 -1.05 -0.10 113.70 112.56 2otd s SER 147 Ca 0.16 0.20 0.24 0.00 0.70 0.00 0.00 55.95 57.25 2otd s SER 147 Cb -0.06 0.23 0.52 0.00 -1.71 0.00 0.00 66.02 65.00 2otd s SER 147 CO 0.07 -0.29 1.66 -0.26 1.20 0.00 0.00 173.24 175.61 2otd h PHE 148 N 2.28 0.00 -3.65 3.44 0.04 -1.80 -1.18 116.94 116.07 2otd h PHE 148 Ca -0.15 0.00 -0.64 0.00 2.80 0.00 0.00 57.97 59.98 2otd h PHE 148 Cb 1.18 0.00 -0.15 0.00 2.20 0.00 0.00 35.95 39.18 2otd h PHE 148 CO 0.26 0.00 -0.14 -1.21 -0.60 0.00 0.00 178.31 176.63 2otd s GLU 149 N -3.17 3.80 0.33 1.51 0.41 -1.26 -4.88 118.70 115.44 2otd s GLU 149 Ca 0.08 -0.07 0.03 0.00 -0.41 0.00 0.00 54.97 54.60 2otd s GLU 149 Cb 0.08 -3.74 0.63 0.00 -1.78 0.00 0.00 34.13 29.32 2otd s GLU 149 CO 0.64 -0.47 1.95 0.82 -0.49 0.00 0.00 175.26 177.71 2otd h ILE 150 N 5.50 1.07 0.00 -1.63 1.08 -1.97 -1.66 117.51 119.90 2otd h ILE 150 Ca -0.29 -0.31 0.00 0.00 -0.39 0.00 0.00 64.86 63.87 2otd h ILE 150 Cb 1.14 0.09 0.00 0.00 -3.07 0.00 0.00 36.82 34.99 2otd h ILE 150 CO 0.71 0.16 0.00 0.47 -0.69 0.00 0.00 178.15 178.81 2otd n ASP 151 N -4.47 0.00 0.09 1.72 8.00 -1.26 -1.53 116.55 119.09 2otd n ASP 151 Ca 0.11 0.32 -0.08 0.00 0.71 0.00 0.00 54.79 55.85 2otd n ASP 151 Cb 0.18 -0.13 -0.01 0.00 -0.02 0.00 0.00 41.12 41.13 2otd n ASP 151 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2otd h ALA 152 N -0.48 0.51 -0.54 2.24 0.00 -1.51 -2.96 119.26 116.53 2otd h ALA 152 Ca 0.00 -0.73 -0.07 0.00 0.00 0.00 0.00 54.91 54.11 2otd h ALA 152 Cb 0.00 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.69 2otd h ALA 152 CO 0.00 0.93 0.07 -0.07 0.00 0.00 0.00 179.25 180.19 2otd h LEU 153 N 0.10 0.86 -1.11 0.00 3.38 -1.32 -0.99 115.31 116.23 2otd h LEU 153 Ca -0.04 -0.27 0.01 0.00 0.09 0.00 0.00 57.88 57.67 2otd h LEU 153 Cb 1.52 -0.23 -0.05 0.00 0.09 0.00 0.00 40.66 41.99 2otd h LEU 153 CO 0.13 0.91 0.60 -0.33 0.09 0.00 0.00 178.44 179.85 2otd h GLU 154 N 0.78 1.18 -0.02 1.13 5.08 -1.13 0.39 114.58 121.98 2otd h GLU 154 Ca 0.16 -0.07 -0.17 0.00 -1.00 0.00 0.00 59.36 58.28 2otd h GLU 154 Cb 0.43 -0.27 -0.01 0.00 0.50 0.00 0.00 28.75 29.40 2otd h GLU 154 CO 0.01 0.78 -0.77 0.00 -1.00 0.00 0.00 179.01 178.04 2otd h ALA 155 N 1.44 0.68 -0.16 3.43 0.00 -1.34 -2.83 119.26 120.48 2otd h ALA 155 Ca 0.34 -0.66 -0.17 0.00 0.00 0.00 0.00 54.91 54.42 2otd h ALA 155 Cb -0.11 -0.09 -0.00 0.00 0.00 0.00 0.00 17.79 17.59 2otd h ALA 155 CO -0.08 0.87 -0.61 0.00 0.00 0.00 0.00 179.25 179.42 2otd h ALA 156 N 1.11 0.63 0.00 0.00 0.00 -0.87 -1.63 119.26 118.50 2otd h ALA 156 Ca -0.02 -0.54 -0.01 0.00 0.00 0.00 0.00 54.91 54.34 2otd h ALA 156 Cb 1.34 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 19.06 2otd h ALA 156 CO 0.11 0.71 -0.03 0.37 0.00 0.00 0.00 179.25 180.41 2otd h GLN 157 N 0.41 0.00 0.02 0.00 4.15 -0.69 -1.17 115.11 117.83 2otd h GLN 157 Ca -0.01 0.00 -0.31 0.00 0.77 0.00 0.00 58.65 59.10 2otd h GLN 157 Cb 1.17 0.00 -0.04 0.00 0.21 0.00 0.00 27.48 28.82 2otd h GLN 157 CO 0.11 0.03 -1.70 1.04 -1.93 0.00 0.00 178.83 176.38 2otd n GLN 158 N -3.93 0.60 -0.16 1.69 1.13 -1.11 -3.91 117.38 111.69 2otd n GLN 158 Ca -0.03 0.45 -0.09 0.00 -1.94 0.00 0.00 57.00 55.39 2otd n GLN 158 Cb 0.12 -1.68 0.00 0.00 0.11 0.00 0.00 30.24 28.79 2otd n GLN 158 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2otd