#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2omk s ALA 0 N 0.00 2.98 0.24 5.41 0.00 -1.26 -4.80 121.76 124.33 2omk s ALA 0 Ca 0.00 0.65 -0.31 0.00 0.00 0.00 0.00 51.96 52.30 2omk s ALA 0 Cb 0.00 -3.26 -0.11 0.00 0.00 0.00 0.00 23.12 19.75 2omk s ALA 0 CO 0.00 -0.25 1.65 1.41 0.00 0.00 0.00 175.76 178.57 2omk s MET 1 N -2.87 4.13 -0.17 0.00 1.75 -1.26 -4.79 119.30 116.10 2omk s MET 1 Ca 0.63 2.57 -0.29 0.00 -1.25 0.00 0.00 55.69 57.34 2omk s MET 1 Cb -0.19 -3.06 -0.01 0.00 2.84 0.00 0.00 34.83 34.41 2omk s MET 1 CO 0.23 -0.68 1.16 0.42 -0.65 0.00 0.00 175.02 175.51 2omk s ILE 2 N 0.66 4.44 0.37 10.11 1.01 -0.10 -4.93 121.20 132.77 2omk s ILE 2 Ca 0.69 1.74 0.08 0.00 0.00 0.00 0.00 60.65 63.17 2omk s ILE 2 Cb -0.48 -4.12 -0.06 0.00 0.01 0.00 0.00 42.46 37.80 2omk s ILE 2 CO 0.39 -0.12 0.04 0.20 0.00 0.00 0.00 174.94 175.45 2omk s ASN 3 N 1.60 4.12 0.21 3.58 0.01 -1.26 -0.60 114.94 122.59 2omk s ASN 3 Ca 0.51 -1.13 -0.03 0.00 -0.71 0.00 0.00 52.86 51.50 2omk s ASN 3 Cb -0.20 -0.47 0.17 0.00 0.41 0.00 0.00 41.25 41.17 2omk s ASN 3 CO 0.13 -0.36 1.57 -0.08 -1.51 0.00 0.00 177.10 176.86 2omk h GLU 4 N 1.73 0.63 -4.93 -0.60 4.81 -1.96 -3.39 114.58 110.87 2omk h GLU 4 Ca -0.43 -0.32 -0.53 0.00 -0.13 0.00 0.00 59.36 57.95 2omk h GLU 4 Cb 1.25 0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.64 2omk h GLU 4 CO 0.71 0.92 1.86 1.58 -0.73 0.00 0.00 179.01 183.35 2omk n HIS 5 N -4.03 2.47 -3.52 0.92 -0.00 -1.26 -4.91 115.22 104.89 2omk n HIS 5 Ca -0.02 -1.80 -0.40 0.00 0.46 0.00 0.00 57.72 55.96 2omk n HIS 5 Cb 0.52 -2.16 -0.10 0.00 -0.12 0.00 0.00 29.99 28.12 2omk n HIS 5 CO 0.00 0.00 0.00 -0.47 0.46 0.00 0.00 176.34 176.33 2omk s TYR 6 N 7.19 3.23 -0.37 1.57 5.04 -1.26 -5.04 117.35 127.71 2omk s TYR 6 Ca 0.61 -0.19 -0.00 0.00 -2.44 0.00 0.00 57.07 55.05 2omk s TYR 6 Cb 0.08 -2.50 0.10 0.00 0.35 0.00 0.00 41.96 39.99 2omk s TYR 6 CO 0.11 -0.37 0.13 0.42 -1.34 0.00 0.00 175.55 174.50 2omk s ILE 7 N 1.76 2.88 0.50 3.14 -1.09 -1.26 -5.11 121.20 122.02 2omk s ILE 7 Ca 0.07 -2.10 -0.15 0.00 -2.23 0.00 0.00 60.65 56.24 2omk s ILE 7 Cb -0.17 -2.99 -0.07 0.00 -1.58 0.00 0.00 42.46 37.64 2omk s ILE 7 CO 0.11 -0.60 0.94 -2.16 -1.23 0.00 0.00 174.94 172.00 2omk s PRO 8 N 1.06 3.88 0.32 2.79 0.04 -1.26 -4.97 135.00 136.86 2omk s PRO 8 Ca 0.08 0.83 0.15 0.00 0.04 0.00 0.00 61.00 62.09 2omk s PRO 8 Cb -0.21 -2.19 0.49 0.00 0.04 0.00 0.00 34.50 32.63 2omk s PRO 8 CO -0.05 -0.24 1.66 1.96 0.04 0.00 0.00 177.00 180.37 2omk h GLN 9 N 0.90 0.00 -3.33 4.56 4.20 -1.01 -3.45 115.11 116.97 2omk h GLN 9 Ca -0.47 0.00 -0.11 0.00 0.06 0.00 0.00 58.65 58.13 2omk h GLN 9 Cb 1.19 0.00 -0.18 0.00 0.30 0.00 0.00 27.48 28.78 2omk h GLN 9 CO 0.62 0.50 -0.33 0.00 -0.67 0.00 0.00 178.83 178.95 2omk s ALA 10 N -3.56 -0.56 -0.07 3.87 0.00 -1.17 -3.96 121.76 116.30 2omk s ALA 10 Ca -0.00 -0.01 0.03 0.00 0.00 0.00 0.00 51.96 51.97 2omk s ALA 10 Cb 0.12 0.21 -0.02 0.00 0.00 0.00 0.00 23.12 23.43 2omk s ALA 10 CO 0.73 -0.32 -0.17 0.42 0.00 0.00 0.00 175.76 176.42 2omk s ILE 11 N -2.04 2.81 -0.24 0.00 -1.09 0.25 -2.29 121.20 118.60 2omk s ILE 11 Ca -0.09 -0.79 -0.08 0.00 -2.23 0.00 0.00 60.65 57.46 2omk s ILE 11 Cb -0.03 -2.11 -0.04 0.00 -1.58 0.00 0.00 42.46 38.70 2omk s ILE 11 CO -0.01 0.57 0.10 -0.63 -1.23 0.00 0.00 174.94 173.74 2omk s ILE 12 N -0.28 4.70 -0.51 2.92 1.01 -0.25 -1.04 121.20 127.74 2omk s ILE 12 Ca 0.01 -0.04 -0.19 0.00 0.00 0.00 0.00 60.65 60.43 2omk s ILE 12 Cb -0.13 -3.19 0.07 0.00 0.01 0.00 0.00 42.46 39.21 2omk s ILE 12 CO 0.03 0.34 0.61 -0.22 0.00 0.00 0.00 174.94 175.70 2omk s LEU 13 N 1.40 5.10 0.99 2.97 2.96 0.28 -0.71 118.68 131.66 2omk s LEU 13 Ca 0.06 -1.03 -0.16 0.00 -0.22 0.00 0.00 54.13 52.78 2omk s LEU 13 Cb -0.15 -2.40 0.21 0.00 0.50 0.00 0.00 46.19 44.35 2omk s LEU 13 CO 0.05 -0.90 1.31 0.00 -1.32 0.00 0.00 176.35 175.49 2omk s ALA 14 N 2.53 2.07 -0.29 5.97 0.00 0.29 -0.97 121.76 131.36 2omk s ALA 14 Ca 0.13 -1.19 0.12 0.00 0.00 0.00 0.00 51.96 51.02 2omk s ALA 14 Cb -0.20 -2.78 0.77 0.00 0.00 0.00 0.00 23.12 20.90 2omk s ALA 14 CO 0.11 -2.57 1.77 -1.71 0.00 0.00 0.00 175.76 173.36 2omk n ASN 15 N -3.87 5.12 -2.82 0.00 5.15 -1.22 -4.70 115.26 112.92 2omk n ASN 15 Ca 0.15 -3.12 0.00 0.00 -0.60 0.00 0.00 54.58 51.01 2omk n ASN 15 Cb 0.59 -0.72 0.00 0.00 -0.53 0.00 0.00 39.78 39.13 2omk n ASN 15 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2omk n GLY 16 N 0.10 0.54 3.72 8.20 0.00 0.13 -4.94 105.19 112.94 2omk n GLY 16 Ca 0.36 -1.55 -0.42 0.00 0.00 0.00 0.00 46.02 44.40 2omk n GLY 16 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2omk s GLU 17 N 0.23 4.43 0.28 1.61 2.56 0.16 -4.89 118.70 123.08 2omk s GLU 17 Ca 0.00 1.82 -0.30 0.00 0.00 0.00 0.00 54.97 56.49 2omk s GLU 17 Cb 0.00 -3.31 -0.13 0.00 2.00 0.00 0.00 34.13 32.69 2omk s GLU 17 CO 0.00 -0.24 1.40 0.98 -0.56 0.00 0.00 175.26 176.84 2omk n TYR 18 N 3.62 2.29 -1.72 5.30 9.36 -1.26 -4.36 117.16 130.40 2omk n TYR 18 Ca 0.08 0.45 -0.41 0.00 3.32 0.00 0.00 57.90 61.34 2omk n TYR 18 Cb 0.46 -2.46 0.02 0.00 -0.63 0.00 0.00 39.34 36.72 2omk n TYR 18 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 2omk n PRO 19 N 1.60 2.00 -0.00 2.98 -0.04 -1.26 -4.94 135.00 135.33 2omk n PRO 19 Ca 0.09 0.71 0.00 0.00 -0.04 0.00 0.00 63.50 64.26 2omk n PRO 19 Cb 0.34 -2.46 -0.00 0.00 -0.04 0.00 0.00 33.50 31.34 2omk n PRO 19 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2omk n ALA 20 N -0.26 2.00 -1.79 0.55 0.00 -1.26 -4.88 120.51 114.87 2omk n ALA 20 Ca 0.06 -0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.16 2omk n ALA 20 Cb 0.40 0.12 -0.03 0.00 0.00 0.00 0.00 19.45 19.95 2omk n ALA 20 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 2omk s HIS 21 N -2.00 2.93 0.25 0.00 5.65 -1.26 -4.94 115.29 115.91 2omk s HIS 21 Ca -0.00 1.57 -0.04 0.00 0.25 0.00 0.00 55.06 56.84 2omk s HIS 21 Cb 0.00 -3.12 0.40 0.00 -1.18 0.00 0.00 32.58 28.68 2omk s HIS 21 CO 0.00 -0.99 1.82 1.05 -0.65 0.00 0.00 174.74 175.97 2omk h GLU 22 N 1.49 0.83 0.96 2.88 9.09 -1.96 -2.64 114.58 125.24 2omk h GLU 22 Ca -0.50 -0.05 -0.05 0.00 0.05 0.00 0.00 59.36 58.82 2omk h GLU 22 Cb 1.23 -0.19 0.01 0.00 -1.65 0.00 0.00 28.75 28.15 2omk h GLU 22 CO 0.59 0.55 -0.46 1.25 0.05 0.00 0.00 179.01 180.99 2omk h LEU 23 N 0.86 -1.09 -1.60 3.06 5.85 -1.93 0.20 115.31 120.65 2omk h LEU 23 Ca 0.40 0.04 0.00 0.00 0.84 0.00 0.00 57.88 59.16 2omk h LEU 23 Cb 0.33 0.28 -0.02 0.00 0.37 0.00 0.00 