#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 7.22 -0.30 6.43 4.22 -1.26 -5.00 114.94 126.25 2otd s ASN 3 Ca 0.00 2.10 -0.03 0.00 -2.14 0.00 0.00 52.86 52.79 2otd s ASN 3 Cb 0.00 -2.60 0.10 0.00 1.28 0.00 0.00 41.25 40.03 2otd s ASN 3 CO 0.00 -0.27 0.12 0.86 -2.04 0.00 0.00 177.10 175.77 2otd s TRP 4 N -0.06 0.82 -1.41 1.54 -0.11 -1.26 -4.99 118.94 113.48 2otd s TRP 4 Ca 0.51 -1.22 0.26 0.00 1.22 0.00 0.00 56.10 56.87 2otd s TRP 4 Cb -0.30 -1.19 0.71 0.00 -1.50 0.00 0.00 33.47 31.19 2otd s TRP 4 CO 0.35 -0.85 1.54 -0.35 -4.62 0.00 0.00 176.95 173.02 2otd n PRO 5 N 5.05 0.45 -2.59 5.86 -0.04 -1.26 -4.99 135.00 137.48 2otd n PRO 5 Ca -0.04 -0.25 -0.36 0.00 -0.04 0.00 0.00 63.50 62.81 2otd n PRO 5 Cb 0.42 -1.49 -0.05 0.00 -0.04 0.00 0.00 33.50 32.34 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 -2.72 3.34 1.04 0.54 2.02 -1.26 -5.03 117.35 115.27 2otd s TYR 6 Ca 0.19 1.66 -0.12 0.00 -0.37 0.00 0.00 57.07 58.43 2otd s TYR 6 Cb 0.19 -3.09 0.21 0.00 -0.40 0.00 0.00 41.96 38.87 2otd s TYR 6 CO 0.59 -0.48 1.07 -2.14 -1.57 0.00 0.00 175.55 173.03 2otd s PRO 7 N -2.44 0.06 0.13 -1.71 0.02 -1.26 -4.99 135.00 124.80 2otd s PRO 7 Ca 0.57 0.93 -0.02 0.00 0.02 0.00 0.00 61.00 62.49 2otd s PRO 7 Cb -0.21 -1.66 -0.12 0.00 0.02 0.00 0.00 34.50 32.53 2otd s PRO 7 CO 0.27 -3.09 1.28 -0.09 -0.33 0.00 0.00 177.00 175.04 2otd h ARG 8 N -2.17 0.29 -5.91 5.54 2.43 -1.88 -3.41 114.38 109.27 2otd h ARG 8 Ca -0.55 -0.36 -0.68 0.00 -0.81 0.00 0.00 59.98 57.58 2otd h ARG 8 Cb 1.31 0.11 -0.28 0.00 -0.42 0.00 0.00 29.97 30.70 2otd h ARG 8 CO 0.51 1.09 -0.82 0.42 -1.51 0.00 0.00 179.97 179.65 2otd s ILE 9 N -3.07 2.61 -0.13 1.20 -1.09 -1.26 -0.28 121.20 119.18 2otd s ILE 9 Ca -0.04 -0.86 0.01 0.00 -2.23 0.00 0.00 60.65 57.53 2otd s ILE 9 Cb 0.09 -2.01 -0.01 0.00 -1.58 0.00 0.00 42.46 38.95 2otd s ILE 9 CO 0.86 0.56 -0.17 -0.69 -1.23 0.00 0.00 174.94 174.27 2otd s VAL 10 N -0.19 2.65 -0.20 2.92 1.01 -0.36 -4.66 120.40 121.58 2otd s VAL 10 Ca -0.01 -0.80 -0.29 0.00 0.00 0.00 0.00 61.98 60.87 2otd s VAL 10 Cb -0.13 -2.08 -0.02 0.00 0.00 0.00 0.00 36.38 34.14 2otd s VAL 10 CO 0.03 0.53 1.40 0.00 0.00 0.00 0.00 175.10 177.07 2otd s ALA 11 N 0.44 3.49 -0.27 5.51 0.00 -1.26 -2.25 121.76 127.41 2otd s ALA 11 Ca -0.12 0.42 -0.29 0.00 0.00 0.00 0.00 51.96 51.97 2otd s ALA 11 Cb -0.16 -3.73 -0.01 0.00 0.00 0.00 0.00 23.12 19.21 2otd s ALA 11 CO 0.06 -1.53 1.52 -1.58 0.00 0.00 0.00 175.76 174.22 2otd s HIS 12 N 4.18 2.28 -1.32 0.00 2.46 -0.30 -1.36 115.29 121.23 2otd s HIS 12 Ca 0.61 0.66 -0.02 0.00 0.47 0.00 0.00 55.06 56.78 2otd s HIS 12 Cb -0.22 -4.01 0.00 0.00 -0.13 0.00 0.00 32.58 28.22 2otd s HIS 12 CO 0.22 -2.49 0.22 0.54 -2.47 0.00 0.00 174.74 170.77 2otd n ARG 13 N 7.66 -2.49 0.00 2.88 1.74 0.24 -1.31 116.66 125.38 2otd n ARG 13 Ca 0.18 0.76 0.00 0.00 -0.77 0.00 0.00 57.85 58.01 2otd n ARG 13 Cb 0.46 -5.19 0.00 0.00 -1.02 0.00 0.00 32.46 26.71 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 -1.18 2.28 0.12 -0.13 0.00 -0.92 -1.44 105.19 103.92 2otd n GLY 14 Ca -0.15 -0.42 0.04 0.00 0.00 0.00 0.00 46.02 45.50 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 2.67 7.00 -0.02 0.00 -1.13 -3.71 105.19 110.01 2otd n GLY 15 Ca 0.00 -0.49 0.00 0.00 0.00 0.00 0.00 46.02 45.53 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 -0.76 3.01 1.60 -0.02 0.00 -0.43 -1.29 105.19 107.30 2otd n GLY 16 Ca 0.07 -0.31 0.09 0.00 0.00 0.00 0.00 46.02 45.87 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 3.73 0.00 1.61 2.85 -0.43 -4.28 118.16 135.64 2otd n LYS 17 Ca 0.00 -2.84 0.13 0.00 -1.05 0.00 0.00 58.31 54.55 2otd n LYS 17 Cb 0.00 -1.90 0.36 0.00 -0.65 0.00 0.00 35.03 32.84 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 1.12 1.15 -3.50 -5.58 4.77 -0.42 -4.93 117.00 109.63 2otd n LEU 18 Ca 0.26 -0.32 -0.11 0.00 -0.03 0.00 0.00 56.01 55.80 2otd n LEU 18 Cb 0.89 -0.10 -0.03 0.00 -2.33 0.00 0.00 43.42 41.85 2otd n LEU 18 CO 0.24 0.21 0.32 0.00 -1.33 0.00 0.00 177.39 176.83 2otd s ALA 19 N -2.45 -1.37 0.05 -1.18 0.00 -1.22 -5.09 121.76 110.52 2otd s ALA 19 Ca 0.25 0.30 -0.30 0.00 0.00 0.00 0.00 51.96 52.21 2otd s ALA 19 Cb 0.19 0.82 -0.09 0.00 0.00 0.00 0.00 23.12 24.05 2otd s ALA 19 CO 0.50 -0.73 1.86 -1.25 0.00 0.00 0.00 175.76 176.15 2otd s PRO 20 N -3.77 4.15 0.70 0.00 0.04 -1.26 -4.71 135.00 130.14 2otd s PRO 20 Ca 0.02 2.53 -0.16 0.00 0.04 0.00 0.00 61.00 63.43 2otd s PRO 20 Cb -0.00 -3.92 -0.04 0.00 0.04 0.00 0.00 34.50 30.57 2otd s PRO 20 CO -0.12 -0.89 0.57 -0.85 0.04 0.00 0.00 177.00 175.74 2otd n GLU 21 N 6.77 0.36 -3.65 4.56 0.28 -1.26 -3.71 120.64 123.99 2otd n GLU 21 Ca 0.19 0.16 -0.21 0.00 -0.16 0.00 0.00 57.16 57.14 2otd n GLU 21 Cb 0.40 -1.84 0.04 0.00 1.43 0.00 0.00 31.44 31.47 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 -0.27 -1.30 -3.88 -1.84 5.03 -0.52 -4.97 115.26 107.50 2otd n ASN 22 Ca 0.11 -0.79 -0.11 0.00 0.87 0.00 0.00 54.58 54.66 2otd n ASN 22 Cb 0.49 -4.24 -0.12 0.00 -1.02 0.00 0.00 39.78 34.89 2otd n ASN 22 CO 0.00 0.00 0.00 0.28 -1.83 0.00 0.00 177.26 175.71 2otd s THR 23 N -3.62 0.04 0.19 3.41 -1.32 -1.24 -4.60 115.64 108.51 2otd s THR 23 Ca 0.00 -0.35 -0.18 0.00 -1.21 0.00 0.00 61.69 59.95 2otd s THR 23 Cb -0.00 -0.22 0.17 0.00 -1.51 0.00 0.00 72.50 70.93 2otd s THR 23 CO 0.80 -0.19 1.61 -0.07 -2.21 0.00 0.00 174.62 174.55 2otd h LEU 24 N 5.33 -0.89 -0.70 9.08 4.07 -1.91 0.24 115.31 130.53 2otd h LEU 24 Ca -0.28 0.20 0.12 0.00 0.08 0.00 0.00 57.88 58.01 2otd h LEU 24 Cb 1.20 0.48 -0.09 0.00 1.08 0.00 0.00 40.66 43.34 2otd h LEU 24 CO 0.44 -0.27 0.26 0.00 -1.08 0.00 0.00 178.44 177.79 2otd h ALA 25 N 1.24 0.94 -0.37 1.53 0.00 -1.95 0.12 119.26 120.77 2otd h ALA 25 Ca 0.26 0.11 -0.08 0.00 0.00 0.00 0.00 54.91 55.20 2otd h ALA 25 Cb 0.51 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.38 2otd h ALA 25 CO -0.65 -0.21 -0.09 0.00 0.00 0.00 0.00 179.25 178.30 2otd h ALA 26 N 1.50 1.14 -0.87 0.00 0.00 -1.44 -1.43 119.26 118.18 2otd h ALA 26 Ca 0.37 -0.28 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 2otd h ALA 26 Cb 0.53 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 18.12 2otd h ALA 26 CO -0.38 0.54 0.44 0.82 0.00 0.00 0.00 179.25 180.67 2otd h ILE 27 N 0.59 1.26 -0.13 0.00 2.04 0.74 -1.05 117.51 120.96 2otd h ILE 27 Ca 0.11 -0.70 -0.01 0.00 1.00 0.00 0.00 64.86 65.26 2otd h ILE 27 Cb 0.51 0.13 -0.01 0.00 -0.74 0.00 0.00 36.82 36.72 2otd h ILE 27 CO 0.03 0.31 0.06 0.44 0.00 0.00 0.00 178.15 178.99 2otd h ASP 28 N 1.23 0.17 -0.81 1.72 3.32 0.17 -2.03 116.42 120.19 2otd h ASP 28 Ca 0.30 -0.12 0.12 0.00 0.02 0.00 0.00 57.03 57.34 2otd h ASP 28 Cb 0.09 -0.04 -0.06 0.00 0.22 0.00 0.00 39.33 39.54 2otd h ASP 28 CO -0.04 0.25 0.53 0.58 -1.72 0.00 0.00 179.24 178.84 2otd h VAL 29 N 0.08 0.89 -0.89 -1.35 2.07 -1.06 0.85 116.25 116.84 2otd h VAL 29 Ca 0.05 -0.23 0.01 0.00 0.82 0.00 0.00 66.70 67.34 2otd h VAL 29 Cb 0.12 0.17 -0.04 0.00 -1.52 0.00 0.00 31.29 30.02 2otd h VAL 29 CO -0.01 0.12 0.58 1.23 0.02 0.00 0.00 177.57 179.52 2otd h GLY 30 N 0.66 1.26 1.98 2.17 0.00 -0.68 -1.98 103.07 106.49 2otd h GLY 30 Ca 0.39 -0.48 -0.16 0.00 0.00 0.00 0.00 47.33 47.07 2otd h GLY 30 CO -0.15 0.47 -0.77 0.00 0.00 0.00 0.00 176.54 176.09 2otd h ALA 31 N 1.32 0.73 0.00 3.60 0.00 -0.31 -2.82 119.26 121.78 2otd h ALA 31 Ca 0.33 -0.69 0.00 0.00 0.00 0.00 0.00 54.91 54.54 2otd h ALA 31 Cb -0.12 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 17.55 2otd h ALA 31 CO -0.07 0.95 0.00 0.87 0.00 0.00 0.00 179.25 181.00 2otd h LYS 32 N 0.01 0.00 -0.47 0.00 1.57 -0.17 -1.90 116.57 115.60 2otd h LYS 32 Ca -0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 2otd h LYS 32 Cb 1.36 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.67 2otd h LYS 32 CO 0.10 0.00 0.00 0.66 -0.57 0.00 0.00 179.45 179.64 2otd n TYR 33 N -2.47 0.63 -0.48 -1.35 4.01 -1.02 -4.99 117.16 111.49 2otd n TYR 33 Ca 0.01 -0.47 0.00 0.00 -0.16 0.00 0.00 57.90 57.27 2otd n TYR 33 Cb 0.21 -0.02 0.00 0.00 -0.31 0.00 0.00 39.34 39.22 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 0.94 0.74 3.81 2.72 0.00 -0.72 -4.50 105.19 108.19 2otd n GLY 34 Ca 0.16 -0.16 -0.34 0.00 0.00 0.00 0.00 46.02 45.68 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 -2.00 3.44 -0.35 1.61 3.76 -1.08 -4.72 115.29 115.94 2otd s HIS 35 Ca 0.00 1.65 0.07 0.00 -0.15 0.00 0.00 55.06 56.63 2otd s HIS 35 Cb 0.00 -2.86 0.54 0.00 1.11 0.00 0.00 32.58 31.38 2otd s HIS 35 CO 0.00 0.00 1.59 1.63 -0.85 0.00 0.00 174.74 177.12 2otd n LYS 36 N -0.24 2.04 -3.54 1.40 4.76 -1.26 -4.71 118.16 116.61 2otd n LYS 36 Ca 0.05 -3.20 -0.13 0.00 -2.87 0.00 0.00 58.31 52.16 2otd n LYS 36 Cb 0.53 -1.95 -0.05 0.00 -1.84 0.00 0.00 35.03 31.72 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 -3.39 0.00 0.11 -0.18 -4.36 -1.26 -4.81 121.20 107.30 2otd s ILE 38 Ca 0.49 0.00 0.06 0.00 -0.26 0.00 0.00 60.65 60.94 2otd s ILE 38 Cb 0.43 -1.00 -0.04 0.00 1.25 0.00 0.00 42.46 43.10 2otd s ILE 38 CO 0.02 0.00 -0.02 -0.70 0.24 0.00 0.00 174.94 174.49 2otd s GLU 39 N -1.44 2.44 -0.07 0.37 -6.30 -0.46 -0.92 118.70 112.32 2otd s GLU 39 Ca -0.05 -0.92 -0.30 0.00 -2.50 0.00 0.00 54.97 51.20 2otd s GLU 39 Cb -0.00 -2.47 0.09 0.00 0.00 0.00 0.00 34.13 31.75 2otd s GLU 39 CO 0.03 0.52 0.79 -0.59 0.02 0.00 0.00 175.26 176.03 2otd s PHE 40 N -1.36 -0.54 -0.28 5.30 -0.12 -0.81 -0.59 117.98 119.58 2otd s PHE 40 Ca 0.25 0.86 -0.14 0.00 -0.05 0.00 0.00 56.93 57.85 2otd s PHE 40 Cb -0.11 0.44 -0.04 0.00 -0.63 0.00 0.00 43.02 42.68 2otd s PHE 40 CO 0.18 -0.54 0.32 -0.51 -0.05 0.00 0.00 175.22 174.62 2otd s ASP 41 N -1.35 6.18 0.15 1.98 1.01 -1.26 -1.52 116.67 121.85 2otd s ASP 41 Ca -0.06 0.17 0.07 0.00 0.71 0.00 0.00 52.55 53.44 2otd s ASP 41 Cb -0.00 -2.18 -0.04 0.00 1.01 0.00 0.00 42.92 41.70 2otd s ASP 41 CO 0.05 -0.16 -0.03 0.00 0.21 0.00 0.00 175.17 175.24 2otd s ALA 42 N 1.98 3.13 0.22 5.23 0.00 0.03 -1.61 121.76 130.75 2otd s ALA 42 Ca 0.12 -1.31 -0.19 0.00 0.00 0.00 0.00 51.96 50.59 2otd s ALA 42 Cb -0.16 -0.97 0.03 0.00 0.00 0.00 0.00 23.12 22.01 2otd s ALA 42 CO 0.10 0.55 0.59 0.15 0.00 0.00 0.00 175.76 177.15 2otd s LYS 43 N -2.67 1.51 -0.12 0.00 1.02 -0.53 -0.53 119.74 118.42 2otd s LYS 43 Ca 0.26 -0.90 -0.05 0.00 0.02 0.00 0.00 55.97 55.30 2otd s LYS 43 Cb -0.10 0.55 -0.04 0.00 -0.52 0.00 0.00 37.83 37.72 2otd s LYS 43 CO 0.17 -0.66 0.08 -0.51 -0.92 0.00 0.00 175.35 173.52 2otd s LEU 44 N -2.89 4.05 0.63 3.17 1.02 -1.26 -1.69 118.68 121.71 2otd s LEU 44 Ca 0.10 0.31 -0.13 0.00 0.02 0.00 0.00 54.13 54.43 2otd s LEU 44 Cb -0.02 -1.97 -0.03 0.00 0.02 0.00 0.00 46.19 44.19 2otd s LEU 44 CO 0.00 0.37 1.04 -0.94 0.02 0.00 0.00 176.35 176.84 2otd s SER 45 N -0.79 5.82 0.29 2.29 1.04 0.06 -4.30 113.70 118.10 2otd s SER 45 Ca 0.13 1.64 0.05 0.00 0.48 0.00 0.00 55.95 58.24 2otd s SER 45 Cb -0.12 -2.50 0.74 0.00 0.10 0.00 0.00 66.02 64.24 2otd s SER 45 CO 0.03 -1.14 1.71 0.50 0.98 0.00 0.00 173.24 175.32 2otd h LYS 46 N -0.07 0.47 -0.13 4.02 3.64 -0.44 0.63 116.57 124.68 2otd h LYS 46 Ca -0.45 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 58.90 2otd h LYS 46 Cb 1.21 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.92 2otd h LYS 46 CO 0.58 0.31 0.00 -0.40 -2.27 0.00 0.00 179.45 177.67 2otd n ASP 47 N -4.98 0.82 -0.45 4.20 5.75 -1.26 -4.94 116.55 115.68 2otd n ASP 47 Ca 0.23 -1.87 0.00 0.00 -0.01 0.00 0.00 54.79 53.13 2otd n ASP 47 Cb 0.64 -0.09 0.00 0.00 -1.03 0.00 0.00 41.12 40.65 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 0.81 0.95 3.88 6.12 0.00 0.22 -5.04 105.19 112.13 2otd n GLY 48 Ca 0.08 -0.60 -0.33 0.00 0.00 0.00 0.00 46.02 45.18 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 -4.40 3.35 -0.35 1.61 0.41 -1.26 -4.86 118.70 113.21 2otd s GLU 49 Ca 0.00 -0.39 -0.15 0.00 -0.41 0.00 0.00 54.97 54.02 2otd s GLU 49 Cb 0.00 -3.03 -0.01 0.00 -1.78 0.00 0.00 34.13 29.31 2otd s GLU 49 CO 0.00 0.65 0.33 0.42 -0.49 0.00 0.00 175.26 176.17 2otd s ILE 50 N -1.34 5.20 0.31 -1.63 1.01 -1.26 -0.76 121.20 122.73 2otd s ILE 50 Ca 0.28 -0.10 0.03 0.00 0.00 0.00 0.00 60.65 60.86 2otd s ILE 50 Cb -0.13 -3.82 -0.06 0.00 0.01 0.00 0.00 42.46 38.47 2otd s ILE 50 CO 0.20 -0.11 0.08 0.72 0.00 0.00 0.00 174.94 175.83 2otd s PHE 51 N 1.93 1.82 -0.12 3.97 -0.71 -0.68 -0.44 117.98 123.75 2otd s PHE 51 Ca 0.10 -1.06 -0.05 0.00 -1.04 0.00 0.00 56.93 54.88 2otd s PHE 51 Cb -0.17 -1.16 -0.04 0.00 -1.21 0.00 0.00 43.02 40.44 2otd s PHE 51 CO 0.11 -0.13 0.06 -0.51 -1.34 0.00 0.00 175.22 173.42 2otd s LEU 52 N -3.45 3.91 -0.30 -1.99 1.43 -1.03 -1.45 118.68 115.80 2otd s LEU 52 Ca 0.36 0.24 -0.17 0.00 -1.03 0.00 0.00 54.13 53.52 2otd s LEU 52 Cb 0.08 -1.94 0.19 0.00 0.03 0.00 0.00 46.19 44.56 2otd s LEU 52 CO 0.15 0.34 1.23 -0.22 0.23 0.00 0.00 176.35 178.08 2otd s LEU 53 N -0.63 -0.15 -0.01 1.79 2.96 -0.63 -4.64 118.68 117.37 2otd s LEU 53 Ca 0.11 0.22 -0.24 0.00 -0.22 0.00 0.00 54.13 54.00 2otd s LEU 53 Cb -0.12 1.19 -0.16 0.00 0.50 0.00 0.00 46.19 47.60 2otd s LEU 53 CO 0.02 -0.03 1.14 -0.74 -1.32 0.00 0.00 176.35 175.42 2otd h HIS 54 N 6.32 -0.34 -4.04 5.38 -0.00 -1.92 -3.44 115.15 117.11 2otd h HIS 54 Ca -0.19 -0.01 -0.47 0.00 -0.00 0.00 0.00 60.37 59.70 2otd h HIS 54 Cb 1.14 0.11 0.08 0.00 -0.00 0.00 0.00 27.41 28.74 2otd h HIS 54 CO 0.20 0.02 0.29 -0.51 -0.00 0.00 0.00 177.93 177.92 2otd s ASP 55 N -5.17 5.09 0.35 3.26 1.11 -1.26 -4.95 116.67 115.10 2otd s ASP 55 Ca -0.14 0.72 0.06 0.00 0.18 0.00 0.00 52.55 53.38 2otd s ASP 55 Cb 0.02 -1.46 0.64 0.00 1.07 0.00 0.00 42.92 43.18 2otd s ASP 55 CO 0.52 -1.46 1.86 0.44 1.18 0.00 0.00 175.17 177.71 2otd h ASP 56 N -0.58 0.37 -3.52 0.27 3.32 -1.92 -3.46 116.42 110.89 2otd h ASP 56 Ca -0.45 -0.08 -0.66 0.00 0.02 0.00 0.00 57.03 55.85 2otd h ASP 56 Cb 1.29 -0.10 -0.15 0.00 0.22 0.00 0.00 39.33 40.59 2otd h ASP 56 CO 0.62 0.52 -0.72 0.20 -1.72 0.00 0.00 179.24 178.14 2otd s ASN 57 N -6.81 4.58 0.36 6.45 0.01 -1.26 -1.38 114.94 116.89 2otd s ASN 57 Ca -0.06 -0.30 0.18 0.00 -0.71 0.00 0.00 52.86 51.97 2otd s ASN 57 Cb 0.15 -0.96 0.64 0.00 0.41 0.00 0.00 41.25 41.49 2otd s ASN 57 CO 0.76 0.20 1.71 -0.07 -1.51 0.00 0.00 177.10 178.19 2otd h LEU 58 N 3.73 0.00 -0.17 0.60 3.38 -1.58 -3.40 115.31 117.87 2otd h LEU 58 Ca -0.48 0.00 0.02 0.00 0.09 0.00 0.00 57.88 57.50 2otd h LEU 58 Cb 1.17 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.89 2otd h LEU 58 CO 0.54 0.39 -0.11 -0.33 0.09 0.00 0.00 178.44 179.03 2otd h GLU 59 N 0.00 -0.01 -1.02 1.13 3.07 -1.76 -1.42 114.58 114.57 2otd h GLU 59 Ca -0.00 0.00 0.25 0.00 -0.50 0.00 0.00 59.36 59.10 2otd h GLU 59 Cb 0.93 0.00 -0.11 0.00 -0.84 0.00 0.00 28.75 28.73 2otd h GLU 59 CO 0.05 -0.00 0.63 -0.09 -1.40 0.00 0.00 179.01 178.19 2otd h ARG 60 N -0.01 0.51 0.00 2.33 2.43 -1.88 -2.81 114.38 114.96 2otd h ARG 60 Ca 0.03 -0.03 -0.01 0.00 -0.81 0.00 0.00 59.98 59.15 2otd h ARG 60 Cb 0.08 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 29.48 2otd h ARG 60 CO -0.17 0.34 -0.29 0.25 -1.51 0.00 0.00 179.97 178.60 2otd n THR 61 N -4.77 1.62 -3.83 0.20 -2.24 -1.07 -5.01 114.28 99.20 2otd n THR 61 Ca 0.26 -2.20 -0.08 0.00 -2.27 0.00 0.00 64.05 59.75 2otd n THR 61 Cb 0.78 -0.06 0.01 0.00 -2.10 0.00 0.00 70.33 68.95 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 -2.70 -0.06 0.00 3.42 1.04 -0.56 -4.37 113.70 110.47 2otd s SER 62 Ca 0.30 -0.99 0.29 0.00 0.48 0.00 0.00 55.95 56.03 2otd s SER 62 Cb 0.28 0.81 1.31 0.00 0.10 0.00 0.00 66.02 68.52 2otd s SER 62 CO -0.02 -1.58 1.90 -0.46 0.98 0.00 0.00 173.24 174.07 2otd n ASN 63 N -1.11 0.50 -4.26 7.02 6.94 -0.90 -4.57 