h ALA 159 N -0.49 0.61 -2.39 -1.58 0.00 -1.22 -3.37 119.26 110.82 2otd h ALA 159 Ca -0.45 -0.21 -0.59 0.00 0.00 0.00 0.00 54.91 53.67 2otd h ALA 159 Cb 1.51 -0.18 -0.38 0.00 0.00 0.00 0.00 17.79 18.74 2otd h ALA 159 CO -0.21 0.31 -0.96 0.00 0.00 0.00 0.00 179.25 178.39 2otd s ALA 160 N -5.28 1.37 0.28 0.00 0.00 -0.45 -4.81 121.76 112.86 2otd s ALA 160 Ca -0.13 -2.40 -0.02 0.00 0.00 0.00 0.00 51.96 49.41 2otd s ALA 160 Cb 0.11 -1.60 0.44 0.00 0.00 0.00 0.00 23.12 22.07 2otd s ALA 160 CO 0.79 -1.99 1.90 -1.35 0.00 0.00 0.00 175.76 175.11 2otd h PRO 161 N 5.77 1.11 -0.07 0.00 0.11 -1.69 -2.74 132.00 134.48 2otd h PRO 161 Ca 0.25 -0.07 -0.06 0.00 0.11 0.00 0.00 66.00 66.23 2otd h PRO 161 Cb 0.91 -0.25 -0.01 0.00 0.11 0.00 0.00 31.00 31.76 2otd h PRO 161 CO 0.36 0.73 -0.24 1.05 -0.21 0.00 0.00 178.00 179.69 2otd h GLU 162 N 1.14 0.11 -6.46 1.05 9.09 -1.91 -3.43 114.58 114.17 2otd h GLU 162 Ca 0.41 -0.03 -0.53 0.00 0.05 0.00 0.00 59.36 59.26 2otd h GLU 162 Cb 0.15 -0.01 0.02 0.00 -1.65 0.00 0.00 28.75 27.26 2otd h GLU 162 CO -0.15 0.36 0.93 -0.51 0.05 0.00 0.00 179.01 179.68 2otd s LEU 163 N -8.51 4.36 0.65 3.06 1.02 -1.03 -4.95 118.68 113.27 2otd s LEU 163 Ca -0.04 2.42 -0.16 0.00 0.02 0.00 0.00 54.13 56.37 2otd s LEU 163 Cb 0.15 -3.57 -0.00 0.00 0.02 0.00 0.00 46.19 42.79 2otd s LEU 163 CO 0.73 -0.83 1.12 -2.16 0.02 0.00 0.00 176.35 175.23 2otd s PRO 164 N 2.30 2.80 0.04 1.29 0.04 -1.26 -4.89 135.00 135.32 2otd s PRO 164 Ca 0.71 1.46 0.04 0.00 0.04 0.00 0.00 61.00 63.25 2otd s PRO 164 Cb -0.38 -1.94 -0.02 0.00 0.04 0.00 0.00 34.50 32.19 2otd s PRO 164 CO 0.31 -1.26 -0.13 1.03 0.04 0.00 0.00 177.00 176.99 2otd s ARG 165 N -3.96 0.82 0.03 4.56 0.52 -1.26 -1.80 118.95 117.86 2otd s ARG 165 Ca 0.69 -0.74 0.04 0.00 -0.52 0.00 0.00 55.73 55.20 2otd s ARG 165 Cb -0.22 -0.80 -0.02 0.00 0.52 0.00 0.00 34.95 34.44 2otd s ARG 165 CO 0.40 0.19 -0.11 0.20 0.02 0.00 0.00 175.30 176.00 2otd s GLY 166 N -1.20 0.63 -0.26 -3.53 0.00 0.65 -2.37 107.32 101.25 2otd s GLY 166 Ca -0.00 -0.68 -0.12 0.00 0.00 0.00 0.00 44.72 43.92 2otd s GLY 166 CO 0.01 -0.65 0.21 -2.27 0.00 0.00 0.00 173.10 170.40 2otd s LEU 167 N -0.93 4.06 -0.11 0.66 2.96 -1.03 -2.53 118.68 121.75 2otd s LEU 167 Ca 0.00 0.10 -0.21 0.00 -0.22 0.00 0.00 54.13 53.80 2otd s LEU 167 Cb -0.07 -2.17 -0.04 0.00 0.50 0.00 0.00 46.19 44.41 2otd s LEU 167 CO 0.01 -0.03 0.61 -0.76 -1.32 0.00 0.00 176.35 174.86 2otd s LEU 168 N 1.53 4.26 -0.11 -0.68 2.01 -0.45 0.20 118.68 125.44 2otd s LEU 168 Ca 0.09 0.98 0.00 0.00 0.01 0.00 0.00 54.13 55.21 2otd s LEU 168 Cb -0.15 -2.91 0.02 0.00 0.01 0.00 0.00 46.19 43.16 2otd s LEU 168 CO 0.08 -0.11 -0.10 -0.76 1.01 0.00 0.00 176.35 176.47 2otd s LEU 169 N 1.00 1.38 0.05 1.79 1.43 -0.20 -4.36 118.68 119.76 2otd s LEU 169 Ca 0.32 -0.34 0.25 0.00 -1.03 0.00 0.00 54.13 53.32 2otd s LEU 169 Cb -0.16 -0.91 0.45 0.00 0.03 0.00 0.00 46.19 45.60 2otd s LEU 169 CO 0.14 -0.07 1.38 -0.67 0.23 0.00 0.00 176.35 177.35 2otd n ASP 170 N 4.67 0.56 -3.92 2.29 2.03 -1.26 -2.37 116.55 118.55 2otd n ASP 170 Ca -0.15 -0.08 -0.10 0.00 0.52 0.00 0.00 54.79 54.97 2otd n ASP 170 Cb 0.50 0.22 -0.12 0.00 -0.72 0.00 0.00 41.12 41.01 2otd n ASP 170 CO 0.00 0.00 0.00 -1.61 -1.92 0.00 0.00 177.20 173.67 2otd s GLU 171 N -3.07 