40.66 41.62 2omk h LEU 23 CO -0.23 -0.77 0.25 1.55 -0.34 0.00 0.00 178.44 178.90 2omk h PRO 24 N -1.31 0.52 -0.53 5.25 0.13 -1.84 -0.39 132.00 133.83 2omk h PRO 24 Ca -0.13 -0.03 -0.07 0.00 -0.87 0.00 0.00 66.00 64.89 2omk h PRO 24 Cb 0.99 -0.12 -0.02 0.00 0.13 0.00 0.00 31.00 31.98 2omk h PRO 24 CO 0.22 0.35 0.06 -0.07 -0.23 0.00 0.00 178.00 178.32 2omk h LEU 25 N 0.53 0.86 -0.40 1.56 3.38 -1.32 -1.54 115.31 118.38 2omk h LEU 25 Ca 0.14 -0.28 -0.04 0.00 0.09 0.00 0.00 57.88 57.79 2omk h LEU 25 Cb -0.05 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.46 2omk h LEU 25 CO -0.03 0.92 0.08 0.03 0.09 0.00 0.00 178.44 179.53 2omk h ARG 26 N 0.77 0.66 -0.89 1.13 3.08 -0.11 -0.91 114.38 118.09 2omk h ARG 26 Ca 0.16 -0.17 0.08 0.00 0.07 0.00 0.00 59.98 60.12 2omk h ARG 26 Cb 0.45 -0.08 -0.07 0.00 0.08 0.00 0.00 29.97 30.35 2omk h ARG 26 CO 0.02 0.69 0.55 -0.07 -1.07 0.00 0.00 179.97 180.09 2omk h LEU 27 N 0.51 0.83 -0.31 3.04 3.38 -1.00 -0.40 115.31 121.36 2omk h LEU 27 Ca 0.12 0.03 -0.12 0.00 0.09 0.00 0.00 57.88 58.01 2omk h LEU 27 Cb 0.35 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 2omk h LEU 27 CO 0.01 0.49 -0.27 0.25 0.09 0.00 0.00 178.44 179.01 2omk h LEU 28 N 0.94 0.78 -0.84 1.67 5.85 -1.13 -2.01 115.31 120.57 2omk h LEU 28 Ca 0.41 -0.46 -0.08 0.00 0.84 0.00 0.00 57.88 58.60 2omk h LEU 28 Cb 0.29 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.09 2omk h LEU 28 CO -0.22 1.07 -0.01 0.00 -0.34 0.00 0.00 178.44 178.95 2omk h ALA 29 N 0.73 1.03 -0.69 1.25 0.00 -0.62 -3.06 119.26 117.90 2omk h ALA 29 Ca 0.05 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.68 2omk h ALA 29 Cb 0.84 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.43 2omk h ALA 29 CO 0.07 0.60 0.00 0.39 0.00 0.00 0.00 179.25 180.31 2omk n GLU 30 N -4.20 3.10 -1.82 0.00 1.02 -0.21 -5.00 120.64 113.52 2omk n GLU 30 Ca 0.03 -2.73 -0.41 0.00 -0.02 0.00 0.00 57.16 54.03 2omk n GLU 30 Cb 0.32 -1.67 -0.01 0.00 -0.02 0.00 0.00 31.44 30.06 2omk n GLU 30 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2omk s ALA 31 N -1.31 3.61 0.11 0.62 0.00 -0.76 -4.92 121.76 119.11 2omk s ALA 31 Ca 0.49 1.55 0.02 0.00 0.00 0.00 0.00 51.96 54.02 2omk s ALA 31 Cb 0.28 -3.61 -0.20 0.00 0.00 0.00 0.00 23.12 19.59 2omk s ALA 31 CO 0.30 -1.01 1.25 1.96 0.00 0.00 0.00 175.76 178.26 2omk h GLN 32 N 3.50 0.13 -2.73 0.00 4.20 -1.87 -3.46 115.11 114.89 2omk h GLN 32 Ca -0.50 -0.20 -0.14 0.00 0.06 0.00 0.00 58.65 57.88 2omk h GLN 32 Cb 1.23 0.07 -0.27 0.00 0.30 0.00 0.00 27.48 28.81 2omk h GLN 32 CO 0.68 1.07 -0.35 0.12 -0.67 0.00 0.00 178.83 179.68 2omk s PHE 33 N -2.77 -0.55 -0.11 2.96 5.36 -1.25 -5.06 117.98 116.56 2omk s PHE 33 Ca -0.01 1.18 0.02 0.00 -0.96 0.00 0.00 56.93 57.15 2omk s PHE 33 Cb 0.09 0.21 0.01 0.00 -0.34 0.00 0.00 43.02 42.99 2omk s PHE 33 CO 0.84 -0.32 -0.17 0.08 -1.46 0.00 0.00 175.22 174.19 2omk s VAL 34 N 1.45 1.59 -0.20 3.12 1.01 -1.26 -0.58 120.40 125.52 2omk s VAL 34 Ca -0.09 -0.71 -0.04 0.00 0.00 0.00 0.00 61.98 61.14 2omk s VAL 34 Cb -0.09 -1.43 -0.02 0.00 0.00 0.00 0.00 36.38 34.84 2omk s VAL 34 CO -0.12 0.46 -0.03 -0.69 0.00 0.00 0.00 175.10 174.73 2omk s VAL 35 N 0.87 3.66 -0.13 2.92 1.01 -0.21 -1.20 120.40 127.33 2omk s VAL 35 Ca -0.09 -0.41 -0.07 0.00 0.00 0.00 0.00 61.98 61.42 2omk s VAL 35 Cb -0.15 -2.65 -0.04 0.00 0.00 0.00 0.00 36.38 33.53 2omk s VAL 35 CO -0.00 0.43 0.11 0.00 0.00 0.00 0.00 175.10 175.64 2omk n ALA 40 N -2.94 0.00 -0.25 0.00 0.00 -1.26 -4.47 120.51 111.59 2omk n ALA 40 Ca -0.33 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.08 2omk n ALA 40 Cb 1.05 0.00 0.09 0.00 0.00 0.00 0.00 19.45 20.59 2omk n ALA 40 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2omk h ALA 41 N 0.00 0.94 -0.90 0.00 0.00 -1.90 -0.26 119.26 117.14 2omk h ALA 41 Ca 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 2omk h ALA 41 Cb 0.00 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.56 2omk h ALA 41 CO 0.00 0.16 0.53 -0.91 0.00 0.00 0.00 179.25 179.03 2omk h ASN 42 N 0.81 1.09 -0.49 0.00 2.35 -1.95 -0.79 115.58 116.60 2omk h ASN 42 Ca 0.30 -0.07 -0.11 0.00 -0.55 0.00 0.00 56.30 55.86 2omk h ASN 42 Cb 0.09 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.17 2omk h ASN 42 CO -0.14 0.84 -0.14 -0.08 -1.65 0.00 0.00 177.43 176.27 2omk h GLU 43 N 1.24 0.96 -0.31 0.81 4.57 -1.87 -2.31 114.58 117.67 2omk h GLU 43 Ca 0.32 -0.38 -0.02 0.00 -1.18 0.00 0.00 59.36 58.10 2omk h GLU 43 Cb -0.03 -0.05 -0.01 0.00 -0.16 0.00 0.00 28.75 28.49 2omk h GLU 43 CO -0.06 1.05 0.11 -0.92 -1.18 0.00 0.00 179.01 178.01 2omk h TYR 44 N 0.82 0.49 -0.48 0.92 3.20 -0.69 -2.88 116.97 118.35 2omk h TYR 44 Ca 0.12 -0.04 -0.12 0.00 3.14 0.00 0.00 58.73 61.83 2omk h TYR 44 Cb 0.70 -0.14 -0.02 0.00 1.54 0.00 0.00 36.73 38.81 2omk h TYR 44 CO 0.05 0.49 -0.16 0.82 -1.64 0.00 0.00 178.16 177.71 2omk h ILE 45 N 0.35 1.27 0.00 1.81 2.04 -1.18 -2.78 117.51 119.01 2omk h ILE 45 Ca 0.10 -1.30 -0.01 0.00 1.00 0.00 0.00 64.86 64.65 2omk h ILE 45 Cb 0.21 1.07 -0.00 0.00 -0.74 0.00 0.00 36.82 37.36 2omk h ILE 45 CO -0.01 0.45 -0.06 0.77 0.00 0.00 0.00 178.15 179.30 2omk h SER 46 N 0.82 0.00 -0.40 1.72 4.64 -1.32 -0.09 113.55 118.92 2omk h SER 46 Ca 0.12 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.44 2omk h SER 46 Cb 0.71 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.80 2omk h SER 46 CO 0.05 0.06 0.00 0.54 -0.87 0.00 0.00 176.83 176.61 2omk n ARG 47 N -3.48 2.59 -1.27 4.77 1.74 -1.07 -4.91 116.66 115.03 2omk n ARG 47 Ca -0.02 -1.73 0.00 0.00 -0.77 0.00 0.00 57.85 55.33 2omk n ARG 47 Cb 0.18 -1.61 0.00 0.00 -1.02 0.00 0.00 32.46 30.02 2omk n ARG 47 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2omk n GLY 48 N 0.85 0.43 3.86 -0.13 0.00 -0.05 -5.05 105.19 105.10 2omk n GLY 48 Ca 0.16 -0.97 -0.21 0.00 0.00 0.00 0.00 46.02 45.00 2omk n GLY 48 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2omk s HIS 49 N -2.00 2.74 -0.21 1.61 3.76 -1.07 -5.04 115.29 115.08 2omk s HIS 49 Ca 0.00 -0.46 -0.01 0.00 -0.15 0.00 0.00 55.06 54.44 2omk s HIS 49 Cb 0.00 -2.07 0.06 0.00 1.11 0.00 0.00 32.58 31.68 2omk s HIS 49 CO 0.00 -0.03 -0.01 0.99 -0.85 0.00 0.00 174.74 174.84 2omk s THR 50 N -2.45 1.00 0.63 1.30 2.01 -1.26 -4.23 115.64 112.65 2omk s THR 50 Ca 0.46 -0.84 -0.12 0.00 0.31 0.00 0.00 61.69 61.51 2omk s THR 50 Cb -0.03 -1.37 -0.03 0.00 0.01 0.00 0.00 72.50 71.08 2omk s THR 50 CO 0.27 -0.13 1.04 -2.16 -0.69 0.00 0.00 174.62 172.95 2omk