115.26 118.88 2otd n ASN 63 Ca -0.07 -0.72 -0.23 0.00 -0.02 0.00 0.00 54.58 53.54 2otd n ASN 63 Cb 0.60 -0.06 0.13 0.00 -2.36 0.00 0.00 39.78 38.08 2otd n ASN 63 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 2otd n GLY 64 N 1.23 0.25 3.19 4.83 0.00 -1.26 -4.99 105.19 108.44 2otd n GLY 64 Ca 0.16 -1.97 -0.13 0.00 0.00 0.00 0.00 46.02 44.09 2otd n GLY 64 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2otd s TRP 65 N -3.03 -0.24 0.00 1.61 0.52 -1.26 -2.76 118.94 113.79 2otd s TRP 65 Ca 0.63 0.52 0.00 0.00 0.02 0.00 0.00 56.10 57.28 2otd s TRP 65 Cb -0.03 0.09 0.00 0.00 -1.15 0.00 0.00 33.47 32.38 2otd s TRP 65 CO 0.43 -0.24 0.00 0.41 0.02 0.00 0.00 176.95 177.57 2otd n GLY 66 N 2.26 0.83 3.59 0.98 0.00 -1.26 -4.77 105.19 106.81 2otd n GLY 66 Ca -0.17 -2.03 -0.42 0.00 0.00 0.00 0.00 46.02 43.40 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 -1.56 3.64 0.26 1.61 1.01 -1.26 -1.67 120.40 122.43 2otd s VAL 67 Ca 0.00 0.61 -0.01 0.00 0.00 0.00 0.00 61.98 62.57 2otd s VAL 67 Cb 0.00 -3.99 0.26 0.00 0.00 0.00 0.00 36.38 32.65 2otd s VAL 67 CO 0.00 -0.71 1.69 0.00 0.00 0.00 0.00 175.10 176.08 2otd h ALA 68 N 12.21 1.15 -0.06 5.51 0.00 -1.56 -1.21 119.26 135.30 2otd h ALA 68 Ca -0.29 0.16 0.02 0.00 0.00 0.00 0.00 54.91 54.80 2otd h ALA 68 Cb 1.14 0.19 -0.00 0.00 0.00 0.00 0.00 17.79 19.11 2otd h ALA 68 CO 1.10 -0.32 0.06 0.78 0.00 0.00 0.00 179.25 180.87 2otd h GLY 69 N 0.34 0.00 2.00 0.00 0.00 -1.77 -1.37 103.07 102.26 2otd h GLY 69 Ca 0.47 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.80 2otd h GLY 69 CO -0.51 0.00 0.00 1.18 0.00 0.00 0.00 176.54 177.21 2otd n GLU 70 N -3.96 0.07 -3.67 4.80 1.02 -0.46 -1.73 120.64 116.72 2otd n GLU 70 Ca -0.01 0.18 -0.28 0.00 -0.02 0.00 0.00 57.16 57.02 2otd n GLU 70 Cb 0.16 -1.61 -0.03 0.00 -0.02 0.00 0.00 31.44 29.94 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 -3.48 4.22 0.56 -4.62 1.43 -0.52 -4.78 118.68 111.50 2otd s LEU 71 Ca 0.10 0.44 -0.07 0.00 -1.03 0.00 0.00 54.13 53.56 2otd s LEU 71 Cb 0.13 -3.21 -0.02 0.00 0.03 0.00 0.00 46.19 43.13 2otd s LEU 71 CO 0.44 -0.04 0.91 0.20 0.23 0.00 0.00 176.35 178.09 2otd s ASN 72 N -3.08 6.02 0.16 2.29 0.01 -1.26 -1.63 114.94 117.45 2otd s ASN 72 Ca 0.39 1.03 -0.15 0.00 -0.71 0.00 0.00 52.86 53.41 2otd s ASN 72 Cb -0.11 -2.15 0.03 0.00 0.41 0.00 0.00 41.25 39.43 2otd s ASN 72 CO 0.29 -0.84 1.79 -0.25 -1.51 0.00 0.00 177.10 176.58 2otd h TRP 73 N -0.10 0.59 -0.83 2.20 -0.00 -1.96 -1.09 115.95 114.77 2otd h TRP 73 Ca -0.46 -0.00 0.22 0.00 -0.00 0.00 0.00 58.89 58.66 2otd h TRP 73 Cb 1.22 -0.20 -0.04 0.00 -0.00 0.00 0.00 29.16 30.14 2otd h TRP 73 CO 0.57 0.41 0.58 1.96 -0.00 0.00 0.00 178.44 181.96 2otd h GLN 74 N 0.60 0.13 0.00 2.65 4.20 -2.00 -0.22 115.11 120.48 2otd h GLN 74 Ca 0.16 -0.01 -0.10 0.00 0.06 0.00 0.00 58.65 58.77 2otd h GLN 74 Cb -0.01 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.72 2otd h GLN 74 CO -0.03 0.09 -0.65 -0.44 -0.67 0.00 0.00 178.83 177.13 2otd h ASP 75 N 0.14 0.00 0.64 1.46 3.32 -1.60 -3.32 116.42 117.05 2otd h ASP 75 Ca 0.41 0.00 -0.27 0.00 0.02 0.00 0.00 57.03 57.19 2otd h ASP 75 Cb 1.40 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 40.93 2otd h ASP 75 CO -0.06 0.41 -1.41 -0.07 -1.72 0.00 0.00 179.24 176.40 2otd h LEU 76 N 0.00 0.17 -0.43 1.55 3.38 -0.67 -3.21 115.31 116.10 2otd h LEU 76 Ca -0.03 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 57.70 2otd h LEU 76 Cb 1.35 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 42.04 2otd h LEU 76 CO 0.05 1.19 0.56 -0.07 0.09 0.00 0.00 178.44 180.26 2otd h LEU 77 N 0.03 0.00 -0.68 1.67 -0.00 -1.35 -1.44 115.31 113.53 2otd h LEU 77 Ca -0.18 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.70 2otd h LEU 77 Cb 1.94 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 42.60 2otd h LEU 77 CO 0.13 0.00 -0.56 0.54 -0.00 0.00 0.00 178.44 178.55 2otd n ARG 78 N -1.94 1.20 -2.41 1.13 1.74 -1.21 -4.95 116.66 110.22 2otd n ARG 78 Ca -0.00 -0.66 -0.41 0.00 -0.77 0.00 0.00 57.85 56.01 2otd n ARG 78 Cb 0.57 -1.40 -0.04 0.00 -1.02 0.00 0.00 32.46 30.57 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 -2.41 3.44 -0.51 1.55 1.01 -0.54 -4.98 120.40 117.95 2otd s VAL 79 Ca 0.14 1.38 -0.20 0.00 0.00 0.00 0.00 61.98 63.30 2otd s VAL 79 Cb 0.16 -3.88 0.06 0.00 0.00 0.00 0.00 36.38 32.71 2otd s VAL 79 CO 0.59 0.30 0.67 -0.62 0.00 0.00 0.00 175.10 176.04 2otd s ASP 80 N -0.56 6.24 -0.24 3.32 -1.08 -1.26 -4.51 116.67 118.58 2otd s ASP 80 Ca 0.47 -0.82 0.13 0.00 -0.52 0.00 0.00 52.55 51.81 2otd s ASP 80 Cb -0.33 -2.31 0.77 0.00 -1.46 0.00 0.00 42.92 39.59 2otd s ASP 80 CO 0.41 -0.94 1.69 0.00 0.52 0.00 0.00 175.17 176.85 2otd n ALA 81 N 6.36 3.91 0.00 3.66 0.00 0.12 -2.12 120.51 132.44 2otd n ALA 81 Ca -0.05 -1.86 0.00 0.00 0.00 0.00 0.00 53.44 51.53 2otd n ALA 81 Cb 0.46 -1.14 0.00 0.00 0.00 0.00 0.00 19.45 18.77 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 0.50 0.00 0.50 0.00 0.00 -1.21 -4.79 105.19 100.18 2otd n GLY 82 Ca 0.28 0.00 0.32 0.00 0.00 0.00 0.00 46.02 46.61 2otd n GLY 82 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2otd h SER 83 N 0.00 0.07 -0.24 1.61 0.02 -1.62 0.03 113.55 113.42 2otd h SER 83 Ca 0.00 0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 60.95 2otd h SER 83 Cb 0.81 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.33 2otd h SER 83 CO 0.00 0.01 0.12 4.11 -1.14 0.00 0.00 176.83 179.94 2otd h TRP 84 N 0.06 0.38 0.25 3.45 5.08 -1.88 -3.24 115.95 120.05 2otd h TRP 84 Ca 0.53 -0.00 -0.01 0.00 1.08 0.00 0.00 58.89 60.49 2otd h TRP 84 Cb 2.01 -0.12 0.00 0.00 -3.00 0.00 0.00 29.16 28.04 2otd h TRP 84 CO -0.00 0.30 -0.12 -0.92 -1.28 0.00 0.00 178.44 176.42 2otd h TYR 85 N 0.40 -0.31 -2.64 0.12 5.03 -1.34 -3.49 116.97 114.73 2otd h TYR 85 Ca 0.10 -0.01 0.08 0.00 2.58 0.00 0.00 58.73 61.48 2otd h TYR 85 Cb 0.07 0.10 -0.11 0.00 1.55 0.00 0.00 36.73 38.34 2otd h TYR 85 CO 0.00 -0.06 0.36 -1.54 -1.32 0.00 0.00 178.16 175.60 2otd s SER 86 N -5.23 -0.36 0.00 -2.11 1.04 -1.22 -5.05 113.70 100.76 2otd s SER 86 Ca -0.08 -0.21 0.22 0.00 0.48 0.00 0.00 55.95 56.36 2otd s SER 86 Cb 0.00 0.54 1.07 0.00 0.10 0.00 0.00 66.02 67.73 2otd s SER 86 CO 0.28 -0.92 1.71 0.29 0.98 0.00 0.00 173.24 175.57 2otd n LYS 87 N -0.38 0.24 0.00 4.02 5.02 -1.26 -3.01 118.16 122.80 2otd n LYS 87 Ca -0.10 0.09 0.13 0.00 -2.02 0.00 0.00 58.31 56.42 2otd n LYS 87 Cb 0.62 -1.50 0.50 0.00 -0.02 0.00 0.00 35.03 34.63 2otd n LYS 87 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2otd n ALA 88 N -1.34 2.69 -2.43 7.82 0.00 -1.26 -3.95 120.51 122.04 2otd n ALA 88 Ca 0.09 -0.17 -0.30 0.00 0.00 0.00 0.00 53.44 53.06 2otd n ALA 88 Cb 0.19 -1.36 0.00 0.00 0.00 0.00 0.00 19.45 18.28 2otd n ALA 88 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2otd n PHE 89 N -1.53 3.38 -0.02 0.00 3.01 -1.16 -4.84 117.46 116.31 2otd n PHE 89 Ca 0.06 -3.04 -0.13 0.00 1.01 0.00 0.00 57.45 55.36 2otd n PHE 89 Cb 0.34 -0.41 -0.08 0.00 -0.01 0.00 0.00 39.48 39.32 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 2.78 0.09 0.00 -1.08 1.63 -1.82 -2.42 116.57 115.74 2otd h LYS 90 Ca 0.35 -0.03 0.00 0.00 -0.85 0.00 0.00 60.65 60.11 2otd h LYS 90 Cb 0.66 -0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.28 2otd h LYS 90 CO 0.98 0.45 0.00 0.41 -3.45 0.00 0.00 179.45 177.84 2otd n GLY 91 N -0.06 -0.64 3.63 5.01 0.00 -1.26 -4.57 105.19 107.30 2otd n GLY 91 Ca -0.07 -0.08 -0.43 0.00 0.00 0.00 0.00 46.02 45.43 2otd n GLY 91 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2otd s GLU 92 N -2.30 3.91 0.76 1.61 2.56 -1.20 -4.85 118.70 119.20 2otd s GLU 92 Ca 0.19 1.15 -0.11 0.00 0.00 0.00 0.00 54.97 56.19 2otd s GLU 92 Cb 0.10 -3.86 0.05 0.00 2.00 0.00 0.00 34.13 32.42 2otd s GLU 92 CO 0.21 -1.13 1.08 -1.25 -0.56 0.00 0.00 175.26 173.61 2otd s PRO 93 N 4.14 2.35 -0.07 4.30 0.05 -1.26 0.15 135.00 144.67 2otd s PRO 93 Ca 0.54 0.82 -0.30 0.00 0.05 0.00 0.00 61.00 62.11 2otd s PRO 93 Cb -0.15 -1.93 -0.04 0.00 0.05 0.00 0.00 34.50 32.43 2otd s PRO 93 CO 0.23 -1.48 1.32 -0.51 0.05 0.00 0.00 177.00 176.61 2otd s LEU 94 N -5.74 4.27 0.06 -3.56 1.43 -1.26 -4.73 118.68 109.14 2otd s LEU 94 Ca 0.60 1.91 -0.24 0.00 -1.03 0.00 0.00 54.13 55.37 2otd s LEU 94 Cb -0.15 -3.55 -0.06 0.00 0.03 0.00 0.00 46.19 42.46 2otd s LEU 94 CO 0.55 -0.71 0.74 -2.16 0.23 0.00 0.00 176.35 175.01 2otd s PRO 95 N 2.79 4.48 0.50 1.29 0.04 -1.26 -4.93 135.00 137.90 2otd s PRO 95 Ca 0.60 1.03 -0.23 0.00 0.04 0.00 0.00 61.00 62.45 2otd s PRO 95 Cb -0.27 -3.34 -0.06 0.00 0.04 0.00 0.00 34.50 30.87 2otd s PRO 95 CO 0.22 0.35 1.28 -0.51 0.04 0.00 0.00 177.00 178.37 2otd s LEU 96 N -0.27 3.95 0.34 -3.56 1.43 -1.26 -2.46 118.68 116.84 2otd s LEU 96 Ca 0.37 2.57 0.09 0.00 -1.03 0.00 0.00 54.13 56.13 2otd s LEU 96 Cb -0.21 -4.23 0.83 0.00 0.03 0.00 0.00 46.19 42.62 2otd s LEU 96 CO 0.23 -1.24 1.81 0.25 0.23 0.00 0.00 176.35 177.62 2otd h LEU 97 N 1.80 0.68 -1.22 1.79 5.85 -1.09 -1.23 115.31 121.89 2otd h LEU 97 Ca -0.50 0.07 -0.03 0.00 0.84 0.00 0.00 57.88 58.26 2otd h LEU 97 Cb 1.27 -0.05 -0.02 0.00 0.37 0.00 0.00 40.66 42.23 2otd h LEU 97 CO 0.59 0.27 0.20 0.77 -0.34 0.00 0.00 178.44 179.92 2otd h SER 98 N 0.68 0.67 -0.32 1.25 4.64 -1.92 0.81 113.55 119.35 2otd h SER 98 Ca 0.53 -0.08 -0.09 0.00 -0.47 0.00 0.00 61.79 61.68 2otd h SER 98 Cb 0.93 -0.17 -0.01 0.00 -0.31 0.00 0.00 62.40 62.84 2otd h SER 98 CO -0.29 0.61 -0.14 1.56 -0.87 0.00 0.00 176.83 177.70 2otd h GLN 99 N 0.73 0.67 -0.76 4.77 4.20 -1.63 -2.23 115.11 120.87 2otd h GLN 99 Ca 0.18 -0.29 0.01 0.00 0.06 0.00 0.00 58.65 58.61 2otd h GLN 99 Cb 0.16 -0.02 -0.04 0.00 0.30 0.00 0.00 27.48 27.88 2otd h GLN 99 CO -0.02 0.88 0.50 0.28 -0.67 0.00 0.00 178.83 179.80 2otd h VAL 100 N 0.44 1.18 -0.56 -0.54 2.07 -0.71 -1.63 116.25 116.50 2otd h VAL 100 Ca 0.07 -0.35 0.01 0.00 0.82 0.00 0.00 66.70 67.26 2otd h VAL 100 Cb 0.67 0.08 -0.03 0.00 -1.52 0.00 0.00 31.29 30.49 2otd h VAL 100 CO 0.05 0.18 0.37 0.00 0.02 0.00 0.00 177.57 178.19 2otd h ALA 101 N 1.29 1.61 -0.29 1.67 0.00 -0.75 -1.16 119.26 121.62 2otd h ALA 101 Ca 0.28 -0.04 -0.14 0.00 0.00 0.00 0.00 54.91 55.01 2otd h ALA 101 Cb -0.09 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.47 2otd h ALA 101 CO -0.07 0.36 -0.38 1.49 0.00 0.00 0.00 179.25 180.65 2otd h GLU 102 N 0.75 0.78 -0.34 0.00 4.57 -0.75 -1.91 114.58 117.68 2otd h GLU 102 Ca 0.21 -0.44 -0.10 0.00 -1.18 0.00 0.00 59.36 57.85 2otd h GLU 102 Cb -0.07 0.03 -0.02 0.00 -0.16 0.00 0.00 28.75 28.53 2otd h GLU 102 CO -0.05 1.07 -0.19 0.00 -1.18 0.00 0.00 179.01 178.67 2otd h ARG 103 N 0.53 0.64 -0.86 1.92 2.47 -0.94 -1.15 114.38 116.99 2otd h ARG 103 Ca 0.04 -0.23 0.03 0.00 -1.26 0.00 0.00 59.98 58.56 2otd h ARG 103 Cb 0.97 -0.04 -0.05 0.00 -1.65 0.00 0.00 29.97 29.20 2otd h ARG 103 CO 0.09 0.79 0.57 0.00 0.56 0.00 0.00 179.97 181.98 2otd h ARG 105 N 1.09 0.15 -0.87 0.00 2.43 -0.58 -1.72 114.38 114.88 2otd h ARG 105 Ca 0.34 -0.07 0.06 0.00 -0.81 0.00 0.00 59.98 59.50 2otd h ARG 105 Cb 0.00 -0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 29.50 2otd h ARG 105 CO -0.10 0.55 0.57 0.93 -1.51 0.00 0.00 179.97 180.41 2otd h GLU 106 N -0.25 0.96 -0.02 0.20 5.08 -1.00 -2.83 114.58 116.72 2otd h GLU 106 Ca 0.01 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 2otd h GLU 106 Cb 0.51 -0.22 0.00 0.00 0.50 0.00 0.00 28.75 29.55 2otd h GLU 106 CO 0.01 0.64 -0.16 0.72 -1.00 0.00 0.00 179.01 179.22 2otd n HIS 107 N -4.48 0.00 -1.98 4.33 8.25 -0.52 -5.10 115.22 115.73 2otd n HIS 107 Ca 0.13 0.00 -0.02 0.00 -0.26 0.00 0.00 57.72 57.57 2otd n HIS 107 Cb 0.19 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.30 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 1.36 -0.83 3.64 -1.41 0.00 -0.65 -5.01 105.19 102.29 2otd n GLY 108 Ca 0.13 0.27 -0.05 0.00 0.00 0.00 0.00 46.02 46.37 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 -1.92 -2.04 -0.36 4.61 0.00 -1.26 -4.87 121.76 115.92 2otd s ALA 111 Ca 0.06 2.30 -0.04 0.00 0.00 0.00 0.00 51.96 54.29 2otd s ALA 111 Cb -0.02 -1.53 0.07 0.00 0.00 0.00 0.00 23.12 21.64 2otd s ALA 111 CO 0.26 -0.36 0.13 1.21 0.00 0.00 0.00 175.76 177.00 2otd s ASN 112 N 1.42 5.21 -0.63 0.00 3.04 -0.10 -0.94 114.94 122.93 2otd s ASN 112 Ca -0.09 -1.55 -0.23 0.00 0.04 0.00 0.00 52.86 51.04 2otd s ASN 112 Cb -0.04 -1.82 0.06 0.00 -1.54 0.00 0.00 41.25 37.91 2otd s ASN 112 CO -0.17 -0.41 0.96 -0.63 -3.04 0.00 0.00 177.10 173.81 2otd s ILE 113 N 1.27 4.34 -0.35 -5.21 1.01 0.43 -1.92 121.20 120.76 2otd s ILE 113 Ca 0.01 -0.19 -0.29 0.00 0.00 0.00 0.00 60.65 60.18 2otd s ILE 113 Cb -0.21 -4.64 0.01 0.00 0.01 0.00 0.00 42.46 37.62 2otd s ILE 113 CO -0.01 -1.37 1.32 -0.70 0.00 0.00 0.00 174.94 174.18 2otd s GLU 114 N 4.04 3.79 -0.48 2.79 2.12 -0.58 -1.33 118.70 129.05 2otd s GLU 114 Ca 0.24 1.08 -0.28 0.00 0.36 0.00 0.00 54.97 56.37 2otd s GLU 114 Cb -0.16 -3.92 -0.01 0.00 0.26 0.00 0.00 34.13 30.30 2otd s GLU 114 CO 0.12 -1.28 1.69 0.42 -0.54 0.00 0.00 175.26 175.67 2otd s ILE 115 N 4.70 3.55 -0.74 -3.70 1.01 0.65 -0.79 121.20 125.89 2otd s ILE 115 Ca 0.57 0.48 0.04 0.00 0.00 0.00 0.00 60.65 61.74 2otd s ILE 115 Cb -0.15 -3.98 0.19 0.00 0.01 0.00 0.00 42.46 38.53 2otd s ILE 115 CO 0.27 -0.78 0.58 1.17 0.00 0.00 0.00 174.94 176.18 2otd n LYS 116 N 8.69 2.07 -2.14 2.79 0.00 0.31 -4.56 118.16 125.31 2otd n LYS 116 Ca 0.19 -4.51 -0.33 0.00 0.00 0.00 0.00 58.31 53.65 2otd n LYS 116 Cb 0.49 -2.31 0.00 0.00 0.00 0.00 0.00 35.03 33.22 2otd n LYS 116 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.40 175.26 2otd s PRO 117 N -1.58 3.37 0.11 1.64 0.02 -1.26 -4.45 135.00 132.84 2otd s PRO 117 Ca 0.27 1.30 -0.32 0.00 0.02 0.00 0.00 61.00 62.27 2otd s PRO 117 Cb -0.03 -2.03 -0.11 0.00 0.02 0.00 0.00 34.50 32.35 2otd s PRO 117 CO -0.15 -0.78 1.80 2.41 -0.33 0.00 0.00 177.00 179.96 2otd n THR 118 N -1.77 0.32 -1.38 0.99 -1.04 -1.26 -4.84 114.28 105.29 2otd n THR 118 Ca 0.09 -0.06 -0.54 0.00 -2.04 0.00 0.00 64.05 61.50 2otd n THR 118 Cb 0.52 -2.00 -0.07 0.00 -1.82 0.00 0.00 70.33 66.96 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 4.54 0.05 -0.42 12.58 -1.04 -1.26 -0.32 114.28 128.41 2otd n THR 119 Ca 0.18 -0.01 0.00 0.00 -2.04 0.00 0.00 64.05 62.18 2otd n THR 119 Cb 0.35 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.86 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 1.40 1.40 1.68 3.41 0.00 -1.26 -4.92 105.19 106.90 2otd n GLY 120 Ca 0.18 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.04 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 2.72 0.03 2.61 -2.24 0.56 -4.88 114.28 111.08 2otd n THR 121 Ca 0.00 -3.39 -0.13 0.00 -2.27 0.00 0.00 64.05 58.26 2otd n THR 121 Cb 0.00 -0.78 -0.09 0.00 -2.10 0.00 0.00 70.33 67.36 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 1.63 -0.10 0.85 3.38 0.00 -1.92 -1.54 103.07 105.38 2otd h GLY 122 Ca 0.34 0.04 0.02 0.00 0.00 0.00 0.00 47.33 47.72 2otd h GLY 122 CO 0.73 -0.04 0.03 -2.55 0.00 0.00 0.00 176.54 174.71 2otd h PRO 123 N -0.56 0.08 -0.38 4.80 0.11 -1.90 -2.01 132.00 132.14 2otd h PRO 123 Ca -0.01 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 66.09 2otd h PRO 123 Cb 0.48 -0.02 -0.02 0.00 0.11 0.00 0.00 31.00 31.55 2otd h PRO 123 CO 0.02 0.06 0.22 1.25 -0.21 0.00 0.00 178.00 179.33 2otd h LEU 124 N 0.09 0.46 -0.47 2.35 5.85 -1.93 -1.94 115.31 119.72 2otd h LEU 124 Ca 0.06 -0.07 -0.04 0.00 0.84 0.00 0.00 57.88 58.67 2otd h LEU 124 Cb 0.05 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 40.94 2otd h LEU 124 CO -0.08 0.40 0.14 0.74 -0.34 0.00 0.00 178.44 179.30 2otd