0.27 0.42 -0.67 0.41 -1.26 -4.80 118.70 109.99 2otd s GLU 171 Ca 0.09 -0.35 -0.25 0.00 -0.41 0.00 0.00 54.97 54.05 2otd s GLU 171 Cb 0.16 0.10 -0.08 0.00 -1.78 0.00 0.00 34.13 32.53 2otd s GLU 171 CO 0.71 -0.05 1.25 -0.46 -0.49 0.00 0.00 175.26 176.22 2otd s TRP 172 N -0.97 2.87 -0.12 1.61 -0.11 -1.26 -5.03 118.94 115.93 2otd s TRP 172 Ca -0.11 1.47 0.01 0.00 1.22 0.00 0.00 56.10 58.69 2otd s TRP 172 Cb -0.06 -3.56 0.02 0.00 -1.50 0.00 0.00 33.47 28.36 2otd s TRP 172 CO -0.00 -1.84 -0.13 1.03 -4.62 0.00 0.00 176.95 171.39 2otd s ARG 173 N -2.35 2.06 0.60 5.86 0.52 -1.26 -5.03 118.95 119.35 2otd s ARG 173 Ca 0.59 -0.48 0.38 0.00 -0.52 0.00 0.00 55.73 55.69 2otd s ARG 173 Cb -0.35 -1.85 1.83 0.00 0.52 0.00 0.00 34.95 35.10 2otd s ARG 173 CO 0.44 -0.15 2.16 -0.44 0.02 0.00 0.00 175.30 177.33 2otd h ASP 174 N 7.73 0.00 -0.56 0.23 3.32 -2.08 -2.51 116.42 122.56 2otd h ASP 174 Ca -0.33 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.72 2otd h ASP 174 Cb 1.15 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.70 2otd h ASP 174 CO 0.48 0.01 0.00 -0.90 -1.72 0.00 0.00 179.24 177.11 2otd n ASP 175 N -3.12 5.03 -0.25 6.45 5.75 -1.26 -4.64 116.55 124.51 2otd n ASP 175 Ca -0.01 -2.69 0.17 0.00 -0.01 0.00 0.00 54.79 52.25 2otd n ASP 175 Cb 0.20 -0.63 0.46 0.00 -1.03 0.00 0.00 41.12 40.13 2otd n ASP 175 CO 0.00 0.00 0.00 4.11 -0.11 0.00 0.00 177.20 181.20 2otd h TRP 176 N 3.73 0.65 0.24 2.11 5.08 -1.88 -0.78 115.95 125.10 2otd h TRP 176 Ca 0.00 0.02 -0.01 0.00 1.08 0.00 0.00 58.89 59.98 2otd h TRP 176 Cb 1.68 -0.20 0.00 0.00 -3.00 0.00 0.00 29.16 27.64 2otd h TRP 176 CO 0.90 0.19 -0.11 -0.09 -1.28 0.00 0.00 178.44 178.05 2otd h ARG 177 N 0.50 -0.31 -0.62 0.12 2.43 -1.87 -0.36 114.38 114.27 2otd h ARG 177 Ca 0.47 0.02 -0.07 0.00 -0.81 0.00 0.00 59.98 59.59 2otd h ARG 177 Cb 1.03 0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 30.62 2otd h ARG 177 CO -0.20 -0.04 0.11 1.05 -1.51 0.00 0.00 179.97 179.38 2otd h GLU 178 N -0.56 1.01 -0.05 0.20 -0.00 -1.77 -1.83 114.58 111.58 2otd h GLU 178 Ca -0.03 -0.25 -0.01 0.00 -0.00 0.00 0.00 59.36 59.07 2otd h GLU 178 Cb 0.41 -0.13 -0.00 0.00 -0.00 0.00 0.00 28.75 29.03 2otd h GLU 178 CO 0.05 0.92 -0.01 1.25 -0.00 0.00 0.00 179.01 181.23 2otd h LEU 179 N 0.95 0.09 -0.75 3.06 5.85 -1.14 -1.44 115.31 121.94 2otd h LEU 179 Ca 0.19 -0.36 -0.03 0.00 0.84 0.00 0.00 57.88 58.52 2otd h LEU 179 Cb 0.40 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 41.37 2otd h LEU 179 CO 0.01 0.42 0.33 0.71 -0.34 0.00 0.00 178.44 179.57 2otd h THR 180 N -0.25 1.25 0.02 1.05 1.35 -1.03 -1.58 112.91 113.71 2otd h THR 180 Ca 0.01 -0.73 0.03 0.00 -0.55 0.00 0.00 66.41 65.17 2otd h THR 180 Cb 0.38 0.34 -0.04 0.00 -1.73 0.00 0.00 68.15 67.10 2otd h THR 180 CO 0.00 0.30 -0.27 0.00 -0.25 0.00 0.00 175.52 175.31 2otd h ALA 181 N 1.17 -0.38 -0.22 6.62 0.00 -1.24 -0.42 119.26 124.78 2otd h ALA 181 Ca 0.25 -0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.17 2otd h ALA 181 Cb 0.16 0.47 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 2otd h ALA 181 CO -0.03 -0.78 0.10 -0.09 0.00 0.00 0.00 179.25 178.45 2otd h ARG 182 N -0.42 0.21 0.00 0.00 2.43 -1.12 -1.44 114.38 114.04 2otd h ARG 182 Ca 0.06 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.21 2otd h ARG 