s PRO 51 N 1.64 3.40 -0.16 4.92 0.04 -1.26 -4.91 135.00 138.68 2omk s PRO 51 Ca -0.03 0.87 0.04 0.00 0.04 0.00 0.00 61.00 61.92 2omk s PRO 51 Cb -0.18 -2.05 -0.23 0.00 0.04 0.00 0.00 34.50 32.08 2omk s PRO 51 CO -0.07 -0.73 0.20 -0.25 0.04 0.00 0.00 177.00 176.19 2omk n ASP 52 N -2.71 1.50 -3.88 6.66 8.00 -0.34 -4.97 116.55 120.82 2omk n ASP 52 Ca 0.07 0.11 -0.12 0.00 0.71 0.00 0.00 54.79 55.56 2omk n ASP 52 Cb 0.54 -0.27 -0.14 0.00 -0.02 0.00 0.00 41.12 41.23 2omk n ASP 52 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 2omk s VAL 53 N -2.54 0.01 -0.14 2.53 1.01 -0.97 -4.85 120.40 115.45 2omk s VAL 53 Ca -0.21 -0.06 0.02 0.00 0.00 0.00 0.00 61.98 61.74 2omk s VAL 53 Cb 0.07 -0.03 0.01 0.00 0.00 0.00 0.00 36.38 36.43 2omk s VAL 53 CO 0.74 -0.03 -0.22 -0.63 0.00 0.00 0.00 175.10 174.96 2omk s ILE 54 N -0.09 2.12 -0.34 2.22 1.01 -0.32 -0.88 121.20 124.91 2omk s ILE 54 Ca -0.01 -0.97 -0.11 0.00 0.00 0.00 0.00 60.65 59.56 2omk s ILE 54 Cb -0.01 -1.84 -0.00 0.00 0.01 0.00 0.00 42.46 40.62 2omk s ILE 54 CO -0.00 0.55 0.20 -0.63 0.00 0.00 0.00 174.94 175.06 2omk s ILE 55 N 0.75 4.87 -1.21 2.92 1.01 0.01 -0.53 121.20 129.01 2omk s ILE 55 Ca -0.08 -0.47 0.00 0.00 0.00 0.00 0.00 60.65 60.09 2omk s ILE 55 Cb -0.16 -3.56 0.00 0.00 0.01 0.00 0.00 42.46 38.76 2omk s ILE 55 CO -0.00 -0.05 0.00 0.61 0.00 0.00 0.00 174.94 175.49 2omk n GLY 56 N 5.04 -1.35 1.38 6.18 0.00 -0.96 -4.58 105.19 110.90 2omk n GLY 56 Ca -0.13 -0.96 0.12 0.00 0.00 0.00 0.00 46.02 45.05 2omk n GLY 56 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2omk n ASP 57 N 0.73 4.02 0.00 1.61 5.68 -1.26 -4.05 116.55 123.27 2omk n ASP 57 Ca 0.00 -2.01 0.00 0.00 -0.50 0.00 0.00 54.79 52.28 2omk n ASP 57 Cb 0.00 -0.50 0.00 0.00 -1.14 0.00 0.00 41.12 39.48 2omk n ASP 57 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2omk n GLY 58 N 1.66 2.65 1.52 6.12 0.00 -1.26 -4.76 105.19 111.12 2omk n GLY 58 Ca 0.25 -0.13 -0.03 0.00 0.00 0.00 0.00 46.02 46.11 2omk n GLY 58 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2omk n ASP 59 N 0.67 3.80 -0.07 1.61 8.00 -1.26 -4.40 116.55 124.92 2omk n ASP 59 Ca 0.00 -2.74 -0.07 0.00 0.71 0.00 0.00 54.79 52.69 2omk n ASP 59 Cb 0.00 -0.65 -0.05 0.00 -0.02 0.00 0.00 41.12 40.40 2omk n ASP 59 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 2omk h SER 60 N 1.83 0.00 -4.10 -2.24 0.02 -1.94 -3.47 113.55 103.65 2omk h SER 60 Ca 0.15 -0.31 -0.51 0.00 -0.84 0.00 0.00 61.79 60.28 2omk h SER 60 Cb 1.71 0.00 0.09 0.00 0.14 0.00 0.00 62.40 64.34 2omk h SER 60 CO 0.45 0.80 0.44 -0.76 -1.14 0.00 0.00 176.83 176.63 2omk s LEU 61 N -8.31 3.70 0.21 5.07 1.43 -1.26 -4.93 118.68 114.58 2omk s LEU 61 Ca -0.11 2.24 -0.31 0.00 -1.03 0.00 0.00 54.13 54.91 2omk s LEU 61 Cb 0.00 -4.59 -0.11 0.00 0.03 0.00 0.00 46.19 41.53 2omk s LEU 61 CO 0.29 -1.37 1.61 -0.76 0.23 0.00 0.00 176.35 176.35 2omk s LEU 62 N -3.95 4.37 0.37 1.79 1.43 -1.26 -4.84 118.68 116.59 2omk s LEU 62 Ca 0.74 2.77 0.21 0.00 -1.03 0.00 0.00 54.13 56.82 2omk s LEU 62 Cb -0.26 -3.61 1.35 0.00 0.03 0.00 0.00 46.19 43.71 2omk s LEU 62 CO 0.30 -0.88 1.58 -0.65 0.23 0.00 0.00 176.35 176.93 2omk h PRO 63 N 6.25 0.00 -0.59 1.29 0.11 -1.98 0.37 132.00 137.46 2omk h PRO 63 Ca -0.44 -0.00 0.06 0.00 0.11 0.00 0.00 66.00 65.74 2omk h PRO 63 Cb 1.21 -0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.28 2omk h PRO 63 CO 0.89 0.00 0.39 1.49 -0.21 0.00 0.00 178.00 180.57 2omk h GLU 64 N 0.00 0.54 0.00 1.05 4.81 -2.02 -1.90 114.58 117.06 2omk h GLU 64 Ca 0.85 -0.03 -0.07 0.00 -0.13 0.00 0.00 59.36 59.98 2omk h GLU 64 Cb 2.26 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 31.50 2omk h GLU 64 CO -0.76 0.35 -1.28 0.66 -0.73 0.00 0.00 179.01 177.25 2omk n TYR 65 N -4.48 0.85 -0.17 0.92 4.01 0.12 -4.31 117.16 114.10 2omk n TYR 65 Ca 0.08 0.26 0.03 0.00 -0.16 0.00 0.00 57.90 58.12 2omk n TYR 65 Cb 0.25 -0.96 0.31 0.00 -0.31 0.00 0.00 39.34 38.63 2omk n TYR 65 CO 0.00 0.00 0.00 0.87 -0.46 0.00 0.00 176.86 177.27 2omk h LYS 66 N 0.00 0.83 -0.82 -0.72 1.57 -0.27 -1.64 116.57 115.51 2omk h LYS 66 Ca -0.07 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.66 2omk h LYS 66 Cb 1.23 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 33.36 2omk h LYS 66 CO 0.02 0.55 0.00 0.36 -0.57 0.00 0.00 179.45 179.80 2omk n LYS 67 N -4.45 0.71 0.00 3.15 2.85 -1.17 -1.97 118.16 117.27 2omk n LYS 67 Ca 0.08 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.34 2omk n LYS 67 Cb 0.11 -1.31 0.00 0.00 -0.65 0.00 0.00 35.03 33.18 2omk n LYS 67 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 2omk n ARG 68 N 0.25 0.00 -0.34 -1.58 3.00 -0.70 -4.96 116.66 112.33 2omk n ARG 68 Ca 0.00 0.00 0.08 0.00 -0.01 0.00 0.00 57.85 57.92 2omk n ARG 68 Cb 0.21 -0.49 0.14 0.00 0.00 0.00 0.00 32.46 32.33 2omk n ARG 68 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.63 178.82 2omk n PHE 69 N -1.40 0.00 0.22 -1.55 3.01 -0.73 -4.74 117.46 112.26 2omk n PHE 69 Ca 0.00 -1.05 0.08 0.00 1.01 0.00 0.00 57.45 57.49 2omk n PHE 69 Cb 0.00 -0.17 0.47 0.00 -0.01 0.00 0.00 39.48 39.77 2omk n PHE 69 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 2omk h SER 70 N 0.36 0.00 0.98 4.37 4.64 -1.63 -3.13 113.55 119.14 2omk h SER 70 Ca -0.01 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.22 2omk h SER 70 Cb 1.08 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.15 2omk h SER 70 CO 0.00 0.27 -0.43 0.77 -0.87 0.00 0.00 176.83 176.58 2omk h SER 71 N 0.00 0.00 -0.56 4.97 4.64 -1.86 -3.23 113.55 117.51 2omk h SER 71 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2omk h SER 71 Cb 0.68 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.77 2omk h SER 71 CO 0.04 0.43 0.00 2.30 -0.87 0.00 0.00 176.83 178.72 2omk n ILE 72 N -3.46 0.75 -3.00 0.95 -5.35 -1.18 -4.92 119.36 103.15 2omk n ILE 72 Ca 0.00 -0.78 -0.40 0.00 -0.27 0.00 0.00 62.75 61.30 2omk n ILE 72 Cb 0.57 0.47 -0.05 0.00 -1.74 0.00 0.00 39.64 38.89 2omk n ILE 72 CO 0.00 0.00 0.00 -0.63 -1.76 0.00 0.00 176.55 174.16 2omk s ILE 73 N -1.25 4.60 0.01 7.28 1.01 -1.22 -1.17 121.20 130.45 2omk s ILE 73 Ca 0.40 1.64 0.00 0.00 0.00 0.00 0.00 60.65 62.69 2omk s ILE 73 Cb 0.21 -4.11 -0.01 0.00 0.01 0.00 0.00 42.46 38.56 2omk s ILE 73 CO 0.28 0.43 -0.02 -0.22 0.00 0.00 0.00 174.94 175.42 2omk s LEU 74 N -0.52 2.09 0.00 2.97 2.96 0.31 -4.93 118.68 121.56 2omk s LEU 74 Ca 0.37 -0.19 0.00 0.00 -0.22 0.00 0.00 54.13 54.09 2omk s LEU 74 Cb -0.21 0.02 0.00 0.00 0.50 