h THR 125 N 0.49 1.23 -0.20 1.05 2.02 -1.27 -3.00 112.91 113.23 2otd h THR 125 Ca 0.14 -0.77 -0.11 0.00 0.77 0.00 0.00 66.41 66.44 2otd h THR 125 Cb 0.03 0.83 -0.01 0.00 -1.74 0.00 0.00 68.15 67.26 2otd h THR 125 CO -0.02 0.28 -0.34 1.23 0.37 0.00 0.00 175.52 177.03 2otd h GLY 126 N 0.63 0.45 -0.20 2.16 0.00 -1.20 -1.47 103.07 103.44 2otd h GLY 126 Ca 0.15 -0.41 0.00 0.00 0.00 0.00 0.00 47.33 47.08 2otd h GLY 126 CO -0.00 0.37 0.00 1.17 0.00 0.00 0.00 176.54 178.07 2otd n LYS 127 N -4.07 0.27 0.00 4.80 4.81 -0.74 -2.70 118.16 120.53 2otd n LYS 127 Ca -0.01 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.43 2otd n LYS 127 Cb 0.45 -1.03 0.00 0.00 0.02 0.00 0.00 35.03 34.48 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 -0.33 0.00 0.09 3.15 0.31 -0.56 -2.13 118.33 118.87 2otd n VAL 129 Ca 0.00 0.00 -0.11 0.00 -0.01 0.00 0.00 64.34 64.22 2otd n VAL 129 Cb 0.01 0.00 -0.08 0.00 -0.91 0.00 0.00 33.84 32.87 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 -0.29 -0.51 3.52 0.00 -1.75 -0.18 119.26 120.05 2otd h ALA 130 Ca 0.00 -0.21 0.10 0.00 0.00 0.00 0.00 54.91 54.80 2otd h ALA 130 Cb 0.00 0.11 -0.10 0.00 0.00 0.00 0.00 17.79 17.81 2otd h ALA 130 CO 0.00 -0.39 -0.13 -0.07 0.00 0.00 0.00 179.25 178.66 2otd h LEU 131 N -0.84 -0.49 -0.73 0.00 4.07 -1.69 0.72 115.31 116.34 2otd h LEU 131 Ca -0.03 0.15 -0.07 0.00 0.08 0.00 0.00 57.88 58.02 2otd h LEU 131 Cb 0.51 0.32 -0.03 0.00 1.08 0.00 0.00 40.66 42.54 2otd h LEU 131 CO 0.05 -0.17 0.20 0.00 -1.08 0.00 0.00 178.44 177.44 2otd h ALA 132 N 1.49 0.97 -0.44 1.53 0.00 -1.82 -2.54 119.26 118.45 2otd h ALA 132 Ca 0.24 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2otd h ALA 132 Cb 0.38 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 2otd h ALA 132 CO -0.53 0.67 0.28 0.00 0.00 0.00 0.00 179.25 179.67 2otd h ALA 133 N 1.11 0.56 -0.52 0.00 0.00 -0.53 0.43 119.26 120.30 2otd h ALA 133 Ca 0.23 -0.05 0.10 0.00 0.00 0.00 0.00 54.91 55.20 2otd h ALA 133 Cb 0.35 -0.18 -0.10 0.00 0.00 0.00 0.00 17.79 17.86 2otd h ALA 133 CO -0.00 0.03 -0.21 -0.09 0.00 0.00 0.00 179.25 178.98 2otd h ARG 134 N 0.59 -0.09 0.01 0.00 2.43 -0.49 -0.58 114.38 116.25 2otd h ARG 134 Ca 0.16 0.01 -0.21 0.00 -0.81 0.00 0.00 59.98 59.12 2otd h ARG 134 Cb -0.03 0.02 0.02 0.00 -0.42 0.00 0.00 29.97 29.56 2otd h ARG 134 CO -0.03 -0.06 -0.84 0.37 -1.51 0.00 0.00 179.97 177.90 2otd h GLN 135 N -0.09 0.55 -0.37 0.20 4.15 -1.08 -3.23 115.11 115.24 2otd h GLN 135 Ca 0.24 -0.61 -0.16 0.00 0.77 0.00 0.00 58.65 58.89 2otd h GLN 135 Cb 0.47 0.18 -0.01 0.00 0.21 0.00 0.00 27.48 28.33 2otd h GLN 135 CO -0.58 1.23 -0.41 -0.07 -1.93 0.00 0.00 178.83 177.07 2otd h LEU 136 N 0.13 0.98 -1.77 -2.39 3.38 -0.75 -3.10 115.31 111.79 2otd h LEU 136 Ca -0.11 -0.46 0.00 0.00 0.09 0.00 0.00 57.88 57.40 2otd h LEU 136 Cb 1.53 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 42.00 2otd h LEU 136 CO 0.17 1.26 0.00 0.79 0.09 0.00 0.00 178.44 180.74 2otd n TRP 137 N -4.05 0.73 -1.63 1.13 8.01 -0.24 -4.97 117.44 116.43 2otd n TRP 137 Ca -0.02 -0.28 -0.43 0.00 -1.31 0.00 0.00 57.50 55.46 2otd n TRP 137 Cb 0.56 -0.18 -0.00 0.00 -2.01 0.00 0.00 31.31 29.68 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 0.34 0.36 -3.48 6.99 0.00 -1.17 -4.59 120.51 118.96 2otd n ALA 138 Ca 0.12 0.33 -0.16 0.00 0.00 0.00 0.00 53.44 53.73 2otd n ALA 138 Cb 0.52 -2.11 0.01 0.00 0.00 0.00 0.00 19.45 17.87 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 1.07 -1.23 3.71 0.00 0.00 -1.26 -5.13 105.19 102.35 2otd n GLY 139 Ca 0.08 0.53 -0.42 0.00 0.00 0.00 0.00 46.02 46.21 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 -3.07 4.88 0.26 2.61 2.01 -1.26 -5.23 115.64 115.83 2otd s THR 141 Ca 0.08 2.00 -0.30 0.00 0.31 0.00 0.00 61.69 63.79 2otd s THR 141 Cb -0.03 -4.29 -0.14 0.00 0.01 0.00 0.00 72.50 68.05 2otd s THR 141 CO 0.83 0.16 1.18 -2.65 -0.69 0.00 0.00 174.62 173.45 2otd n PRO 142 N 3.98 1.58 -2.24 4.92 -0.02 -1.26 -4.88 135.00 137.09 2otd n PRO 142 Ca 0.06 0.56 -0.38 0.00 -2.02 0.00 0.00 63.50 61.72 2otd n PRO 142 Cb 0.51 -2.06 -0.01 0.00 -0.02 0.00 0.00 33.50 31.92 2otd n PRO 142 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2otd s PRO 143 N -1.05 3.91 -0.43 0.52 0.04 -1.26 -4.80 135.00 131.92 2otd s PRO 143 Ca 0.64 1.86 -0.27 0.00 0.04 0.00 0.00 61.00 63.27 2otd s PRO 143 Cb -0.70 -2.57 0.02 0.00 0.04 0.00 0.00 34.50 31.29 2otd s PRO 143 CO 0.56 -0.45 0.99 -1.17 0.04 0.00 0.00 177.00 176.97 2otd s LEU 144 N -2.72 3.91 -0.26 -3.56 2.96 -0.12 -4.24 118.68 114.64 2otd s LEU 144 Ca 0.60 0.38 -0.24 0.00 -0.22 0.00 0.00 54.13 54.65 2otd s LEU 144 Cb -0.31 -3.32 -0.00 0.00 0.50 0.00 0.00 46.19 43.06 2otd s LEU 144 CO 0.38 -1.04 0.83 -0.76 -1.32 0.00 0.00 176.35 174.44 2otd s LEU 145 N 3.85 4.07 0.30 -0.68 1.02 -0.48 -0.43 118.68 126.33 2otd s LEU 145 Ca 0.41 0.94 0.07 0.00 0.02 0.00 0.00 54.13 55.56 2otd s LEU 145 Cb -0.10 -3.17 -0.06 0.00 0.02 0.00 0.00 46.19 42.88 2otd s LEU 145 CO 0.25 -0.56 -0.05 -0.94 0.02 0.00 0.00 176.35 175.07 2otd s SER 146 N 1.43 2.99 -0.27 2.29 1.04 -0.44 -0.21 113.70 120.51 2otd s SER 146 Ca 0.35 -1.22 -0.26 0.00 0.48 0.00 0.00 55.95 55.30 2otd s SER 146 Cb -0.15 -0.21 0.14 0.00 0.10 0.00 0.00 66.02 65.90 2otd s SER 146 CO 0.09 -0.34 1.12 -0.55 0.98 0.00 0.00 173.24 174.54 2otd s SER 147 N -3.49 -0.35 0.51 7.02 0.15 -1.13 -0.25 113.70 116.16 2otd s SER 147 Ca 0.31 0.65 0.27 0.00 0.70 0.00 0.00 55.95 57.89 2otd s SER 147 Cb 0.04 0.65 1.39 0.00 -1.71 0.00 0.00 66.02 66.39 2otd s SER 147 CO 0.13 -0.14 2.04 -0.26 1.20 0.00 0.00 173.24 176.22 2otd h PHE 148 N 3.80 0.00 -3.68 3.44 0.04 -1.80 -1.91 116.94 116.83 2otd h PHE 148 Ca -0.27 0.00 -0.63 0.00 2.80 0.00 0.00 57.97 59.87 2otd h PHE 148 Cb 1.18 0.00 -0.14 0.00 2.20 0.00 0.00 35.95 39.18 2otd h PHE 148 CO 0.29 0.13 -0.17 -1.21 -0.60 0.00 0.00 178.31 176.75 2otd s GLU 149 N -4.10 3.95 0.13 1.51 0.41 -1.26 -4.84 118.70 114.50 2otd s GLU 149 Ca -0.02 0.04 -0.15 0.00 -0.41 0.00 0.00 54.97 54.43 2otd s GLU 149 Cb 0.13 -3.68 -0.01 0.00 -1.78 0.00 0.00 34.13 28.78 2otd s GLU 149 CO 0.59 -0.35 1.62 0.82 -0.49 0.00 0.00 175.26 177.44 2otd h ILE 150 N 5.43 1.24 -0.06 -1.63 2.04 -1.98 -1.28 117.51 121.27 2otd h ILE 150 Ca -0.30 -0.83 0.01 0.00 1.00 0.00 0.00 64.86 64.73 2otd h ILE 150 Cb 1.15 1.00 -0.01 0.00 -0.74 0.00 0.00 36.82 38.23 2otd h ILE 150 CO 0.68 0.29 -0.03 0.47 0.00 0.00 0.00 178.15 179.55 2otd n ASP 151 N -4.54 -0.06 0.06 1.72 8.00 -1.26 -0.60 116.55 119.86 2otd n ASP 151 Ca -0.00 0.12 -0.20 0.00 0.71 0.00 0.00 54.79 55.41 2otd n ASP 151 Cb 0.22 -0.02 -0.13 0.00 -0.02 0.00 0.00 41.12 41.17 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 0.02 -0.03 -0.52 2.24 0.00 -1.33 -1.02 119.26 118.62 2otd h ALA 152 Ca 0.01 -0.70 0.05 0.00 0.00 0.00 0.00 54.91 54.27 2otd h ALA 152 Cb 0.02 0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.86 2otd h ALA 152 CO -0.06 0.49 0.26 -0.07 0.00 0.00 0.00 179.25 179.88 2otd h LEU 153 N -0.05 0.37 -0.49 0.00 3.38 -1.25 0.11 115.31 117.39 2otd h LEU 153 Ca -0.15 0.03 0.02 0.00 0.09 0.00 0.00 57.88 57.87 2otd h LEU 153 Cb 1.68 -0.04 -0.03 0.00 0.09 0.00 0.00 40.66 42.36 2otd h LEU 153 CO 0.18 0.26 0.29 -0.33 0.09 0.00 0.00 178.44 178.93 2otd h GLU 154 N 0.51 0.56 -0.76 1.13 5.08 -0.68 -0.21 114.58 120.22 2otd h GLU 154 Ca 0.23 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.53 2otd h GLU 154 Cb 0.14 -0.13 -0.04 0.00 0.50 0.00 0.00 28.75 29.22 2otd h GLU 154 CO -0.16 0.37 0.40 0.00 -1.00 0.00 0.00 179.01 178.62 2otd h ALA 155 N 1.22 0.98 -0.61 3.43 0.00 -0.76 -2.36 119.26 121.15 2otd h ALA 155 Ca 0.19 -0.13 -0.08 0.00 0.00 0.00 0.00 54.91 54.89 2otd h ALA 155 Cb 0.01 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.48 2otd h ALA 155 CO -0.09 0.51 0.06 0.00 0.00 0.00 