182 Cb 0.50 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.00 2otd h ARG 182 CO -0.22 0.14 0.00 -0.07 -1.51 0.00 0.00 179.97 178.31 2otd h LEU 183 N 0.22 0.00 0.10 3.80 4.07 -1.21 -3.47 115.31 118.82 2otd h LEU 183 Ca 0.09 0.00 -0.28 0.00 0.08 0.00 0.00 57.88 57.77 2otd h LEU 183 Cb 0.04 0.00 0.06 0.00 1.08 0.00 0.00 40.66 41.83 2otd h LEU 183 CO -0.07 0.00 -0.43 0.61 -1.08 0.00 0.00 178.44 177.46 2otd n GLY 184 N -0.58 -0.13 3.72 0.83 0.00 -0.28 -4.95 105.19 103.81 2otd n GLY 184 Ca -0.00 -0.12 -0.42 0.00 0.00 0.00 0.00 46.02 45.48 2otd n GLY 184 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2otd h VAL 186 N 4.10 1.29 -3.17 0.00 -1.51 -1.82 -3.47 116.25 111.67 2otd h VAL 186 Ca -0.43 -1.41 -0.48 0.00 -1.23 0.00 0.00 66.70 63.15 2otd h VAL 186 Cb 1.21 1.45 -0.17 0.00 -2.13 0.00 0.00 31.29 31.66 2otd h VAL 186 CO 0.81 0.46 -0.76 -0.94 -1.23 0.00 0.00 177.57 175.92 2otd s SER 187 N -6.57 2.53 -0.11 4.19 1.04 -1.04 -2.13 113.70 111.62 2otd s SER 187 Ca -0.12 -0.92 0.03 0.00 0.48 0.00 0.00 55.95 55.42 2otd s SER 187 Cb 0.10 -0.14 0.01 0.00 0.10 0.00 0.00 66.02 66.09 2otd s SER 187 CO 0.84 -0.11 -0.21 -0.51 0.98 0.00 0.00 173.24 174.23 2otd s ILE 188 N -2.43 1.87 -0.29 -1.02 2.07 0.33 -2.48 121.20 119.25 2otd s ILE 188 Ca 0.17 -0.90 -0.04 0.00 -1.41 0.00 0.00 60.65 58.48 2otd s ILE 188 Cb -0.04 -1.64 0.03 0.00 0.13 0.00 0.00 42.46 40.94 2otd s ILE 188 CO 0.06 0.52 0.03 -1.00 -1.91 0.00 0.00 174.94 172.63 2otd s HIS 189 N 0.57 3.18 0.01 3.50 3.76 0.13 -2.16 115.29 124.29 2otd s HIS 189 Ca -0.14 -1.49 0.09 0.00 -0.15 0.00 0.00 55.06 53.37 2otd s HIS 189 Cb -0.17 -2.17 -0.02 0.00 1.11 0.00 0.00 32.58 31.33 2otd s HIS 189 CO 0.05 -0.72 -0.26 -0.51 -0.85 0.00 0.00 174.74 172.45 2otd s LEU 190 N 1.36 2.10 0.21 0.89 1.43 -0.04 -1.04 118.68 123.60 2otd s LEU 190 Ca -0.01 -0.52 -0.32 0.00 -1.03 0.00 0.00 54.13 52.25 2otd s LEU 190 Cb -0.18 -1.30 -0.14 0.00 0.03 0.00 0.00 46.19 44.59 2otd s LEU 190 CO -0.00 0.29 1.36 -3.20 0.23 0.00 0.00 176.35 175.03 2otd n ASN 191 N 2.14 2.42 0.23 2.29 2.85 -1.00 -2.19 115.26 122.01 2otd n ASN 191 Ca -0.16 1.14 0.07 0.00 -0.11 0.00 0.00 54.58 55.51 2otd n ASN 191 Cb 0.51 -1.37 0.55 0.00 1.24 0.00 0.00 39.78 40.71 2otd n ASN 191 CO 0.00 0.00 0.00 1.12 -2.11 0.00 0.00 177.26 176.27 2otd h HIS 192 N 4.16 0.00 -0.25 1.20 2.07 -1.53 -2.68 115.15 118.12 2otd h HIS 192 Ca -0.45 0.00 0.06 0.00 -2.85 0.00 0.00 60.37 57.13 2otd h HIS 192 Cb 1.29 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 31.26 2otd h HIS 192 CO 0.56 0.16 0.18 0.87 -3.07 0.00 0.00 177.93 176.63 2otd h LYS 193 N 0.00 0.06 0.00 5.12 1.79 -1.90 -2.70 116.57 118.94 2otd h LYS 193 Ca -0.00 -0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.46 2otd h LYS 193 Cb 0.29 -0.01 0.00 0.00 -1.58 0.00 0.00 32.23 30.92 2otd h LYS 193 CO 0.02 0.04 0.00 1.28 -1.08 0.00 0.00 179.45 179.71 2otd n LEU 194 N -4.48 0.31 -4.91 2.94 4.77 -1.01 -4.87 117.00 109.76 2otd n LEU 194 Ca 0.03 0.54 -0.28 0.00 -0.03 0.00 0.00 56.01 56.27 2otd n LEU 194 Cb 0.29 -0.46 -0.03 0.00 -2.33 0.00 0.00 43.42 40.89 2otd n LEU 194 CO 0.35 -0.17 0.22 -0.76 -1.33 0.00 0.00 177.39 175.69 2otd s LEU 195 N -3.61 4.03 0.36 2.23 2.01 -1.02 -4.98 118.68 117.70 2otd s LEU 195 Ca 0.10 0.70 -0.12 0.00 0.01 0.00 0.00 54.13 54.83 