0.00 0.00 46.19 46.49 2omk s LEU 74 CO 0.24 -0.11 0.00 0.00 -1.32 0.00 0.00 176.35 175.16 2omk n GLN 75 N 2.51 -0.40 -5.06 1.98 6.02 -1.26 -2.26 117.38 118.92 2omk n GLN 75 Ca -0.17 0.00 -0.32 0.00 -0.01 0.00 0.00 57.00 56.50 2omk n GLN 75 Cb 0.58 0.00 -0.16 0.00 1.02 0.00 0.00 30.24 31.68 2omk n GLN 75 CO 0.00 0.00 0.00 -2.00 -1.01 0.00 0.00 177.06 174.05 2omk s GLU 80 N -1.49 3.08 0.00 -1.09 2.12 -1.26 -4.92 118.70 115.14 2omk s GLU 80 Ca 0.00 -0.81 0.00 0.00 0.36 0.00 0.00 54.97 54.52 2omk s GLU 80 Cb 0.00 -2.40 0.00 0.00 0.26 0.00 0.00 34.13 31.99 2omk s GLU 80 CO 0.00 0.24 0.00 0.25 -0.54 0.00 0.00 175.26 175.21 2omk n THR 81 N 3.40 0.00 -3.54 -1.70 -2.24 -1.26 -5.15 114.28 103.79 2omk n THR 81 Ca -0.18 0.00 -0.25 0.00 -2.27 0.00 0.00 64.05 61.34 2omk n THR 81 Cb 0.53 0.00 -0.02 0.00 -2.10 0.00 0.00 70.33 68.74 2omk n THR 81 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 2omk s ASN 82 N 2.00 6.35 0.34 3.42 4.22 -1.26 -4.99 114.94 125.01 2omk s ASN 82 Ca 0.00 0.43 0.03 0.00 -2.14 0.00 0.00 52.86 51.18 2omk s ASN 82 Cb 0.00 -2.02 0.61 0.00 1.28 0.00 0.00 41.25 41.11 2omk s ASN 82 CO 0.00 -0.18 1.93 0.44 -2.04 0.00 0.00 177.10 177.25 2omk h ASP 83 N 1.32 0.62 -0.47 3.54 3.32 -1.99 -1.81 116.42 120.95 2omk h ASP 83 Ca -0.49 -0.07 0.03 0.00 0.02 0.00 0.00 57.03 56.51 2omk h ASP 83 Cb 1.21 -0.16 -0.03 0.00 0.22 0.00 0.00 39.33 40.57 2omk h ASP 83 CO 0.64 0.56 0.27 -0.61 -1.72 0.00 0.00 179.24 178.39 2omk h GLN 84 N 0.68 0.53 -0.45 3.56 4.15 -1.97 -0.48 115.11 121.12 2omk h GLN 84 Ca 0.16 -0.03 -0.05 0.00 0.77 0.00 0.00 58.65 59.50 2omk h GLN 84 Cb 0.14 -0.12 -0.02 0.00 0.21 0.00 0.00 27.48 27.69 2omk h GLN 84 CO -0.02 0.35 0.08 1.15 -1.93 0.00 0.00 178.83 178.46 2omk h THR 85 N 0.54 1.24 -0.97 2.39 2.02 -1.79 -0.95 112.91 115.41 2omk h THR 85 Ca 0.19 -0.89 0.01 0.00 0.77 0.00 0.00 66.41 66.49 2omk h THR 85 Cb 0.04 0.95 -0.05 0.00 -1.74 0.00 0.00 68.15 67.35 2omk h THR 85 CO -0.10 0.31 0.64 0.11 0.37 0.00 0.00 175.52 176.85 2omk h LYS 86 N 0.61 1.28 -0.43 6.66 1.57 -1.17 0.08 116.57 125.18 2omk h LYS 86 Ca 0.14 -0.08 -0.02 0.00 -1.87 0.00 0.00 60.65 58.82 2omk h LYS 86 Cb 0.37 -0.29 -0.02 0.00 0.08 0.00 0.00 32.23 32.38 2omk h LYS 86 CO 0.01 0.85 0.20 0.00 -0.57 0.00 0.00 179.45 179.94 2omk h ALA 87 N 1.35 0.55 -0.12 3.86 0.00 -0.69 -0.18 119.26 124.02 2omk h ALA 87 Ca 0.35 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.15 2omk h ALA 87 Cb -0.14 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 2omk h ALA 87 CO -0.08 0.12 0.08 0.28 0.00 0.00 0.00 179.25 179.65 2omk h VAL 88 N 0.55 1.05 -0.64 0.00 2.07 -0.75 -2.02 116.25 116.50 2omk h VAL 88 Ca 0.15 -0.10 -0.07 0.00 0.82 0.00 0.00 66.70 67.49 2omk h VAL 88 Cb 0.13 0.90 -0.03 0.00 -1.52 0.00 0.00 31.29 30.77 2omk h VAL 88 CO -0.02 0.04 0.12 0.45 0.02 0.00 0.00 177.57 178.18 2omk h HIS 89 N 0.15 1.10 0.05 1.57 -0.00 -0.84 0.50 115.15 117.68 2omk h HIS 89 Ca 0.04 -0.14 0.01 0.00 -0.00 0.00 0.00 60.37 60.28 2omk h HIS 89 Cb 0.00 -0.31 -0.01 0.00 -0.00 0.00 0.00 27.41 27.10 2omk h HIS 89 CO -0.06 0.92 -0.07 -0.92 -0.00 0.00 0.00 177.93 177.80 2omk h TYR 90 N 0.98 -0.17 -0.77 2.45 3.20 -0.98 -0.75 116.97 120.94 2omk h TYR 90 Ca 0.20 0.00 -0.01 0.00 3.14 0.00 0.00 58.73 62.06 2omk h TYR 90 Cb 0.41 0.07 -0.04 0.00 1.54 0.00 0.00 36.73 38.71 2omk h TYR 90 CO 0.03 -0.11 0.44 -0.07 -1.64 0.00 0.00 178.16 176.81 2omk h LEU 91 N -0.14 0.93 -1.27 2.82 3.38 -1.06 -1.85 115.31 118.11 2omk h LEU 91 Ca 0.01 -0.06 -0.04 0.00 0.09 0.00 0.00 57.88 57.88 2omk h LEU 91 Cb 0.15 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 2omk h LEU 91 CO -0.03 0.73 0.04 -0.61 0.09 0.00 0.00 178.44 178.65 2omk h GLN 92 N 1.06 0.53 0.00 1.13 4.15 -0.66 -2.02 115.11 119.31 2omk h GLN 92 Ca 0.27 -0.10 -0.03 0.00 0.77 0.00 0.00 58.65 59.56 2omk h GLN 92 Cb -0.01 -0.08 -0.00 0.00 0.21 0.00 0.00 27.48 27.59 2omk h GLN 92 CO -0.05 0.53 -0.14 0.66 -1.93 0.00 0.00 178.83 177.90 2omk h SER 93 N 0.51 0.00 -0.53 -0.69 4.64 -0.30 -2.84 113.55 114.34 2omk h SER 93 Ca 0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 2omk h SER 93 Cb 0.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.37 2omk h SER 93 CO 0.00 0.14 0.00 0.29 -0.87 0.00 0.00 176.83 176.40 2omk n LYS 94 N -3.34 2.63 -0.99 4.77 4.76 -0.84 -4.93 118.16 120.23 2omk n LYS 94 Ca -0.00 -2.07 0.00 0.00 -2.87 0.00 0.00 58.31 53.37 2omk n LYS 94 Cb 0.36 -1.57 0.00 0.00 -1.84 0.00 0.00 35.03 31.98 2omk n LYS 94 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2omk n GLY 95 N 1.18 0.69 3.75 0.72 0.00 -1.07 -5.02 105.19 105.44 2omk n GLY 95 Ca 0.19 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.80 2omk n GLY 95 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2omk s ILE 96 N -2.81 3.37 0.00 -0.61 -1.09 -0.82 -4.93 121.20 114.30 2omk s ILE 96 Ca 0.00 1.24 0.00 0.00 -2.23 0.00 0.00 60.65 59.66 2omk s ILE 96 Cb 0.00 -3.79 0.00 0.00 -1.58 0.00 0.00 42.46 37.09 2omk s ILE 96 CO 0.00 0.24 0.00 0.54 -1.23 0.00 0.00 174.94 174.49 2omk n ARG 97 N 1.84 1.00 -4.01 2.79 5.12 -1.26 -4.16 116.66 117.97 2omk n ARG 97 Ca 0.02 0.00 -0.31 0.00 -1.93 0.00 0.00 57.85 55.63 2omk n ARG 97 Cb 0.44 -0.91 -0.16 0.00 -1.16 0.00 0.00 32.46 30.67 2omk n ARG 97 CO 0.00 0.00 0.00 0.21 -1.93 0.00 0.00 177.63 175.91 2omk s LYS 98 N -1.73 2.09 0.03 5.56 2.20 -1.26 0.11 119.74 126.76 2omk s LYS 98 Ca 0.00 -0.97 0.02 0.00 -0.36 0.00 0.00 55.97 54.66 2omk s LYS 98 Cb 0.00 -2.55 -0.02 0.00 -1.51 0.00 0.00 37.83 33.75 2omk s LYS 98 CO 0.00 -0.46 -0.07 0.42 -0.36 0.00 0.00 175.35 174.87 2omk s ILE 99 N 1.33 0.52 -0.04 5.43 1.01 0.17 -0.26 121.20 129.36 2omk s ILE 99 Ca -0.03 -0.89 0.07 0.00 0.00 0.00 0.00 60.65 59.79 2omk s ILE 99 Cb -0.17 -0.56 -0.02 0.00 0.01 0.00 0.00 42.46 41.72 2omk s ILE 99 CO -0.08 -0.27 -0.24 0.00 0.00 0.00 0.00 174.94 174.36 2omk s ALA 100 N -1.10 2.25 -0.16 9.38 0.00 -0.97 -2.13 121.76 129.03 2omk s ALA 100 Ca -0.07 -1.07 -0.06 0.00 0.00 0.00 0.00 51.96 50.75 2omk s ALA 100 Cb -0.08 -0.66 -0.04 0.00 0.00 0.00 0.00 23.12 22.34 2omk s ALA 100 CO 0.00 0.50 0.04 0.42 0.00 0.00 0.00 175.76 176.72 2omk s ILE 101 N -0.49 4.63 0.20 0.00 1.01 0.93 -1.09 121.20 126.38 2omk s ILE 101 Ca 0.06 -0.10 0.10 0.00 0.00 0.00 0.00 60.65 60.71 2omk s ILE 101 Cb -0.11 -3.06 -0.04 0.00 0.01 0.00 0.00 42.46 39.25 2omk s ILE 101 CO 0.01 0.49 -0.19 0.68 0.00 0.00 0.00 174.94 175.92 2omk s VAL 102 N 0.17 2.08 -1.20 2.92 -7.23 0.11 -0.66 120.40 116.59 