0.00 179.25 179.73 2otd h ALA 156 N 1.20 0.95 -0.37 0.00 0.00 -0.40 -1.86 119.26 118.78 2otd h ALA 156 Ca 0.26 -0.28 0.01 0.00 0.00 0.00 0.00 54.91 54.90 2otd h ALA 156 Cb 0.07 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 2otd h ALA 156 CO -0.04 0.65 0.23 0.37 0.00 0.00 0.00 179.25 180.46 2otd h GLN 157 N 0.95 0.45 -0.36 0.00 4.15 -0.63 0.01 115.11 119.69 2otd h GLN 157 Ca 0.18 -0.03 -0.13 0.00 0.77 0.00 0.00 58.65 59.45 2otd h GLN 157 Cb 0.47 -0.10 -0.01 0.00 0.21 0.00 0.00 27.48 28.05 2otd h GLN 157 CO 0.02 0.30 -0.29 1.96 -1.93 0.00 0.00 178.83 178.89 2otd h GLN 158 N 0.47 0.75 0.16 1.69 1.08 -1.29 -3.07 115.11 114.89 2otd h GLN 158 Ca 0.14 -0.33 -0.29 0.00 -1.45 0.00 0.00 58.65 56.71 2otd h GLN 158 Cb -0.03 -0.02 0.02 0.00 -0.05 0.00 0.00 27.48 27.40 2otd h GLN 158 CO -0.05 0.95 -1.30 0.00 -0.95 0.00 0.00 178.83 177.48 2otd h ALA 159 N 1.03 0.02 -1.46 3.87 0.00 -1.03 -3.41 119.26 118.28 2otd h ALA 159 Ca 0.08 -0.85 -0.42 0.00 0.00 0.00 0.00 54.91 53.72 2otd h ALA 159 Cb 0.81 0.07 -0.29 0.00 0.00 0.00 0.00 17.79 18.38 2otd h ALA 159 CO 0.07 0.84 -0.82 0.00 0.00 0.00 0.00 179.25 179.34 2otd n ALA 160 N -2.61 0.87 0.13 0.00 0.00 -0.04 -4.77 120.51 114.10 2otd n ALA 160 Ca -0.11 -2.43 0.07 0.00 0.00 0.00 0.00 53.44 50.97 2otd n ALA 160 Cb 1.03 -1.04 0.55 0.00 0.00 0.00 0.00 19.45 19.99 2otd n ALA 160 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2otd h PRO 161 N 4.62 0.24 0.00 0.00 0.11 -1.70 -2.14 132.00 133.12 2otd h PRO 161 Ca 0.07 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.17 2otd h PRO 161 Cb 0.96 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.02 2otd h PRO 161 CO 0.32 0.16 0.00 -0.85 -0.21 0.00 0.00 178.00 177.42 2otd n GLU 162 N -4.50 0.01 -2.88 1.05 0.00 -1.26 -4.68 120.64 108.37 2otd n GLU 162 Ca 0.01 0.10 -0.41 0.00 0.00 0.00 0.00 57.16 56.85 2otd n GLU 162 Cb 0.11 -1.50 -0.04 0.00 0.00 0.00 0.00 31.44 30.01 2otd n GLU 162 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.13 176.62 2otd s LEU 163 N -2.99 4.25 0.60 -1.84 1.02 -0.81 -5.03 118.68 113.88 2otd s LEU 163 Ca 0.11 1.29 -0.18 0.00 0.02 0.00 0.00 54.13 55.37 2otd s LEU 163 Cb 0.15 -3.28 -0.03 0.00 0.02 0.00 0.00 46.19 43.05 2otd s LEU 163 CO 0.42 -0.31 1.19 -2.16 0.02 0.00 0.00 176.35 175.51 2otd s PRO 164 N 1.64 2.97 -0.01 1.29 0.04 -1.26 -4.88 135.00 134.79 2otd s PRO 164 Ca 0.41 1.77 0.04 0.00 0.04 0.00 0.00 61.00 63.27 2otd s PRO 164 Cb -0.18 -1.94 -0.01 0.00 0.04 0.00 0.00 34.50 32.42 2otd s PRO 164 CO 0.17 -1.19 -0.13 1.03 0.04 0.00 0.00 177.00 176.91 2otd s ARG 165 N -3.39 1.06 -0.03 4.56 0.52 -1.26 -1.39 118.95 119.03 2otd s ARG 165 Ca 0.76 -0.50 0.07 0.00 -0.52 0.00 0.00 55.73 55.54 2otd s ARG 165 Cb -0.29 -1.03 -0.02 0.00 0.52 0.00 0.00 34.95 34.14 2otd s ARG 165 CO 0.33 0.28 -0.23 0.20 0.02 0.00 0.00 175.30 175.90 2otd s GLY 166 N -0.39 1.16 -0.17 -3.53 0.00 0.70 -1.40 107.32 103.70 2otd s GLY 166 Ca 0.05 -1.00 -0.21 0.00 0.00 0.00 0.00 44.72 43.55 2otd s GLY 166 CO -0.00 -0.78 0.64 -2.27 0.00 0.00 0.00 173.10 170.68 2otd s LEU 167 N -0.46 4.19 0.03 0.66 2.96 -1.06 -2.83 118.68 122.16 2otd s LEU 167 Ca 0.06 0.91 -0.23 0.00 -0.22 0.00 0.00 54.13 54.65 2otd s LEU 167 Cb -0.10 -2.92 -0.05 0.00 0.50 0.00 0.00 46.19 43.62 2otd s LEU 167 CO -0.00 -0.23 0.69 -0.76 -1.32 0.00 0.00 176.35 174.73 2otd s LEU 168 N 1.62 4.44 -0.06 -0.68 2.01 -0.72 -0.36 118.68 124.93 2otd s LEU 168 Ca 0.30 1.32 -0.01 0.00 0.01 0.00 0.00 54.13 55.76 2otd s LEU 168 Cb -0.16 -3.09 0.03 0.00 0.01 0.00 0.00 46.19 42.97 2otd s LEU 168 CO 0.12 0.06 -0.00 -0.76 1.01 0.00 0.00 176.35 176.77 2otd s LEU 169 N -0.15 0.80 0.07 1.79 1.43 -0.46 -4.35 118.68 117.81 2otd s LEU 169 Ca 0.35 -0.07 0.16 0.00 -1.03 0.00 0.00 54.13 53.54 2otd s LEU 169 Cb -0.20 -0.38 -0.13 0.00 0.03 0.00 0.00 46.19 45.51 2otd s LEU 169 CO 0.20 -0.15 0.86 -0.78 0.23 0.00 0.00 176.35 176.71 2otd h ASP 170 N 7.92 0.00 -4.29 2.29 3.58 -1.97 -2.94 116.42 121.00 2otd h ASP 170 Ca -0.27 0.00 -0.52 0.00 0.42 0.00 0.00 57.03 56.66 2otd h ASP 170 Cb 1.13 0.00 -0.27 0.00 1.72 0.00 0.00 39.33 41.91 2otd h ASP 170 CO 0.33 0.61 -0.82 -1.61 -2.88 0.00 0.00 179.24 174.87 2otd s GLU 171 N -2.90 1.24 0.78 0.28 0.41 -1.26 -4.74 118.70 112.52 2otd s GLU 171 Ca -0.03 -0.76 -0.15 0.00 -0.41 0.00 0.00 54.97 53.62 2otd s GLU 171 Cb 0.09 -1.27 0.01 0.00 -1.78 0.00 0.00 34.13 31.18 2otd s GLU 171 CO 0.81 0.33 0.76 1.87 -0.49 0.00 0.00 175.26 178.54 2otd n TRP 172 N 2.17 -0.12 -3.86 1.61 -0.00 -1.26 -5.05 117.44 110.92 2otd n TRP 172 Ca -0.16 0.35 -0.12 0.00 -0.00 0.00 0.00 57.50 57.57 2otd n TRP 172 Cb 0.54 -1.97 -0.14 0.00 -0.00 0.00 0.00 31.31 29.74 2otd n TRP 172 CO 0.00 0.00 0.00 1.03 -0.00 0.00 0.00 177.69 178.72 2otd s ARG 173 N -3.35 0.04 0.23 5.87 0.52 -1.26 -5.04 118.95 115.95 2otd s ARG 173 Ca 0.67 0.04 0.13 0.00 -0.52 0.00 0.00 55.73 56.05 2otd s ARG 173 Cb -0.31 0.02 0.82 0.00 0.52 0.00 0.00 34.95 35.99 2otd s ARG 173 CO 0.56 -0.00 0.97 -0.25 0.02 0.00 0.00 175.30 176.60 2otd n ASP 174 N 3.06 0.21 -1.08 0.23 9.92 -1.26 -2.27 116.55 125.35 2otd n ASP 174 Ca -0.12 1.02 -0.02 0.00 -0.53 0.00 0.00 54.79 55.14 2otd n ASP 174 Cb 0.60 -0.49 0.20 0.00 -0.64 0.00 0.00 41.12 40.79 2otd n ASP 174 CO 0.00 0.00 0.00 -0.90 0.13 0.00 0.00 177.20 176.43 2otd n ASP 175 N -4.40 2.54 -0.34 -2.24 5.75 -1.26 -4.75 116.55 111.85 2otd n ASP 175 Ca 0.23 -3.70 0.05 0.00 -0.01 0.00 0.00 54.79 51.36 2otd n ASP 175 Cb 0.78 -0.62 0.21 0.00 -1.03 0.00 0.00 41.12 40.46 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 1.05 1.06 0.13 2.11 5.08 -1.89 -0.20 115.95 123.29 2otd h TRP 176 Ca 0.18 0.03 -0.27 0.00 1.08 0.00 0.00 58.89 59.91 2otd h TRP 176 Cb 1.59 -0.33 0.01 0.00 -3.00 0.00 0.00 29.16 27.42 2otd h TRP 176 CO 0.95 0.44 -1.23 -0.09 -1.28 0.00 0.00 178.44 177.23 2otd h ARG 177 N 0.96 0.32 -0.63 0.12 2.43 -1.88 -0.93 114.38 114.76 2otd h ARG 177 Ca 0.46 -0.51 -0.02 0.00 -0.81 0.00 0.00 59.98 59.09 2otd h ARG 177 Cb 0.40 0.19 -0.03 0.00 -0.42 0.00 0.00 29.97 30.11 2otd h ARG 177 CO -0.25 1.23 0.31 0.93 -1.51 0.00 0.00 179.97 180.68 2otd h GLU 178 N 0.10 0.91 -0.13 0.20 5.08 -1.87 -1.72 114.58 117.14 2otd h GLU 178 Ca -0.14 -0.13 -0.03 0.00 -1.00 0.00 0.00 59.36 58.06 2otd h GLU 178 Cb 1.95 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 31.03 2otd h GLU 178 CO 0.21 0.73 -0.04 1.25 -1.00 0.00 0.00 179.01 180.16 2otd h LEU 179 N 0.87 0.26 -0.83 1.33 5.85 -0.90 -0.56 115.31 121.33 2otd h LEU 179 Ca 0.22 -0.38 -0.11 0.00 0.84 0.00 0.00 57.88 58.45 2otd h LEU 179 Cb 0.12 -0.07 -0.01 0.00 0.37 0.00 0.00 40.66 41.06 2otd h LEU 179 CO -0.03 0.58 -0.26 0.71 -0.34 0.00 0.00 178.44 179.11 2otd h THR 180 N -0.05 1.27 0.20 1.05 1.35 -1.19 -1.94 112.91 113.59 2otd h THR 180 Ca 0.03 -1.32 0.01 0.00 -0.55 0.00 0.00 66.41 64.58 2otd h THR 180 Cb 0.47 1.33 -0.03 0.00 -1.73 0.00 0.00 68.15 68.19 2otd h THR 180 CO 0.01 0.43 -0.26 0.00 -0.25 0.00 0.00 175.52 175.45 2otd h ALA 181 N 1.21 -0.50 -0.14 6.62 0.00 -1.13 -1.21 119.26 124.11 2otd h ALA 181 Ca 0.07 -0.06 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 2otd h ALA 181 Cb 0.71 0.40 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 2otd h ALA 181 CO 0.05 -0.82 -0.19 -0.09 0.00 0.00 0.00 179.25 178.21 2otd h ARG 182 N -0.52 0.23 -0.00 0.00 2.43 -0.85 -1.07 114.38 114.60 2otd h ARG 182 Ca 0.01 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 2otd h ARG 182 Cb 0.51 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.03 2otd h ARG 182 CO -0.10 0.42 -0.36 1.28 -1.51 0.00 0.00 179.97 179.69 2otd n LEU 183 N -4.23 0.50 -3.49 3.80 4.32 -0.75 -4.95 117.00 112.20 2otd n LEU 183 Ca -0.01 0.04 -0.18 0.00 -0.02 0.00 0.00 56.01 55.84 2otd n LEU 183 Cb 0.31 -0.26 0.07 0.00 -1.62 0.00 0.00 43.42 41.92 2otd n LEU 183 CO 0.39 0.11 