2otd s LEU 195 Cb 0.14 -3.53 0.04 0.00 0.01 0.00 0.00 46.19 42.84 2otd s LEU 195 CO 0.48 -0.23 0.68 1.51 1.01 0.00 0.00 176.35 179.80 2otd s ASP 196 N -3.31 0.26 0.32 2.29 1.47 -1.26 -5.04 116.67 111.40 2otd s ASP 196 Ca 0.44 -1.20 0.07 0.00 1.18 0.00 0.00 52.55 53.04 2otd s ASP 196 Cb -0.11 0.78 0.78 0.00 -0.34 0.00 0.00 42.92 44.03 2otd s ASP 196 CO 0.31 -1.53 1.79 0.50 0.68 0.00 0.00 175.17 176.92 2otd h LYS 197 N 2.04 0.71 0.58 2.11 1.63 -1.99 -2.77 116.57 118.89 2otd h LYS 197 Ca -0.30 -0.04 -0.03 0.00 -0.85 0.00 0.00 60.65 59.43 2otd h LYS 197 Cb 1.25 -0.16 0.01 0.00 -0.60 0.00 0.00 32.23 32.72 2otd h LYS 197 CO 0.39 0.47 -0.28 0.00 -3.45 0.00 0.00 179.45 176.58 2otd h ALA 198 N 1.63 -0.98 -0.89 5.00 0.00 -1.99 -3.23 119.26 118.81 2otd h ALA 198 Ca 0.56 -0.17 0.13 0.00 0.00 0.00 0.00 54.91 55.43 2otd h ALA 198 Cb 0.92 0.30 -0.09 0.00 0.00 0.00 0.00 17.79 18.92 2otd h ALA 198 CO -0.34 -0.92 0.51 0.00 0.00 0.00 0.00 179.25 178.49 2otd h ARG 199 N -0.96 0.74 -0.05 0.00 3.08 -1.92 -0.92 114.38 114.35 2otd h ARG 199 Ca -0.08 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 59.93 2otd h ARG 199 Cb 0.60 -0.17 0.00 0.00 0.08 0.00 0.00 29.97 30.48 2otd h ARG 199 CO 0.13 0.49 0.00 0.28 -1.07 0.00 0.00 179.97 179.80 2otd n VAL 200 N -4.77 0.00 0.00 2.04 0.31 -1.05 -0.45 118.33 114.41 2otd n VAL 200 Ca 0.17 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.50 2otd n VAL 200 Cb 0.39 -0.01 0.00 0.00 -0.91 0.00 0.00 33.84 33.31 2otd n VAL 200 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2otd n GLN 202 N 0.39 0.00 -0.31 5.55 10.64 -0.35 -1.22 117.38 132.08 2otd n GLN 202 Ca 0.00 0.00 -0.04 0.00 -1.83 0.00 0.00 57.00 55.13 2otd n GLN 202 Cb 0.00 0.00 0.08 0.00 -0.86 0.00 0.00 30.24 29.46 2otd n GLN 202 CO 0.00 0.00 0.00 -0.07 -1.83 0.00 0.00 177.06 175.16 2otd h LEU 203 N 0.00 1.01 -0.14 2.61 3.38 -1.02 -1.94 115.31 119.21 2otd h LEU 203 Ca 0.00 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 57.89 2otd h LEU 203 Cb 0.00 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.49 2otd h LEU 203 CO 0.00 0.78 0.05 0.11 0.09 0.00 0.00 178.44 179.47 2otd h LYS 204 N 1.15 0.21 -0.66 1.13 1.57 -1.34 -2.55 116.57 116.08 2otd h LYS 204 Ca 0.30 -0.04 0.03 0.00 -1.87 0.00 0.00 60.65 59.06 2otd h LYS 204 Cb -0.04 -0.03 -0.04 0.00 0.08 0.00 0.00 32.23 32.20 2otd h LYS 204 CO -0.06 0.32 0.44 -0.44 -0.57 0.00 0.00 179.45 179.15 2otd h ASP 205 N 0.06 0.70 0.00 0.86 3.32 -1.78 0.43 116.42 120.01 2otd h ASP 205 Ca 0.05 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.08 2otd h ASP 205 Cb 0.19 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 39.58 2otd h ASP 205 CO -0.00 0.49 0.00 0.00 -1.72 0.00 0.00 179.24 178.01 2otd n ALA 206 N -2.44 2.09 -0.36 3.45 0.00 -0.74 -4.84 120.51 117.66 2otd n ALA 206 Ca 0.08 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.42 2otd n ALA 206 Cb 0.10 -1.24 0.00 0.00 0.00 0.00 0.00 19.45 18.31 2otd n ALA 206 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2otd n GLY 207 N 0.01 0.82 3.81 0.00 0.00 0.15 -5.06 105.19 104.92 2otd n GLY 207 Ca 0.11 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.76 2otd n GLY 207 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2otd s LEU 208 N 0.00 4.40 0.44 0.99 1.43 -0.97 -4.82 118.68 120.15 