2omk s VAL 102 Ca 0.03 -2.09 -0.00 0.00 -1.81 0.00 0.00 61.98 58.11 2omk s VAL 102 Cb -0.12 -2.03 0.00 0.00 0.56 0.00 0.00 36.38 34.78 2omk s VAL 102 CO 0.01 -0.32 0.04 0.61 -0.31 0.00 0.00 175.10 175.12 2omk n GLY 103 N 0.00 -0.21 0.00 2.32 0.00 -1.26 -0.55 105.19 105.50 2omk n GLY 103 Ca -0.11 -0.28 0.12 0.00 0.00 0.00 0.00 46.02 45.75 2omk n GLY 103 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2omk n ALA 104 N -1.80 3.57 -2.50 4.61 0.00 -1.26 0.20 120.51 123.34 2omk n ALA 104 Ca -0.16 -0.36 -0.24 0.00 0.00 0.00 0.00 53.44 52.68 2omk n ALA 104 Cb 0.62 -1.11 -0.09 0.00 0.00 0.00 0.00 19.45 18.87 2omk n ALA 104 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 2omk s THR 105 N -2.99 0.92 0.00 0.00 -4.23 -1.26 -4.47 115.64 103.61 2omk s THR 105 Ca 0.11 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.62 2omk s THR 105 Cb 0.17 -2.55 0.00 0.00 1.34 0.00 0.00 72.50 71.46 2omk s THR 105 CO 0.70 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 175.39 2omk n GLY 106 N -0.82 0.58 0.00 3.99 0.00 -1.26 -0.66 105.19 107.01 2omk n GLY 106 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.97 2omk n GLY 106 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2omk n LYS 107 N -2.01 2.53 -1.67 1.61 5.02 -1.26 -4.56 118.16 117.82 2omk n LYS 107 Ca 0.00 0.00 -0.46 0.00 -2.02 0.00 0.00 58.31 55.83 2omk n LYS 107 Cb 0.00 0.00 -0.04 0.00 -0.02 0.00 0.00 35.03 34.97 2omk n LYS 107 CO 0.00 0.00 0.00 2.89 -0.52 0.00 0.00 177.40 179.77 2omk n ARG 108 N 0.00 2.20 0.21 1.97 1.85 -1.26 -4.85 116.66 116.78 2omk n ARG 108 Ca 0.00 0.80 0.06 0.00 -1.00 0.00 0.00 57.85 57.71 2omk n ARG 108 Cb 0.00 -2.58 0.48 0.00 -1.05 0.00 0.00 32.46 29.30 2omk n ARG 108 CO 0.00 0.00 0.00 0.93 -0.01 0.00 0.00 177.63 178.55 2omk h GLU 109 N 6.47 0.00 -0.25 2.89 3.07 -1.99 -2.13 114.58 122.64 2omk h GLU 109 Ca -0.45 0.00 -0.09 0.00 -0.50 0.00 0.00 59.36 58.32 2omk h GLU 109 Cb 1.25 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 29.15 2omk h GLU 109 CO 0.90 0.28 -0.22 0.38 -1.40 0.00 0.00 179.01 178.95 2omk h ASP 110 N 0.00 0.45 -0.39 1.42 2.03 -1.99 -0.21 116.42 117.73 2omk h ASP 110 Ca -0.00 -0.14 -0.06 0.00 -0.73 0.00 0.00 57.03 56.09 2omk h ASP 110 Cb 0.58 -0.12 -0.01 0.00 -0.83 0.00 0.00 39.33 38.94 2omk h ASP 110 CO 0.04 0.68 -0.01 0.45 -1.03 0.00 0.00 179.24 179.37 2omk h HIS 111 N 0.41 0.75 -0.12 4.15 3.86 -1.77 -1.44 115.15 120.99 2omk h HIS 111 Ca 0.06 -0.14 0.03 0.00 -1.16 0.00 0.00 60.37 59.17 2omk h HIS 111 Cb 0.62 -0.19 -0.03 0.00 1.06 0.00 0.00 27.41 28.86 2omk h HIS 111 CO 0.02 0.78 -0.06 1.15 0.86 0.00 0.00 177.93 180.68 2omk h THR 112 N 0.51 0.80 -0.52 2.45 2.02 -1.18 -0.01 112.91 116.98 2omk h THR 112 Ca 0.11 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.29 2omk h THR 112 Cb 0.49 0.80 -0.03 0.00 -1.74 0.00 0.00 68.15 67.68 2omk h THR 112 CO 0.02 0.00 0.32 -0.07 0.37 0.00 0.00 175.52 176.16 2omk h LEU 113 N -0.05 0.62 0.09 2.58 3.38 -0.99 -1.38 115.31 119.55 2omk h LEU 113 Ca 0.07 -0.05 -0.00 0.00 0.09 0.00 0.00 57.88 57.99 2omk h LEU 113 Cb 0.15 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.75 2omk h LEU 113 CO -0.16 0.48 -0.04 1.23 0.09 0.00 0.00 178.44 180.04 2omk h GLY 114 N 0.70 -0.12 0.83 0.83 0.00 -1.10 -2.10 103.07 102.11 2omk h GLY 114 Ca 0.19 0.04 0.04 0.00 0.00 0.00 0.00 47.33 47.60 2omk h GLY 114 CO -0.04 -0.04 0.57 3.43 0.00 0.00 0.00 176.54 180.46 2omk h ASN 115 N -0.12 0.94 -0.20 0.19 2.35 -0.78 -2.29 115.58 115.66 2omk h ASN 115 Ca -0.01 -0.00 -0.21 0.00 -0.55 0.00 0.00 56.30 55.53 2omk h ASN 115 Cb 0.09 -0.20 0.01 0.00 0.05 0.00 0.00 38.32 38.26 2omk h ASN 115 CO 0.02 0.63 -0.67 0.40 -1.65 0.00 0.00 177.43 176.16 2omk h ILE 116 N 1.09 1.28 0.00 2.81 1.08 -1.21 -3.21 117.51 119.35 2omk h ILE 116 Ca 0.37 -1.86 -0.05 0.00 -0.39 0.00 0.00 64.86 62.93 2omk h ILE 116 Cb 0.05 1.81 -0.01 0.00 -3.07 0.00 0.00 36.82 35.61 2omk h ILE 116 CO -0.13 0.60 -0.22 0.77 -0.69 0.00 0.00 178.15 178.47 2omk h SER 117 N 0.60 0.00 1.12 1.72 4.64 -1.07 -2.82 113.55 117.74 2omk h SER 117 Ca -0.02 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.27 2omk h SER 117 Cb 1.29 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 63.37 2omk h SER 117 CO 0.14 0.22 -0.12 -0.07 -0.87 0.00 0.00 176.83 176.14 2omk h LEU 118 N 0.00 0.00 -0.79 5.97 3.38 -1.42 -3.22 115.31 119.23 2omk h LEU 118 Ca -0.00 0.00 0.15 0.00 0.09 0.00 0.00 57.88 58.11 2omk h LEU 118 Cb 0.47 0.00 -0.10 0.00 0.09 0.00 0.00 40.66 41.13 2omk h LEU 118 CO 0.03 0.12 0.35 -0.07 0.09 0.00 0.00 178.44 178.96 2omk h LEU 119 N 0.00 0.37 -1.67 1.67 3.38 -1.60 -0.53 115.31 116.93 2omk h LEU 119 Ca -0.00 0.10 -0.04 0.00 0.09 0.00 0.00 57.88 58.03 2omk h LEU 119 Cb 0.71 0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.51 2omk h LEU 119 CO 0.02 0.14 -0.19 0.58 0.09 0.00 0.00 178.44 179.08 2omk h VAL 120 N 0.51 0.98 0.12 1.22 2.07 -1.76 -2.66 116.25 116.73 2omk h VAL 120 Ca 0.44 -0.69 -0.28 0.00 0.82 0.00 0.00 66.70 66.99 2omk h VAL 120 Cb 0.65 1.39 0.01 0.00 -1.52 0.00 0.00 31.29 31.82 2omk h VAL 120 CO -0.39 0.19 -1.22 -0.33 0.02 0.00 0.00 177.57 175.83 2omk h GLU 121 N 0.00 0.34 -0.89 1.57 5.08 -1.30 -3.27 114.58 116.12 2omk h GLU 121 Ca -0.00 -0.53 -0.01 0.00 -1.00 0.00 0.00 59.36 57.82 2omk h GLU 121 Cb 0.37 0.19 -0.04 0.00 0.50 0.00 0.00 28.75 29.77 2omk h GLU 121 CO 0.02 1.24 0.51 1.88 -1.00 0.00 0.00 179.01 181.66 2omk h TYR 122 N 0.11 1.20 -0.26 4.33 0.05 -1.02 -2.95 116.97 118.44 2omk h TYR 122 Ca -0.14 -0.02 -0.11 0.00 0.05 0.00 0.00 58.73 58.51 2omk h TYR 122 Cb 1.93 -0.39 -0.01 0.00 1.01 0.00 0.00 36.73 39.27 2omk h TYR 122 CO 0.07 0.81 -0.31 0.00 -1.05 0.00 0.00 178.16 177.69 2omk h MET 123 N 1.23 0.53 0.00 4.88 -0.00 -1.62 -2.48 114.93 117.48 2omk h MET 123 Ca 0.32 -0.23 -0.05 0.00 -0.00 0.00 0.00 59.70 59.74 2omk h MET 123 Cb -0.01 -0.02 -0.01 0.00 -0.00 0.00 0.00 31.60 31.57 2omk h MET 123 CO -0.05 0.78 -0.24 0.07 -0.00 0.00 0.00 176.91 177.46 2omk h ARG 124 N 0.45 0.00 0.00 -0.10 0.11 -1.57 0.09 114.38 113.37 2omk h ARG 124 Ca 0.06 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.14 2omk h ARG 124 Cb 0.77 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.85 2omk h ARG 124 CO 0.06 0.24 0.00 0.77 0.10 0.00 0.00 179.97 181.15 2omk h SER 125 N 0.00 0.00 0.00 0.08 0.02 -1.35 -3.47 113.55 108.83 2omk h SER 125 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2omk h SER 125 Cb 0.79 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.33 