0.06 0.61 -1.22 0.00 0.00 177.39 177.34 2otd n GLY 184 N 1.46 -0.42 3.76 -0.72 0.00 -0.41 -4.96 105.19 103.91 2otd n GLY 184 Ca 0.07 0.15 -0.40 0.00 0.00 0.00 0.00 46.02 45.85 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 3.68 1.02 -4.23 0.00 -1.51 -1.59 -3.48 116.25 110.15 2otd h VAL 186 Ca -0.45 -1.84 -0.15 0.00 -1.23 0.00 0.00 66.70 63.03 2otd h VAL 186 Cb 1.21 2.09 -0.14 0.00 -2.13 0.00 0.00 31.29 32.32 2otd h VAL 186 CO 0.68 0.46 -0.55 -0.94 -1.23 0.00 0.00 177.57 176.00 2otd s SER 187 N -6.52 0.24 -0.02 4.19 1.04 -1.16 -1.61 113.70 109.85 2otd s SER 187 Ca 0.00 -1.07 0.02 0.00 0.48 0.00 0.00 55.95 55.39 2otd s SER 187 Cb 0.11 0.33 0.00 0.00 0.10 0.00 0.00 66.02 66.56 2otd s SER 187 CO 0.72 -0.76 -0.09 -0.51 0.98 0.00 0.00 173.24 173.58 2otd s ILE 188 N -4.00 0.75 -0.20 -1.02 2.07 -0.38 -2.57 121.20 115.85 2otd s ILE 188 Ca 0.19 -0.34 0.01 0.00 -1.41 0.00 0.00 60.65 59.10 2otd s ILE 188 Cb 0.06 -0.67 0.04 0.00 0.13 0.00 0.00 42.46 42.02 2otd s ILE 188 CO -0.01 0.24 -0.12 -1.00 -1.91 0.00 0.00 174.94 172.14 2otd s HIS 189 N 0.20 2.52 0.08 3.50 3.76 0.51 -1.43 115.29 124.42 2otd s HIS 189 Ca -0.03 -1.63 0.09 0.00 -0.15 0.00 0.00 55.06 53.34 2otd s HIS 189 Cb -0.08 -1.70 -0.03 0.00 1.11 0.00 0.00 32.58 31.88 2otd s HIS 189 CO 0.00 -0.76 -0.25 -0.51 -0.85 0.00 0.00 174.74 172.38 2otd s LEU 190 N 1.36 2.24 -0.04 0.89 1.43 -0.50 -1.36 118.68 122.71 2otd s LEU 190 Ca -0.01 -0.64 -0.35 0.00 -1.03 0.00 0.00 54.13 52.10 2otd s LEU 190 Cb -0.16 -1.14 -0.13 0.00 0.03 0.00 0.00 46.19 44.79 2otd s LEU 190 CO -0.09 0.18 1.78 -3.20 0.23 0.00 0.00 176.35 175.25 2otd n ASN 191 N 1.40 3.21 0.25 2.29 2.85 -1.11 -1.59 115.26 122.56 2otd n ASN 191 Ca -0.18 1.01 0.15 0.00 -0.11 0.00 0.00 54.58 55.46 2otd n ASN 191 Cb 0.53 -1.36 0.84 0.00 1.24 0.00 0.00 39.78 41.03 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 8.07 0.00 0.00 1.20 2.07 -1.62 0.11 115.15 124.97 2otd h HIS 192 Ca -0.47 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.05 2otd h HIS 192 Cb 1.27 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.25 2otd h HIS 192 CO 0.80 0.00 0.00 0.87 -3.07 0.00 0.00 177.93 176.53 2otd h LYS 193 N 0.00 0.00 0.00 5.12 1.79 -1.89 -1.37 116.57 120.22 2otd h LYS 193 Ca 0.04 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.51 2otd h LYS 193 Cb 0.20 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.85 2otd h LYS 193 CO -0.00 0.00 -0.04 1.28 -1.08 0.00 0.00 179.45 179.61 2otd n LEU 194 N -2.64 0.55 -4.81 2.94 4.77 0.37 -4.94 117.00 113.24 2otd n LEU 194 Ca -0.02 0.53 -0.36 0.00 -0.03 0.00 0.00 56.01 56.12 2otd n LEU 194 Cb 0.07 -0.37 -0.07 0.00 -2.33 0.00 0.00 43.42 40.72 2otd n LEU 194 CO 0.15 -0.11 -0.21 -0.76 -1.33 0.00 0.00 177.39 175.13 2otd s LEU 195 N -4.02 4.15 0.30 2.23 1.02 -0.52 -5.01 118.68 116.84 2otd s LEU 195 Ca 0.12 0.36 0.03 0.00 0.02 0.00 0.00 54.13 54.65 2otd s LEU 195 Cb 0.15 -2.00 -0.04 0.00 0.02 0.00 0.00 46.19 44.31 2otd s LEU 195 CO 0.58 0.38 0.15 1.51 0.02 0.00 0.00 176.35 178.99 2otd s ASP 196 N -0.86 1.53 0.36 2.29 1.47 -1.26 -5.06 116.67 115.13 2otd s ASP 196 Ca 0.14 -1.53 0.04 0.00 1.18 0.00 0.00 52.55 52.38 2otd s ASP 196 Cb -0.12 0.35 0.69 0.00 -0.34 0.00 0.00 42.92 43.50 2otd s ASP 196 CO 0.03 -0.86 1.98 0.50 0.68 0.00 0.00 175.17 177.50 2otd h LYS 197 N 2.23 0.78 0.06 2.11 1.63 -1.98 -1.82 116.57 119.58 2otd h LYS 197 Ca -0.34 -0.05 -0.00 0.00 -0.85 0.00 0.00 60.65 59.41 2otd h LYS 197 Cb 1.25 -0.18 0.00 0.00 -0.60 0.00 0.00 32.23 32.70 2otd h LYS 197 CO 0.54 0.52 -0.03 0.00 -3.45 0.00 0.00 179.45 177.03 2otd h ALA 198 N 1.60 -0.08 -0.54 5.00 0.00 -1.98 -3.13 119.26 120.13 2otd h ALA 198 Ca 0.28 -0.26 0.10 0.00 0.00 0.00 0.00 54.91 55.04 2otd h ALA 198 Cb 0.12 0.03 -0.11 0.00 0.00 0.00 0.00 17.79 17.83 2otd h ALA 198 CO -0.08 -0.27 -0.27 0.00 0.00 0.00 0.00 179.25 178.63 2otd h ARG 199 N -0.64 -0.13 -0.70 0.00 2.47 -1.93 0.38 114.38 113.83 2otd h ARG 199 Ca -0.01 0.01 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 2otd h ARG 199 Cb 0.54 0.03 0.00 0.00 -1.65 0.00 0.00 29.97 28.89 2otd h ARG 199 CO 0.01 -0.09 0.00 0.28 0.56 0.00 0.00 179.97 180.74 2otd n VAL 200 N -5.43 0.00 0.00 2.04 0.31 -0.69 -0.54 118.33 114.02 2otd n VAL 200 Ca 0.04 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.37 2otd n VAL 200 Cb 0.34 -0.16 0.00 0.00 -0.91 0.00 0.00 33.84 33.11 2otd n VAL 200 CO 0.00 0.00 0.00 1.67 -1.32 0.00 0.00 176.83 177.18 2otd n GLN 202 N 0.61 0.00 0.08 5.55 7.27 0.13 0.00 117.38 131.02 2otd n GLN 202 Ca 0.00 0.00 -0.19 0.00 0.07 0.00 0.00 57.00 56.88 2otd n GLN 202 Cb 0.00 0.00 -0.10 0.00 2.41 0.00 0.00 30.24 32.55 2otd n GLN 202 CO 0.00 0.00 0.00 -0.07 0.07 0.00 0.00 177.06 177.06 2otd h LEU 203 N 0.00 0.76 -0.23 1.69 3.38 -1.08 -2.37 115.31 117.46 2otd h LEU 203 Ca 0.00 -0.67 0.01 0.00 0.09 0.00 0.00 57.88 57.31 2otd h LEU 203 Cb 0.00 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 2otd h LEU 203 CO 0.00 1.48 0.14 0.11 0.09 0.00 0.00 178.44 180.26 2otd h LYS 204 N 0.27 0.28 0.00 1.13 1.57 -0.62 -1.93 116.57 117.28 2otd h LYS 204 Ca -0.14 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.62 2otd h LYS 204 Cb 1.79 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 34.04 2otd h LYS 204 CO 0.21 0.19 0.00 -0.44 -0.57 0.00 0.00 179.45 178.84 2otd h ASP 205 N 0.29 0.00 -0.01 0.86 5.19 -1.75 1.45 116.42 122.44 2otd h ASP 205 Ca 0.09 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.50 2otd h ASP 205 Cb -0.01 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.50 2otd h ASP 205 CO -0.04 0.00 0.00 0.00 -3.12 0.00 0.00 179.24 176.08 2otd n ALA 206 N -2.00 2.60 -0.98 3.45 0.00 -0.75 -4.97 120.51 117.86 2otd n ALA 206 Ca -0.02 -0.39 0.00 0.00 0.00 0.00 0.00 53.44 53.04 2otd n ALA 206 Cb 0.11 -1.25 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 1.13 0.40 3.84 0.00 0.00 0.50 -5.04 105.19 106.02 2otd n GLY 207 Ca 0.20 -1.03 -0.37 0.00 0.00 0.00 0.00 46.02 44.82 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 4.39 0.70 0.99 1.43 -1.12 -4.95 118.68 120.12 2otd s LEU 208 Ca 0.00 0.63 -0.13 0.00 -1.03 0.00 0.00 54.13 53.60 2otd s LEU 208 Cb 0.00 -2.29 0.02 0.00 0.03 0.00 0.00 46.19 43.95 2otd s LEU 208 CO 0.00 0.33 1.10 -0.13 0.23 0.00 0.00 176.35 177.88 2otd s ARG 209 N -0.80 2.64 -0.14 1.70 1.81 -0.64 -4.36 118.95 119.16 2otd s ARG 209 Ca 0.18 1.26 -0.00 0.00 -1.72 0.00 0.00 55.73 55.45 2otd s ARG 209 Cb -0.14 -1.94 0.03 0.00 -0.45 0.00 0.00 34.95 32.45 2otd s ARG 209 CO 0.07 -1.36 -0.08 0.42 -0.68 0.00 0.00 175.30 173.67 2otd s ILE 210 N -2.61 1.17 0.04 1.52 1.01 -1.26 -1.24 121.20 119.83 2otd s ILE 210 Ca 0.64 -0.48 -0.00 0.00 0.00 0.00 0.00 60.65 60.81 2otd s ILE 210 Cb -0.18 -1.22 -0.04 0.00 0.01 0.00 0.00 42.46 41.03 2otd s ILE 210 CO 0.47 0.31 0.18 -0.22 0.00 0.00 0.00 174.94 175.68 2otd s LEU 211 N 1.64 4.26 -0.02 2.97 0.20 -0.52 -0.35 118.68 126.87 2otd s LEU 211 Ca 0.03 0.25 0.03 0.00 0.69 0.00 0.00 54.13 55.13 2otd s LEU 211 Cb -0.14 -2.77 -0.00 0.00 -0.43 0.00 0.00 46.19 42.85 2otd s LEU 211 CO -0.08 0.20 -0.10 -0.69 -0.29 0.00 0.00 176.35 175.39 2otd s VAL 212 N -1.43 0.82 0.11 1.68 1.01 -0.22 -1.41 120.40 120.97 2otd s VAL 212 Ca 0.31 -0.42 0.03 0.00 0.00 0.00 0.00 61.98 61.91 2otd s VAL 212 Cb -0.13 -0.70 -0.04 0.00 0.00 0.00 0.00 36.38 35.51 2otd s VAL 212 CO 0.24 0.24 -0.08 -0.72 0.00 0.00 0.00 175.10 174.78 2otd s TYR 213 N -0.08 1.02 -0.29 5.22 1.13 -0.62 -0.52 117.35 123.21 2otd s TYR 213 Ca 0.01 -0.82 -0.03 0.00 -1.41 0.00 0.00 57.07 54.83 2otd s TYR 213 Cb -0.06 -0.56 0.04 0.00 -1.10 0.00 0.00 41.96 40.28 2otd s TYR 213 CO -0.00 -0.06 -0.01 0.99 -2.51 0.00 0.00 175.55 173.97 2otd s THR 214 N -3.29 3.10 -0.25 -3.49 2.01 -1.26 -1.47 115.64 110.99 2otd s THR 214 Ca 0.12 -1.19 -0.07 0.00 0.31 0.00 0.00 