2otd s LEU 208 Ca 0.00 0.77 -0.23 0.00 -1.03 0.00 0.00 54.13 53.64 2otd s LEU 208 Cb 0.00 -2.45 -0.08 0.00 0.03 0.00 0.00 46.19 43.68 2otd s LEU 208 CO 0.00 0.27 1.08 -0.13 0.23 0.00 0.00 176.35 177.81 2otd s ARG 209 N -0.64 3.93 -0.08 1.70 1.81 -0.91 -4.26 118.95 120.51 2otd s ARG 209 Ca 0.21 1.56 0.01 0.00 -1.72 0.00 0.00 55.73 55.79 2otd s ARG 209 Cb -0.15 -2.39 0.02 0.00 -0.45 0.00 0.00 34.95 31.98 2otd s ARG 209 CO 0.09 -0.35 -0.09 0.42 -0.68 0.00 0.00 175.30 174.69 2otd s ILE 210 N -1.69 1.01 0.11 1.52 1.01 -1.26 -0.52 121.20 121.38 2otd s ILE 210 Ca 0.62 -0.36 0.10 0.00 0.00 0.00 0.00 60.65 61.02 2otd s ILE 210 Cb -0.23 -0.97 -0.04 0.00 0.01 0.00 0.00 42.46 41.23 2otd s ILE 210 CO 0.28 0.34 -0.26 -0.22 0.00 0.00 0.00 174.94 175.08 2otd s LEU 211 N 1.06 2.34 0.05 2.97 0.20 -0.92 -1.09 118.68 123.29 2otd s LEU 211 Ca -0.07 -0.70 0.04 0.00 0.69 0.00 0.00 54.13 54.09 2otd s LEU 211 Cb -0.14 -1.27 -0.02 0.00 -0.43 0.00 0.00 46.19 44.32 2otd s LEU 211 CO -0.01 0.19 -0.13 -0.69 -0.29 0.00 0.00 176.35 175.43 2otd s VAL 212 N -1.03 0.98 0.06 1.68 1.01 -0.32 -0.86 120.40 121.92 2otd s VAL 212 Ca 0.14 -1.10 -0.10 0.00 0.00 0.00 0.00 61.98 60.92 2otd s VAL 212 Cb -0.10 -0.93 0.01 0.00 0.00 0.00 0.00 36.38 35.35 2otd s VAL 212 CO 0.06 -0.15 0.22 -0.72 0.00 0.00 0.00 175.10 174.51 2otd s TYR 213 N -1.08 0.05 -0.32 5.22 1.13 -0.93 -0.28 117.35 121.14 2otd s TYR 213 Ca -0.02 -0.35 -0.07 0.00 -1.41 0.00 0.00 57.07 55.22 2otd s TYR 213 Cb -0.09 -0.01 0.03 0.00 -1.10 0.00 0.00 41.96 40.79 2otd s TYR 213 CO 0.01 -0.50 0.10 0.99 -2.51 0.00 0.00 175.55 173.65 2otd s THR 214 N -3.12 3.94 -0.27 -3.49 2.01 -1.26 -1.22 115.64 112.22 2otd s THR 214 Ca -0.01 -0.92 -0.09 0.00 0.31 0.00 0.00 61.69 60.98 2otd s THR 214 Cb 0.01 -3.14 -0.04 0.00 0.01 0.00 0.00 72.50 69.34 2otd s THR 214 CO -0.07 -0.08 0.13 -0.69 -0.69 0.00 0.00 174.62 173.23 2otd s VAL 215 N 1.46 4.84 -0.07 3.82 1.01 -0.72 -4.87 120.40 125.87 2otd s VAL 215 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 61.98 62.07 2otd s VAL 215 Cb -0.18 -3.29 -0.12 0.00 0.00 0.00 0.00 36.38 32.78 2otd s VAL 215 CO 0.03 0.29 0.08 0.59 0.00 0.00 0.00 175.10 176.09 2otd n ASN 216 N 5.00 2.77 -4.58 3.32 3.02 -1.26 -4.26 115.26 119.27 2otd n ASN 216 Ca -0.15 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 53.98 2otd n ASN 216 Cb 0.52 0.91 -0.06 0.00 -0.61 0.00 0.00 39.78 40.54 2otd n ASN 216 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 2otd s LYS 217 N -2.34 3.74 0.38 3.52 1.02 -1.26 -4.76 119.74 120.04 2otd s LYS 217 Ca -0.04 0.17 0.17 0.00 0.02 0.00 0.00 55.97 56.29 2otd s LYS 217 Cb 0.04 -3.79 1.06 0.00 -0.52 0.00 0.00 37.83 34.62 2otd s LYS 217 CO 0.38 -0.74 1.76 -1.35 -0.92 0.00 0.00 175.35 174.48 2otd h PRO 218 N 8.41 0.42 -0.54 -1.68 0.11 -1.94 0.03 132.00 136.81 2otd h PRO 218 Ca -0.26 -0.03 -0.06 0.00 0.11 0.00 0.00 66.00 65.77 2otd h PRO 218 Cb 1.11 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 32.10 2otd h PRO 218 CO 0.85 0.28 0.12 -0.56 -0.21 0.00 0.00 178.00 178.48 2otd h GLN 219 N 0.43 0.87 0.00 1.05 -0.00 -1.99 0.46 115.11 115.93 2otd h GLN 219 Ca 0.61 -0.22 -0.11 0.00 -0.00 0.00 0.00 58.65 58.93 2otd h GLN 219 Cb 1.46 -0.11 -0.02 0.00 -0.00 0.00 0.00 27.48 28.81 2otd h GLN 219 CO -0.33 0.83 -0.52 1.25 -0.00 0.00 