2omk h SER 125 CO 0.03 0.00 0.00 0.61 -1.14 0.00 0.00 176.83 176.33 2omk n GLY 126 N 0.11 1.08 3.85 -3.77 0.00 0.02 -5.11 105.19 101.36 2omk n GLY 126 Ca 0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.68 2omk n GLY 126 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2omk s MET 127 N -0.49 3.86 -0.42 1.61 -1.94 -0.95 -5.00 119.30 115.96 2omk s MET 127 Ca 0.00 0.32 -0.15 0.00 -1.71 0.00 0.00 55.69 54.15 2omk s MET 127 Cb 0.00 -3.00 0.03 0.00 2.01 0.00 0.00 34.83 33.87 2omk s MET 127 CO 0.00 0.55 0.32 -2.00 -0.01 0.00 0.00 175.02 173.88 2omk s GLU 128 N -1.83 2.97 -0.01 2.03 2.12 0.12 -3.79 118.70 120.32 2omk s GLU 128 Ca 0.34 -1.10 0.04 0.00 0.36 0.00 0.00 54.97 54.61 2omk s GLU 128 Cb -0.15 -4.02 -0.01 0.00 0.26 0.00 0.00 34.13 30.22 2omk s GLU 128 CO 0.18 -0.82 -0.12 0.08 -0.54 0.00 0.00 175.26 174.04 2omk s VAL 129 N 1.67 0.97 0.03 3.70 1.01 -1.26 -0.66 120.40 125.86 2omk s VAL 129 Ca 0.05 -0.56 0.03 0.00 0.00 0.00 0.00 61.98 61.50 2omk s VAL 129 Cb -0.20 -0.82 -0.02 0.00 0.00 0.00 0.00 36.38 35.34 2omk s VAL 129 CO 0.09 0.25 -0.09 -0.13 0.00 0.00 0.00 175.10 175.22 2omk s ARG 130 N -0.35 0.64 -0.22 2.72 0.52 -0.91 -4.40 118.95 116.96 2omk s ARG 130 Ca 0.04 -0.61 -0.05 0.00 -0.52 0.00 0.00 55.73 54.59 2omk s ARG 130 Cb -0.05 -0.55 -0.02 0.00 0.52 0.00 0.00 34.95 34.86 2omk s ARG 130 CO -0.00 0.13 -0.01 0.99 0.02 0.00 0.00 175.30 176.43 2omk s THR 131 N -0.88 3.74 -0.22 0.02 2.01 -0.74 -0.05 115.64 119.52 2omk s THR 131 Ca -0.03 -0.37 -0.06 0.00 0.31 0.00 0.00 61.69 61.54 2omk s THR 131 Cb -0.07 -2.71 -0.03 0.00 0.01 0.00 0.00 72.50 69.70 2omk s THR 131 CO 0.01 0.40 0.04 -0.69 -0.69 0.00 0.00 174.62 173.69 2omk s VAL 132 N 1.38 4.16 0.19 3.82 1.01 0.16 -0.36 120.40 130.76 2omk s VAL 132 Ca 0.05 -0.23 0.01 0.00 0.00 0.00 0.00 61.98 61.81 2omk s VAL 132 Cb -0.15 -2.91 0.01 0.00 0.00 0.00 0.00 36.38 33.34 2omk s VAL 132 CO -0.00 0.39 0.12 0.35 0.00 0.00 0.00 175.10 175.96 2omk n THR 133 N 4.55 0.00 1.27 3.92 -2.24 0.03 -4.24 114.28 117.57 2omk n THR 133 Ca -0.17 -0.77 0.12 0.00 -2.27 0.00 0.00 64.05 60.97 2omk n THR 133 Cb 0.52 -0.26 0.66 0.00 -2.10 0.00 0.00 70.33 69.15 2omk n THR 133 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2omk n ASP 134 N -1.81 0.00 0.00 3.42 8.00 -1.26 -4.02 116.55 120.88 2omk n ASP 134 Ca -0.02 -0.22 0.00 0.00 0.71 0.00 0.00 54.79 55.27 2omk n ASP 134 Cb 0.22 -0.23 0.00 0.00 -0.02 0.00 0.00 41.12 41.09 2omk n ASP 134 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2omk n TYR 135 N -1.23 0.00 -3.28 1.24 4.02 -1.26 -4.79 117.16 111.86 2omk n TYR 135 Ca 0.13 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 58.02 2omk n TYR 135 Cb 0.18 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.50 2omk n TYR 135 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2omk n GLY 136 N 1.08 -1.19 3.09 2.72 0.00 -1.26 -1.93 105.19 107.71 2omk n GLY 136 Ca 0.00 -0.90 -0.26 0.00 0.00 0.00 0.00 46.02 44.86 2omk n GLY 136 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2omk s THR 137 N -3.00 1.36 -0.15 2.61 2.01 -0.59 -0.79 115.64 117.09 2omk s THR 137 Ca 0.00 -0.64 -0.17 0.00 0.31 0.00 0.00 61.69 61.19 2omk s THR 137 Cb 0.00 -1.20 -0.04 0.00 0.01 0.00 0.00 72.50 71.27 2omk s THR 137 CO 0.00 0.40 0.46 -0.36 -0.69 0.00 0.00 174.62 174.43 2omk s PHE 138 N 0.36 3.46 -0.18 4.92 0.40 0.51 -1.27 117.98 126.19 2omk s PHE 138 Ca -0.11 0.80 -0.00 0.00 -0.60 0.00 0.00 56.93 57.03 2omk s PHE 138 Cb -0.14 -2.55 0.04 0.00 0.51 0.00 0.00 43.02 40.88 2omk s PHE 138 CO 0.04 0.10 -0.06 0.42 0.70 0.00 0.00 175.22 176.42 2omk s ILE 139 N 0.88 1.25 0.30 0.64 1.01 0.32 -1.79 121.20 123.82 2omk s ILE 139 Ca 0.24 -0.78 -0.29 0.00 0.00 0.00 0.00 60.65 59.83 2omk s ILE 139 Cb -0.15 -1.43 -0.09 0.00 0.01 0.00 0.00 42.46 40.80 2omk s ILE 139 CO 0.09 0.10 1.08 -2.16 0.00 0.00 0.00 174.94 174.04 2omk s PRO 140 N 1.56 4.58 0.04 2.79 0.04 -1.26 -1.33 135.00 141.42 2omk s PRO 140 Ca -0.01 1.73 -0.01 0.00 0.04 0.00 0.00 61.00 62.75 2omk s PRO 140 Cb -0.16 -3.09 -0.03 0.00 0.04 0.00 0.00 34.50 31.26 2omk s PRO 140 CO -0.08 0.18 -0.03 0.08 0.04 0.00 0.00 177.00 177.20 2omk s VAL 141 N -1.25 0.17 0.02 -0.36 1.01 0.07 -4.96 120.40 115.10 2omk s VAL 141 Ca 0.46 -1.39 0.02 0.00 0.00 0.00 0.00 61.98 61.08 2omk s VAL 141 Cb -0.30 -0.94 -0.01 0.00 0.00 0.00 0.00 36.38 35.13 2omk s VAL 141 CO 0.38 -0.77 -0.08 -0.94 0.00 0.00 0.00 175.10 173.70 2omk s SER 142 N -2.25 0.86 0.81 3.32 1.04 -1.26 -1.33 113.70 114.88 2omk s SER 142 Ca -0.04 -0.34 0.00 0.00 0.48 0.00 0.00 55.95 56.05 2omk s SER 142 Cb -0.00 -0.03 0.00 0.00 0.10 0.00 0.00 66.02 66.09 2omk s SER 142 CO -0.06 -0.06 0.00 0.47 0.98 0.00 0.00 173.24 174.58 2omk n ASP 143 N 2.17 -0.83 -4.72 7.02 8.00 -0.10 -4.68 116.55 123.40 2omk n ASP 143 Ca -0.18 0.00 -0.42 0.00 0.71 0.00 0.00 54.79 54.90 2omk n ASP 143 Cb 0.56 0.00 -0.03 0.00 -0.02 0.00 0.00 41.12 41.63 2omk n ASP 143 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2omk s THR 144 N 0.00 4.01 -0.15 -3.53 2.01 -1.24 -4.35 115.64 112.39 2omk s THR 144 Ca 0.00 1.53 -0.10 0.00 0.31 0.00 0.00 61.69 63.42 2omk s THR 144 Cb 0.00 -3.98 0.05 0.00 0.01 0.00 0.00 72.50 68.58 2omk s THR 144 CO 0.00 0.16 0.38 -1.58 -0.69 0.00 0.00 174.62 172.89 2omk s GLN 145 N 0.60 0.39 0.03 4.92 2.00 -0.42 -4.77 119.66 122.40 2omk s GLN 145 Ca 0.55 0.65 -0.00 0.00 -2.00 0.00 0.00 55.36 54.56 2omk s GLN 145 Cb -0.29 0.06 -0.04 0.00 0.80 0.00 0.00 33.01 33.54 2omk s GLN 145 CO 0.31 -0.12 0.15 -1.54 -0.50 0.00 0.00 175.29 173.60 2omk s SER 146 N 0.91 6.08 -0.02 6.67 1.04 -1.26 -1.20 113.70 125.92 2omk s SER 146 Ca -0.06 0.22 0.02 0.00 0.48 0.00 0.00 55.95 56.62 2omk s SER 146 Cb -0.06 -1.83 0.00 0.00 0.10 0.00 0.00 66.02 64.23 2omk s SER 146 CO -0.07 0.22 -0.09 -0.36 0.98 0.00 0.00 173.24 173.93 2omk s PHE 147 N -1.37 0.89 0.32 5.02 0.40 0.95 -0.92 117.98 123.27 2omk s PHE 147 Ca 0.29 -0.21 -0.27 0.00 -0.60 0.00 0.00 56.93 56.13 2omk s PHE 147 Cb -0.13 -0.63 -0.09 0.00 0.51 0.00 0.00 43.02 42.68 2omk s PHE 147 CO 0.21 -0.09 1.05 0.00 0.70 0.00 0.00 175.22 177.09 2omk s ALA 148 N 0.16 3.28 0.36 5.36 0.00 0.23 -1.24 121.76 129.91 2omk s ALA 148 Ca -0.02 0.77 -0.07 0.00 0.00 0.00 0.00 51.96 52.63 2omk s ALA 148 Cb -0.08 -3.28 0.02 0.00 0.00 0.00 0.00 23.12 19.78 2omk s ALA 148 CO 0.00 -0.10 0.59 -1.54 0.00 0.00 0.00 175.76 174.72 2omk s SER 149 N -1.20 0.60 0.06 0.00 1.04 -0.34 -4.85 113.70 109.02 2omk s SER 149 