61.69 60.85 2otd s THR 214 Cb 0.03 -2.70 -0.03 0.00 0.01 0.00 0.00 72.50 69.81 2otd s THR 214 CO -0.02 0.00 0.07 -0.69 -0.69 0.00 0.00 174.62 173.29 2otd s VAL 215 N 1.31 4.35 -0.03 3.82 1.01 -0.05 -4.88 120.40 125.93 2otd s VAL 215 Ca -0.03 -0.16 0.06 0.00 0.00 0.00 0.00 61.98 61.85 2otd s VAL 215 Cb -0.19 -3.03 -0.09 0.00 0.00 0.00 0.00 36.38 33.08 2otd s VAL 215 CO -0.02 0.34 0.10 0.59 0.00 0.00 0.00 175.10 176.11 2otd n ASN 216 N 4.86 3.59 -4.66 3.32 3.02 -1.26 -4.25 115.26 119.87 2otd n ASN 216 Ca -0.16 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 53.97 2otd n ASN 216 Cb 0.51 1.06 -0.04 0.00 -0.61 0.00 0.00 39.78 40.70 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 -2.33 4.26 0.18 3.52 -0.14 -1.26 -4.79 119.74 119.18 2otd s LYS 217 Ca -0.02 1.01 -0.20 0.00 -1.36 0.00 0.00 55.97 55.40 2otd s LYS 217 Cb 0.03 -3.60 0.12 0.00 -1.68 0.00 0.00 37.83 32.70 2otd s LYS 217 CO 0.25 -0.40 1.61 -1.35 -0.76 0.00 0.00 175.35 174.70 2otd h PRO 218 N 7.45 -0.15 -1.00 -1.68 0.11 -1.95 -1.03 132.00 133.75 2otd h PRO 218 Ca -0.27 0.01 0.01 0.00 0.11 0.00 0.00 66.00 65.87 2otd h PRO 218 Cb 1.11 0.03 -0.05 0.00 0.11 0.00 0.00 31.00 32.21 2otd h PRO 218 CO 0.86 -0.10 0.66 -0.56 -0.21 0.00 0.00 178.00 178.65 2otd h GLN 219 N -0.16 1.30 -0.20 1.05 -0.00 -1.99 0.45 115.11 115.56 2otd h GLN 219 Ca 0.22 -0.08 -0.18 0.00 -0.00 0.00 0.00 58.65 58.61 2otd h GLN 219 Cb 0.50 -0.29 0.00 0.00 -0.00 0.00 0.00 27.48 27.69 2otd h GLN 219 CO -0.57 0.86 -0.57 1.25 -0.00 0.00 0.00 178.83 179.80 2otd h HIS 220 N 1.34 0.96 -0.48 0.06 2.76 -1.90 -1.35 115.15 116.55 2otd h HIS 220 Ca 0.37 -0.38 0.07 0.00 -2.20 0.00 0.00 60.37 58.23 2otd h HIS 220 Cb -0.14 -0.17 -0.06 0.00 1.55 0.00 0.00 27.41 28.60 2otd h HIS 220 CO -0.00 1.19 0.14 0.00 -1.30 0.00 0.00 177.93 177.96 2otd h ALA 221 N 0.59 0.57 -0.80 5.26 0.00 -0.15 -0.19 119.26 124.54 2otd h ALA 221 Ca -0.01 0.08 0.05 0.00 0.00 0.00 0.00 54.91 55.02 2otd h ALA 221 Cb 1.19 0.07 -0.05 0.00 0.00 0.00 0.00 17.79 19.00 2otd h ALA 221 CO 0.12 -0.26 0.50 0.00 0.00 0.00 0.00 179.25 179.61 2otd h ALA 222 N 1.34 1.07 -0.47 0.00 0.00 -0.00 -2.31 119.26 118.89 2otd h ALA 222 Ca 0.23 -0.02 -0.12 0.00 0.00 0.00 0.00 54.91 55.01 2otd h ALA 222 Cb 0.27 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 2otd h ALA 222 CO -0.26 0.26 -0.17 1.49 0.00 0.00 0.00 179.25 180.57 2otd h GLU 223 N 0.93 0.93 -0.81 0.00 4.81 -0.38 -1.26 114.58 118.79 2otd h GLU 223 Ca 0.34 -0.36 -0.04 0.00 -0.13 0.00 0.00 59.36 59.16 2otd h GLU 223 Cb 0.10 -0.05 -0.04 0.00 0.63 0.00 0.00 28.75 29.39 2otd h GLU 223 CO -0.15 1.02 0.35 -0.07 -0.73 0.00 0.00 179.01 179.44 2otd h LEU 224 N 0.81 1.10 -0.22 1.64 -0.00 -0.74 -2.34 115.31 115.56 2otd h LEU 224 Ca 0.12 -0.15 -0.06 0.00 -0.00 0.00 0.00 57.88 57.78 2otd h LEU 224 Cb 0.72 -0.28 -0.01 0.00 -0.00 0.00 0.00 40.66 41.09 2otd h LEU 224 CO 0.06 0.95 -0.10 -0.07 -0.00 0.00 0.00 178.44 179.28 2otd h LEU 225 N 1.18 0.47 -0.98 1.67 3.38 -1.15 -2.20 115.31 117.67 2otd h LEU 225 Ca 0.28 -0.41 0.21 0.00 0.09 0.00 0.00 57.88 58.05 2otd h LEU 225 Cb 0.18 -0.13 -0.11 0.00 0.09 0.00 0.00 40.66 40.68 2otd h LEU 225 CO -0.03 0.77 0.58 0.03 0.09 0.00 0.00 178.44 179.88 2otd h ARG 226 N 0.17 0.66 0.00 1.13 3.08 -1.13 0.36 114.38 118.64 2otd h ARG 226 Ca 0.05 -0.04 -0.00 0.00 0.07 0.00 0.00 59.98 60.06 2otd h ARG 226 Cb 0.59 -0.15 -0.00 0.00 0.08 0.00 0.00 29.97 30.49 2otd h ARG 226 CO 0.03 0.43 -0.01 -1.49 -1.07 0.00 0.00 179.97 177.86 2otd h TRP 227 N 0.68 0.00 0.00 3.04 6.55 -1.16 -3.47 115.95 121.59 2otd h TRP 227 Ca 0.59 0.00 0.00 0.00 0.95 0.00 0.00 58.89 60.43 2otd h TRP 227 Cb 0.99 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 29.29 2otd h TRP 227 CO -0.02 0.01 0.00 0.41 -1.05 0.00 0.00 178.44 177.79 2otd n GLY 228 N -0.09 1.22 3.67 1.49 0.00 0.13 -5.00 105.19 106.60 2otd n GLY 228 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.70 3.90 -0.12 1.61 0.31 -0.85 -4.89 118.33 117.60 2otd n VAL 229 Ca 0.00 -0.44 -0.25 0.00 -0.01 0.00 0.00 64.34 63.64 2otd n VAL 229 Cb 0.00 -1.28 -0.10 0.00 -0.91 0.00 0.00 33.84 31.54 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 -1.70 1.91 -4.32 4.52 8.00 0.53 -4.70 116.55 120.78 2otd n ASP 230 Ca 0.15 0.39 -0.28 0.00 0.71 0.00 0.00 54.79 55.75 2otd n ASP 230 Cb 0.48 -0.89 -0.14 0.00 -0.02 0.00 0.00 41.12 40.56 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 -0.90 4.05 -0.30 0.00 1.01 0.62 -1.05 121.20 124.62 2otd s ILE 232 Ca 0.11 -0.26 -0.19 0.00 0.00 0.00 0.00 60.65 60.30 2otd s ILE 232 Cb -0.10 -2.87 -0.01 0.00 0.01 0.00 0.00 42.46 39.49 2otd s ILE 232 CO 0.03 0.37 0.59 0.00 0.00 0.00 0.00 174.94 175.93 2otd s THR 234 N 2.51 1.41 -0.38 0.00 -1.32 -0.96 -0.87 115.64 116.04 2otd s THR 234 Ca 0.23 -1.51 0.23 0.00 -1.21 0.00 0.00 61.69 59.43 2otd s THR 234 Cb -0.15 -1.38 -0.07 0.00 -1.51 0.00 0.00 72.50 69.39 2otd s THR 234 CO 0.12 -0.21 1.01 0.47 -2.21 0.00 0.00 174.62 173.79 2otd n ASP 235 N 1.00 0.65 -2.91 8.08 8.00 -1.26 -1.15 116.55 128.96 2otd n ASP 235 Ca -0.19 0.10 -0.32 0.00 0.71 0.00 0.00 54.79 55.09 2otd n ASP 235 Cb 0.55 0.70 -0.04 0.00 -0.02 0.00 0.00 41.12 42.31 2otd n ASP 235 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2otd n ALA 236 N -2.04 6.62 0.10 2.24 0.00 -1.26 -1.31 120.51 124.85 2otd n ALA 236 Ca 0.01 -3.48 0.06 0.00 0.00 0.00 0.00 53.44 50.02 2otd n ALA 236 Cb 0.50 -2.43 0.30 0.00 0.00 0.00 0.00 19.45 17.83 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 1.29 1.25 0.07 0.00 -5.35 -1.26 -1.00 119.36 114.36 2otd n ILE 237 Ca 0.55 0.64 -0.23 0.00 -0.27 0.00 0.00 62.75 63.44 2otd n ILE 237 Cb 0.43 -1.64 -0.15 0.00 -1.74 0.00 0.00 39.64 36.54 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 0.60 0.00 7.28 2.03 -1.94 -3.31 116.42 121.09 2otd h ASP 238 Ca 0.00 -0.94 -0.09 0.00 -0.73 0.00 0.00 57.03 55.28 2otd h ASP 238 Cb 0.16 -0.20 -0.01 0.00 -0.83 0.00 0.00 39.33 38.45 2otd h ASP 238 CO 0.00 1.78 -0.49 0.58 -1.03 0.00 0.00 179.24 180.08 2otd h VAL 239 N 0.08 1.27 0.00 4.15 2.07 -1.46 -3.41 116.25 118.95 2otd h VAL 239 Ca -0.35 -2.13 0.00 0.00 0.82 0.00 0.00 66.70 65.04 2otd h VAL 239 Cb 2.08 2.58 0.00 0.00 -1.52 0.00 0.00 31.29 34.43 2otd h VAL 239 CO 0.17 0.43 0.00 -0.38 0.02 0.00 0.00 177.57 177.81 2otd n ILE 240 N -4.56 0.00 0.00 4.57 2.08 -0.76 -5.02 119.36 115.68 2otd n ILE 240 Ca -0.17 0.39 0.00 0.00 0.56 0.00 0.00 62.75 63.53 2otd n ILE 240 Cb 0.51 -1.17 0.00 0.00 -0.75 0.00 0.00 39.64 38.23 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 0.66 1.74 0.25 7.39 0.00 -1.25 -4.44 105.19 109.54 2otd n GLY 241 Ca 0.00 -1.73 0.11 0.00 0.00 0.00 0.00 46.02 44.40 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 -0.72 1.61 0.13 -1.85 -1.81 132.00 129.37 2otd h PRO 242 Ca 0.00 0.00 -0.47 0.00 -0.87 0.00 0.00 66.00 64.66 2otd h PRO 242 Cb 0.00 0.00 -0.28 0.00 0.13 0.00 0.00 31.00 30.85 2otd h PRO 242 CO 0.00 0.15 0.01 0.09 -0.23 0.00 0.00 178.00 178.03 2otd n ASN 243 N -3.73 4.87 -4.69 1.44 5.03 -1.26 -4.61 115.26 112.31 2otd n ASN 243 Ca -0.02 -3.77 -0.42 0.00 0.87 0.00 0.00 54.58 51.24 2otd n ASN 243 Cb 0.26 -0.66 -0.03 0.00 -1.02 0.00 0.00 39.78 38.34 2otd n ASN 243 CO 0.00 0.00 0.00 0.12 -1.83 0.00 0.00 177.26 175.55 2otd s PHE 244 N -3.54 3.11 0.07 3.10 5.36 -0.68 -5.01 117.98 120.38 2otd s PHE 244 Ca 0.54 1.14 0.08 0.00 -0.96 0.00 0.00 56.93 57.72 2otd s PHE 244 Cb 0.44 -3.47 -0.03 0.00 -0.34 0.00 0.00 43.02 39.62 2otd s PHE 244 CO 0.02 -1.52 -0.20 0.95 -1.46 0.00 0.00 175.22 173.00 2otd s THR 245 N 2.34 2.65 -2.00 0.12 -4.23 -1.26 -4.98 115.64 108.28 2otd s THR 245 Ca 0.57 -1.34 0.25 0.00 -1.18 0.00 0.00 61.69 60.00 2otd s THR 245 Cb -0.25 -2.13 0.72 0.00 1.34 0.00 0.00 72.50 72.17 2otd s THR 245 CO 0.22 0.27 1.87 0.00 -0.54 0.00 0.00 174.62 176.44