0.00 178.83 180.06 2otd h HIS 220 N 0.77 0.00 0.19 0.06 2.76 -1.48 -0.66 115.15 116.79 2otd h HIS 220 Ca 0.17 0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.33 2otd h HIS 220 Cb 0.36 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.32 2otd h HIS 220 CO 0.02 0.52 -0.09 0.00 -1.30 0.00 0.00 177.93 177.08 2otd h ALA 221 N 1.48 -0.26 0.01 5.26 0.00 -0.79 -2.50 119.26 122.46 2otd h ALA 221 Ca -0.01 -0.15 0.03 0.00 0.00 0.00 0.00 54.91 54.79 2otd h ALA 221 Cb 1.12 0.10 -0.05 0.00 0.00 0.00 0.00 17.79 18.96 2otd h ALA 221 CO 0.07 -0.52 -0.28 0.00 0.00 0.00 0.00 179.25 178.51 2otd h ALA 222 N 0.25 -0.40 -0.26 0.00 0.00 -0.81 -0.47 119.26 117.56 2otd h ALA 222 Ca -0.03 -0.01 0.06 0.00 0.00 0.00 0.00 54.91 54.93 2otd h ALA 222 Cb 0.38 0.49 -0.08 0.00 0.00 0.00 0.00 17.79 18.59 2otd h ALA 222 CO 0.04 -0.79 -0.40 1.49 0.00 0.00 0.00 179.25 179.59 2otd h GLU 223 N -0.44 -0.38 -0.74 0.00 4.81 -1.17 0.19 114.58 116.86 2otd h GLU 223 Ca 0.06 0.03 0.10 0.00 -0.13 0.00 0.00 59.36 59.42 2otd h GLU 223 Cb 0.52 0.09 -0.08 0.00 0.63 0.00 0.00 28.75 29.91 2otd h GLU 223 CO -0.23 -0.25 0.37 -0.07 -0.73 0.00 0.00 179.01 178.09 2otd h LEU 224 N -0.40 0.47 -0.90 1.64 4.07 -1.07 0.27 115.31 119.39 2otd h LEU 224 Ca 0.11 0.07 -0.01 0.00 0.08 0.00 0.00 57.88 58.13 2otd h LEU 224 Cb 0.59 -0.01 -0.04 0.00 1.08 0.00 0.00 40.66 42.28 2otd h LEU 224 CO -0.47 0.25 0.53 -0.07 -1.08 0.00 0.00 178.44 177.60 2otd h LEU 225 N 0.60 1.10 -1.14 1.67 3.38 -0.18 -2.37 115.31 118.36 2otd h LEU 225 Ca 0.37 -0.08 -0.08 0.00 0.09 0.00 0.00 57.88 58.19 2otd h LEU 225 Cb 0.42 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 2otd h LEU 225 CO -0.29 0.86 -0.25 0.03 0.09 0.00 0.00 178.44 178.88 2otd h ARG 226 N 1.25 0.29 -0.49 1.13 3.08 0.92 -2.41 114.38 118.15 2otd h ARG 226 Ca 0.32 -0.10 -0.04 0.00 0.07 0.00 0.00 59.98 60.23 2otd h ARG 226 Cb -0.03 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 29.97 2otd h ARG 226 CO -0.06 0.53 0.14 -1.49 -1.07 0.00 0.00 179.97 178.02 2otd h TRP 227 N 0.26 0.74 0.00 3.04 6.55 -0.76 -3.47 115.95 122.32 2otd h TRP 227 Ca 0.04 -0.05 0.00 0.00 0.95 0.00 0.00 58.89 59.83 2otd h TRP 227 Cb 0.59 -0.22 0.00 0.00 -0.86 0.00 0.00 29.16 28.66 2otd h TRP 227 CO 0.01 0.62 0.00 0.41 -1.05 0.00 0.00 178.44 178.43 2otd n GLY 228 N -0.97 -0.05 3.55 1.49 0.00 -0.91 -5.01 105.19 103.30 2otd n GLY 228 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 2otd n GLY 228 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2otd n VAL 229 N 0.00 2.42 -0.10 1.61 0.31 -0.92 -4.89 118.33 116.75 2otd n VAL 229 Ca 0.00 -0.50 -0.11 0.00 -0.01 0.00 0.00 64.34 63.72 2otd n VAL 229 Cb 0.00 -0.93 -0.15 0.00 -0.91 0.00 0.00 33.84 31.84 2otd n VAL 229 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 2otd n ASP 230 N 0.54 0.35 -3.98 4.52 8.00 -0.25 -4.64 116.55 121.09 2otd n ASP 230 Ca 0.11 -0.02 -0.18 0.00 0.71 0.00 0.00 54.79 55.41 2otd n ASP 230 Cb 0.41 0.80 -0.15 0.00 -0.02 0.00 0.00 41.12 42.17 2otd n ASP 230 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2otd s ILE 232 N -0.07 4.03 -0.32 0.00 1.09 -0.15 -1.17 121.20 124.61 2otd s ILE 232 Ca 0.01 -0.56 -0.24 0.00 -1.10 0.00 0.00 60.65 58.77 2otd s ILE 232 Cb -0.04 -3.02 0.00 0.00 -1.06 0.00 0.00 42.46 38.34 2otd s ILE 232 CO -0.00 0.15 