Ca 0.49 -1.37 0.06 0.00 0.48 0.00 0.00 55.95 55.62 2omk s SER 149 Cb -0.27 0.74 -0.03 0.00 0.10 0.00 0.00 66.02 66.56 2omk s SER 149 CO 0.34 -1.45 -0.17 -0.72 0.98 0.00 0.00 173.24 172.22 2omk s TYR 150 N -2.76 1.50 0.08 5.02 -0.85 -1.25 -4.29 117.35 114.80 2omk s TYR 150 Ca 0.25 -0.40 -0.34 0.00 -0.52 0.00 0.00 57.07 56.06 2omk s TYR 150 Cb -0.02 -0.86 -0.14 0.00 0.38 0.00 0.00 41.96 41.32 2omk s TYR 150 CO 0.17 0.10 1.64 -2.30 -1.52 0.00 0.00 175.55 173.64 2omk n PRO 151 N 1.53 2.06 -0.04 -3.49 -0.02 -1.07 -1.13 135.00 132.84 2omk n PRO 151 Ca -0.19 0.75 0.00 0.00 -2.02 0.00 0.00 63.50 62.04 2omk n PRO 151 Cb 0.54 -2.52 0.00 0.00 -0.02 0.00 0.00 33.50 31.50 2omk n PRO 151 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2omk n GLY 152 N 3.62 0.50 3.71 -1.23 0.00 0.49 -4.98 105.19 107.31 2omk n GLY 152 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 2omk n GLY 152 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2omk s GLN 153 N -0.84 4.25 0.13 1.61 0.74 -0.29 -4.75 119.66 120.51 2omk s GLN 153 Ca 0.00 2.26 -0.30 0.00 0.05 0.00 0.00 55.36 57.37 2omk s GLN 153 Cb 0.00 -3.25 -0.07 0.00 1.10 0.00 0.00 33.01 30.79 2omk s GLN 153 CO 0.00 -0.57 1.19 -0.65 -0.55 0.00 0.00 175.29 174.70 2omk s GLN 154 N 1.35 4.48 -0.06 1.67 -1.52 -1.26 -0.58 119.66 123.74 2omk s GLN 154 Ca 0.69 1.81 0.01 0.00 -1.95 0.00 0.00 55.36 55.91 2omk s GLN 154 Cb -0.41 -3.29 0.02 0.00 -0.22 0.00 0.00 33.01 29.11 2omk s GLN 154 CO 0.31 -0.14 -0.06 0.08 -0.25 0.00 0.00 175.29 175.23 2omk s VAL 155 N 0.42 0.68 -0.10 1.09 1.01 -0.27 -2.14 120.40 121.09 2omk s VAL 155 Ca 0.55 -0.17 0.03 0.00 0.00 0.00 0.00 61.98 62.38 2omk s VAL 155 Cb -0.31 -0.70 -0.01 0.00 0.00 0.00 0.00 36.38 35.36 2omk s VAL 155 CO 0.33 0.27 -0.18 -0.44 0.00 0.00 0.00 175.10 175.08 2omk s SER 156 N 1.11 3.60 -0.17 3.32 0.01 -0.11 -0.41 113.70 121.05 2omk s SER 156 Ca -0.08 -0.40 -0.00 0.00 1.31 0.00 0.00 55.95 56.78 2omk s SER 156 Cb -0.14 -1.29 0.00 0.00 0.21 0.00 0.00 66.02 64.80 2omk s SER 156 CO -0.01 0.21 -0.14 -0.63 0.41 0.00 0.00 173.24 173.07 2omk s ILE 157 N 0.08 2.68 -0.18 1.44 1.01 -0.24 -0.13 121.20 125.87 2omk s ILE 157 Ca -0.08 -0.76 -0.00 0.00 0.00 0.00 0.00 60.65 59.81 2omk s ILE 157 Cb -0.15 -2.14 0.01 0.00 0.01 0.00 0.00 42.46 40.18 2omk s ILE 157 CO 0.05 0.51 -0.16 -0.63 0.00 0.00 0.00 174.94 174.71 2omk s ILE 158 N 0.96 2.48 0.26 2.92 1.01 0.25 -3.93 121.20 125.17 2omk s ILE 158 Ca -0.02 -0.81 -0.28 0.00 0.00 0.00 0.00 60.65 59.54 2omk s ILE 158 Cb -0.15 -2.06 -0.09 0.00 0.01 0.00 0.00 42.46 40.17 2omk s ILE 158 CO -0.02 0.51 0.92 0.21 0.00 0.00 0.00 174.94 176.56 2omk s ASN 159 N 1.17 7.51 -0.35 3.58 2.47 -1.26 -0.59 114.94 127.47 2omk s ASN 159 Ca 0.02 1.88 0.10 0.00 0.42 0.00 0.00 52.86 55.27 2omk s ASN 159 Cb -0.14 -2.59 0.45 0.00 -1.45 0.00 0.00 41.25 37.52 2omk s ASN 159 CO -0.07 0.08 1.11 0.49 -3.72 0.00 0.00 177.10 175.00 2omk n PHE 160 N 1.15 2.57 0.00 0.43 3.01 -0.71 -4.90 117.46 119.02 2omk n PHE 160 Ca -0.01 -2.63 0.00 0.00 1.01 0.00 0.00 57.45 55.82 2omk n PHE 160 Cb 0.48 -0.23 0.00 0.00 -0.01 0.00 0.00 39.48 39.72 2omk n PHE 160 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2omk n GLY 161 N -0.51 0.56 3.76 1.37 0.00 -1.22 -4.23 105.19 104.91 2omk n GLY 161 Ca 0.32 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.97 2omk n GLY 161 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2omk s ALA 162 N -2.00 2.75 0.08 4.61 0.00 -1.11 -4.72 121.76 121.37 2omk s ALA 162 Ca 0.00 1.06 0.09 0.00 0.00 0.00 0.00 51.96 53.11 2omk s ALA 162 Cb 0.00 -3.46 -0.03 0.00 0.00 0.00 0.00 23.12 19.63 2omk s ALA 162 CO 0.00 -1.05 -0.23 0.15 0.00 0.00 0.00 175.76 174.63 2omk s LYS 163 N -3.03 1.38 -0.48 0.00 1.02 0.28 -4.76 119.74 114.15 2omk s LYS 163 Ca 0.72 -1.11 0.00 0.00 0.02 0.00 0.00 55.97 55.59 2omk s LYS 163 Cb -0.32 -1.62 0.00 0.00 -0.52 0.00 0.00 37.83 35.36 2omk s LYS 163 CO 0.37 0.40 0.00 0.41 -0.92 0.00 0.00 175.35 175.61 2omk n GLY 164 N 1.43 0.17 3.69 -3.33 0.00 -1.26 -1.35 105.19 104.55 2omk n GLY 164 Ca -0.18 -0.66 -0.42 0.00 0.00 0.00 0.00 46.02 44.76 2omk n GLY 164 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2omk n LEU 165 N -0.79 4.06 -3.67 0.99 4.77 -1.25 -4.23 117.00 116.88 2omk n LEU 165 Ca -0.07 0.99 -0.13 0.00 -0.03 0.00 0.00 56.01 56.78 2omk n LEU 165 Cb 0.53 -1.55 -0.06 0.00 -2.33 0.00 0.00 43.42 40.01 2omk n LEU 165 CO 0.08 0.19 0.15 -1.59 -1.33 0.00 0.00 177.39 174.88 2omk s LYS 166 N 2.57 0.91 0.09 3.23 -2.85 -0.53 -4.01 119.74 119.15 2omk s LYS 166 Ca 0.81 -0.35 0.01 0.00 -1.00 0.00 0.00 55.97 55.44 2omk s LYS 166 Cb -0.48 0.40 -0.04 0.00 -2.06 0.00 0.00 37.83 35.65 2omk s LYS 166 CO 0.37 -0.31 -0.04 0.00 0.10 0.00 0.00 175.35 175.47 2omk s ALA 167 N -2.40 0.83 0.05 0.59 0.00 -1.26 0.04 121.76 119.59 2omk s ALA 167 Ca -0.06 -1.32 0.09 0.00 0.00 0.00 0.00 51.96 50.67 2omk s ALA 167 Cb -0.01 0.26 -0.03 0.00 0.00 0.00 0.00 23.12 23.34 2omk s ALA 167 CO -0.02 -0.30 -0.25 -1.21 0.00 0.00 0.00 175.76 173.98 2omk s GLU 168 N -3.88 1.68 0.00 0.00 8.01 -0.58 -4.82 118.70 119.10 2omk s GLU 168 Ca 0.11 -1.07 0.00 0.00 0.01 0.00 0.00 54.97 54.03 2omk s GLU 168 Cb 0.06 -1.84 0.00 0.00 -4.31 0.00 0.00 34.13 28.04 2omk s GLU 168 CO -0.06 0.47 0.00 0.41 0.01 0.00 0.00 175.26 176.10 2omk n GLY 169 N 1.78 0.78 3.53 -1.39 0.00 -1.26 -1.52 105.19 107.10 2omk n GLY 169 Ca -0.17 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.55 2omk n GLY 169 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2omk s LEU 170 N 0.00 2.87 0.19 0.99 1.43 -1.26 -1.27 118.68 121.62 2omk s LEU 170 Ca 0.00 -0.43 -0.10 0.00 -1.03 0.00 0.00 54.13 52.56 2omk s LEU 170 Cb 0.00 -1.69 0.10 0.00 0.03 0.00 0.00 46.19 44.64 2omk s LEU 170 CO 0.00 0.20 1.74 0.15 0.23 0.00 0.00 176.35 178.67 2omk h PHE 171 N 3.86 1.01 -3.38 0.29 3.57 -0.84 -3.43 116.94 118.03 2omk h PHE 171 Ca -0.49 -0.08 -0.68 0.00 3.53 0.00 0.00 57.97 60.26 2omk h PHE 171 Cb 1.17 -0.30 -0.15 0.00 2.79 0.00 0.00 35.95 39.45 2omk h PHE 171 CO 0.59 0.79 -0.64 0.71 -2.23 0.00 0.00 178.31 177.53 2omk s TYR 172 N -5.54 3.10 0.73 0.41 1.51 -1.26 -5.03 117.35 111.27 2omk s TYR 172 Ca -0.13 0.13 -0.12 0.00 -1.01 0.00 0.00 57.07 55.95 2omk s TYR 172 Cb 0.14 -1.74 0.03 0.00 -0.11 0.00 0.00 41.96 40.29 2omk s TYR 172 CO 0.81 0.45 1.09 -1.25 -1.11 0.00 0.00 175.55 175.54 2omk s PRO 173 N -1.11 2.50 0.27 -1.71 0.04 -1.26 -4.98 135.00 128.75 2omk s PRO 173 Ca 0.15 1.21 0.06 0.00 0.04 0.00 