0.80 0.00 -0.10 0.00 0.00 174.94 175.80 2otd s THR 234 N 3.03 1.82 -0.10 0.00 -1.32 0.12 -1.76 115.64 117.42 2otd s THR 234 Ca 0.33 -1.59 0.16 0.00 -1.21 0.00 0.00 61.69 59.38 2otd s THR 234 Cb -0.14 -1.64 -0.15 0.00 -1.51 0.00 0.00 72.50 69.06 2otd s THR 234 CO 0.14 -0.04 0.81 0.44 -2.21 0.00 0.00 174.62 173.76 2otd h ASP 235 N 4.03 0.00 -0.83 8.08 3.32 -1.88 -2.16 116.42 126.98 2otd h ASP 235 Ca -0.47 0.00 -0.72 0.00 0.02 0.00 0.00 57.03 55.86 2otd h ASP 235 Cb 1.18 0.00 -0.08 0.00 0.22 0.00 0.00 39.33 40.65 2otd h ASP 235 CO 0.40 0.68 2.79 0.00 -1.72 0.00 0.00 179.24 181.38 2otd n ALA 236 N -2.43 6.83 0.30 3.45 0.00 -1.26 -2.04 120.51 125.36 2otd n ALA 236 Ca -0.11 -3.95 0.08 0.00 0.00 0.00 0.00 53.44 49.46 2otd n ALA 236 Cb 0.89 -2.98 0.36 0.00 0.00 0.00 0.00 19.45 17.72 2otd n ALA 236 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 2otd n ILE 237 N 2.49 1.15 0.08 0.00 -5.35 -1.26 -1.13 119.36 115.35 2otd n ILE 237 Ca 0.64 0.39 -0.16 0.00 -0.27 0.00 0.00 62.75 63.36 2otd n ILE 237 Cb 0.26 -1.30 -0.14 0.00 -1.74 0.00 0.00 39.64 36.72 2otd n ILE 237 CO 0.00 0.00 0.00 -2.24 -1.76 0.00 0.00 176.55 172.55 2otd h ASP 238 N 0.00 0.38 0.03 7.28 2.03 -1.96 -3.29 116.42 120.89 2otd h ASP 238 Ca 0.00 -0.45 -0.39 0.00 -0.73 0.00 0.00 57.03 55.46 2otd h ASP 238 Cb 0.18 -0.12 -0.06 0.00 -0.83 0.00 0.00 39.33 38.50 2otd h ASP 238 CO 0.00 1.36 -2.34 0.52 -1.03 0.00 0.00 179.24 177.75 2otd n VAL 239 N -3.48 1.56 0.00 4.15 0.31 -0.51 -4.66 118.33 115.71 2otd n VAL 239 Ca -0.11 -0.56 0.00 0.00 -0.01 0.00 0.00 64.34 63.66 2otd n VAL 239 Cb 1.03 -1.55 0.00 0.00 -0.91 0.00 0.00 33.84 32.41 2otd n VAL 239 CO 0.00 0.00 0.00 -0.38 -1.32 0.00 0.00 176.83 175.13 2otd n ILE 240 N -3.42 0.00 0.00 2.52 2.08 -0.29 -4.98 119.36 115.27 2otd n ILE 240 Ca -0.43 0.54 0.00 0.00 0.56 0.00 0.00 62.75 63.41 2otd n ILE 240 Cb 0.99 -1.07 0.00 0.00 -0.75 0.00 0.00 39.64 38.80 2otd n ILE 240 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 2otd n GLY 241 N 0.89 -0.31 0.27 7.39 0.00 -1.24 -4.38 105.19 107.81 2otd n GLY 241 Ca 0.00 -1.44 0.13 0.00 0.00 0.00 0.00 46.02 44.72 2otd n GLY 241 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2otd h PRO 242 N 0.00 0.00 -0.67 1.61 0.13 -1.86 -0.66 132.00 130.55 2otd h PRO 242 Ca 0.00 0.00 -0.22 0.00 -0.87 0.00 0.00 66.00 64.91 2otd h PRO 242 Cb 0.00 0.00 -0.13 0.00 0.13 0.00 0.00 31.00 31.00 2otd h PRO 242 CO 0.00 0.09 0.24 0.09 -0.23 0.00 0.00 178.00 178.19 2otd n ASN 243 N -3.73 4.35 -4.72 1.44 5.03 -1.26 -4.61 115.26 111.76 2otd n ASN 243 Ca -0.02 -3.31 -0.38 0.00 0.87 0.00 0.00 54.58 51.74 2otd n ASN 243 Cb 0.19 -0.72 0.05 0.00 -1.02 0.00 0.00 39.78 38.28 2otd n ASN 243 CO 0.00 0.00 0.00 0.33 -1.83 0.00 0.00 177.26 175.76 2otd n PHE 244 N -0.41 2.08 -3.57 3.10 7.35 -0.26 -5.04 117.46 120.71 2otd n PHE 244 Ca 0.40 0.43 -0.11 0.00 -0.76 0.00 0.00 57.45 57.41 2otd n PHE 244 Cb 1.32 -2.33 -0.04 0.00 0.35 0.00 0.00 39.48 38.79 2otd n PHE 244 CO 0.00 0.00 0.00 0.95 -0.76 0.00 0.00 176.76 176.95 2otd s THR 245 N -1.32 0.05 -2.20 -2.13 -4.23 -1.26 -4.98 115.64 99.57 2otd s THR 245 Ca 0.73 -0.40 0.30 0.00 -1.18 0.00 0.00 61.69 61.15 2otd s THR 245 Cb -0.42 -1.13 0.77 0.00 1.34 0.00 0.00 72.50 73.06 2otd s THR 245 CO 0.48 -0.21 2.04 0.00 -0.54 0.00 0.00 174.62 176.39