0.00 61.00 62.45 2omk s PRO 173 Cb -0.11 -1.92 -0.02 0.00 0.04 0.00 0.00 34.50 32.48 2omk s PRO 173 CO 0.05 -1.46 0.39 -0.51 0.04 0.00 0.00 177.00 175.50 2omk s LEU 174 N -5.57 4.19 0.34 -3.56 1.43 -1.26 -5.05 118.68 109.20 2omk s LEU 174 Ca 0.62 -0.03 0.01 0.00 -1.03 0.00 0.00 54.13 53.71 2omk s LEU 174 Cb -0.18 -2.80 -0.01 0.00 0.03 0.00 0.00 46.19 43.23 2omk s LEU 174 CO 0.52 -0.18 0.41 -0.94 0.23 0.00 0.00 176.35 176.38 2omk s SER 175 N -4.03 1.19 -1.26 2.29 1.04 -1.26 -4.70 113.70 106.97 2omk s SER 175 Ca 0.37 -1.59 -0.17 0.00 0.48 0.00 0.00 55.95 55.04 2omk s SER 175 Cb -0.09 0.63 0.09 0.00 0.10 0.00 0.00 66.02 66.74 2omk s SER 175 CO 0.29 -1.22 1.66 -1.81 0.98 0.00 0.00 173.24 173.15 2omk s ASP 176 N -3.29 6.86 0.51 7.02 1.01 -1.26 -4.69 116.67 122.83 2omk s ASP 176 Ca 0.34 -2.50 -0.21 0.00 0.71 0.00 0.00 52.55 50.89 2omk s ASP 176 Cb 0.01 -2.54 -0.08 0.00 1.01 0.00 0.00 42.92 41.31 2omk s ASP 176 CO 0.23 -1.11 0.95 0.49 0.21 0.00 0.00 175.17 175.94 2omk n PHE 177 N 7.89 0.87 0.00 4.23 0.99 -1.26 -4.96 117.46 125.22 2omk n PHE 177 Ca 0.46 0.49 0.00 0.00 -0.00 0.00 0.00 57.45 58.40 2omk n PHE 177 Cb 0.46 -2.17 0.00 0.00 -1.00 0.00 0.00 39.48 36.77 2omk n PHE 177 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.76 177.01 2omk n THR 178 N -1.10 0.00 -4.16 4.37 -2.24 -1.26 -4.71 114.28 105.18 2omk n THR 178 Ca 0.11 0.00 -0.17 0.00 -2.27 0.00 0.00 64.05 61.72 2omk n THR 178 Cb 0.43 0.16 -0.12 0.00 -2.10 0.00 0.00 70.33 68.70 2omk n THR 178 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 2omk s ASN 179 N -1.23 1.55 0.35 3.42 2.47 -1.26 -5.08 114.94 115.16 2omk s ASN 179 Ca 0.00 -0.61 0.04 0.00 0.42 0.00 0.00 52.86 52.70 2omk s ASN 179 Cb 0.00 -0.04 0.66 0.00 -1.45 0.00 0.00 41.25 40.42 2omk s ASN 179 CO 0.00 -0.10 1.97 -0.50 -3.72 0.00 0.00 177.10 174.75 2omk h TRP 180 N 4.30 0.67 0.00 0.43 6.55 -1.96 -2.11 115.95 123.82 2omk h TRP 180 Ca -0.40 -0.01 -0.02 0.00 0.95 0.00 0.00 58.89 59.41 2omk h TRP 180 Cb 1.19 -0.21 -0.00 0.00 -0.86 0.00 0.00 29.16 29.28 2omk h TRP 180 CO 0.63 0.49 -0.09 0.11 -1.05 0.00 0.00 178.44 178.53 2omk h TRP 181 N 0.69 0.00 -0.78 0.49 5.08 -1.98 -3.33 115.95 116.12 2omk h TRP 181 Ca 0.17 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.14 2omk h TRP 181 Cb 0.06 0.00 -0.04 0.00 -3.00 0.00 0.00 29.16 26.18 2omk h TRP 181 CO 0.00 0.09 0.50 1.96 -1.28 0.00 0.00 178.44 179.71 2omk h GLN 182 N 0.00 1.05 -0.51 0.12 4.20 -1.72 -2.52 115.11 115.72 2omk h GLN 182 Ca -0.00 -0.08 0.00 0.00 0.06 0.00 0.00 58.65 58.63 2omk h GLN 182 Cb 0.31 -0.23 0.00 0.00 0.30 0.00 0.00 27.48 27.87 2omk h GLN 182 CO 0.01 0.72 0.00 0.41 -0.67 0.00 0.00 178.83 179.30 2omk n GLY 183 N -1.25 1.86 3.85 3.46 0.00 -1.25 -4.98 105.19 106.88 2omk n GLY 183 Ca 0.08 -0.72 -0.32 0.00 0.00 0.00 0.00 46.02 45.06 2omk n GLY 183 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2omk s THR 184 N -1.32 4.58 -1.02 2.61 -4.23 -0.95 -1.08 115.64 114.22 2omk s THR 184 Ca 0.42 1.11 -0.04 0.00 -1.18 0.00 0.00 61.69 62.00 2omk s THR 184 Cb 0.23 -3.72 0.00 0.00 1.34 0.00 0.00 72.50 70.36 2omk s THR 184 CO 0.31 -0.64 0.53 0.18 -0.54 0.00 0.00 174.62 174.46 2omk n LEU 185 N -1.47 -2.50 0.00 4.79 4.77 -1.23 -4.92 117.00 116.44 2omk n LEU 185 Ca 0.06 -0.24 -0.27 0.00 -0.03 0.00 0.00 56.01 55.52 2omk n LEU 185 Cb 0.54 -2.20 0.20 0.00 -2.33 0.00 0.00 43.42 39.63 2omk n LEU 185 CO 0.46 0.24 0.78 -3.20 -1.33 0.00 0.00 177.39 174.34 2omk n ASN 186 N -1.27 -0.24 -3.71 -1.43 2.85 0.45 -4.88 115.26 107.03 2omk n ASN 186 Ca -0.05 -1.40 -0.12 0.00 -0.11 0.00 0.00 54.58 52.90 2omk n ASN 186 Cb 0.57 -0.94 -0.11 0.00 1.24 0.00 0.00 39.78 40.54 2omk n ASN 186 CO 0.00 0.00 0.00 -0.70 -2.11 0.00 0.00 177.26 174.45 2omk s GLU 187 N -5.64 0.42 0.27 1.20 2.12 -1.26 -1.12 118.70 114.69 2omk s GLU 187 Ca 0.69 0.68 -0.29 0.00 0.36 0.00 0.00 54.97 56.41 2omk s GLU 187 Cb -0.03 0.08 -0.09 0.00 0.26 0.00 0.00 34.13 34.35 2omk s GLU 187 CO 0.49 -0.11 1.22 0.00 -0.54 0.00 0.00 175.26 176.31 2omk s ALA 188 N 0.89 3.46 -1.49 6.30 0.00 0.25 -0.11 121.76 131.06 2omk s ALA 188 Ca -0.05 1.05 0.15 0.00 0.00 0.00 0.00 51.96 53.11 2omk s ALA 188 Cb -0.06 -3.41 0.02 0.00 0.00 0.00 0.00 23.12 19.66 2omk s ALA 188 CO -0.07 -0.41 0.85 0.44 0.00 0.00 0.00 175.76 176.57 2omk n ILE 189 N 1.55 0.00 -3.13 0.00 -5.35 -0.40 -0.38 119.36 111.66 2omk n ILE 189 Ca 0.01 -0.37 0.00 0.00 -0.27 0.00 0.00 62.75 62.12 2omk n ILE 189 Cb 0.43 1.21 0.00 0.00 -1.74 0.00 0.00 39.64 39.54 2omk n ILE 189 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2omk n ALA 190 N 0.04 0.00 1.26 -1.28 0.00 -1.26 -4.72 120.51 114.55 2omk n ALA 190 Ca 0.07 0.00 0.13 0.00 0.00 0.00 0.00 53.44 53.64 2omk n ALA 190 Cb 0.33 0.00 0.42 0.00 0.00 0.00 0.00 19.45 20.21 2omk n ALA 190 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2omk n ASP 191 N -0.94 0.86 -3.66 0.00 8.00 -1.26 -2.59 116.55 116.96 2omk n ASP 191 Ca 0.00 -0.76 -0.15 0.00 0.71 0.00 0.00 54.79 54.59 2omk n ASP 191 Cb 0.00 0.09 -0.08 0.00 -0.02 0.00 0.00 41.12 41.11 2omk n ASP 191 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 2omk s GLU 192 N -2.53 0.77 0.06 -1.24 2.12 -1.26 -1.19 118.70 115.42 2omk s GLU 192 Ca 0.24 0.36 0.03 0.00 0.36 0.00 0.00 54.97 55.96 2omk s GLU 192 Cb 0.19 0.36 -0.03 0.00 0.26 0.00 0.00 34.13 34.92 2omk s GLU 192 CO 0.52 -0.18 -0.09 -0.59 -0.54 0.00 0.00 175.26 174.38 2omk s PHE 193 N -0.57 0.81 -0.06 5.30 -0.12 -0.37 -4.60 117.98 118.36 2omk s PHE 193 Ca -0.07 -0.54 0.03 0.00 -0.05 0.00 0.00 56.93 56.30 2omk s PHE 193 Cb -0.03 -0.47 0.01 0.00 -0.63 0.00 0.00 43.02 41.90 2omk s PHE 193 CO 0.04 -0.06 -0.13 0.99 -0.05 0.00 0.00 175.22 176.01 2omk s THR 194 N -1.61 1.19 -0.19 -4.49 2.01 -0.58 -0.03 115.64 111.95 2omk s THR 194 Ca -0.06 -0.54 -0.05 0.00 0.31 0.00 0.00 61.69 61.36 2omk s THR 194 Cb -0.08 -1.07 -0.02 0.00 0.01 0.00 0.00 72.50 71.33 2omk s THR 194 CO 0.00 0.36 -0.01 -0.63 -0.69 0.00 0.00 174.62 173.65 2omk s ILE 195 N 0.47 3.90 -0.12 1.82 1.01 -0.34 -1.53 121.20 126.41 2omk s ILE 195 Ca -0.11 -0.34 -0.03 0.00 0.00 0.00 0.00 60.65 60.16 2omk s ILE 195 Cb -0.14 -2.75 -0.03 0.00 0.01 0.00 0.00 42.46 39.55 2omk s ILE 195 CO 0.03 0.45 0.01 -1.00 0.00 0.00 0.00 174.94 174.43 2omk s HIS 196 N 0.83 3.17 0.02 3.97 3.76 0.11 -1.30 115.29 125.84 2omk s HIS 196 Ca 0.00 0.08 -0.18 0.00 -0.15 0.00 0.00 55.06 54.81 2omk s HIS 196 Cb -0.14 -1.88 0.06 0.00 1.11 0.00 0.00 32.58 31.72 2omk s HIS 196 CO 0.02 0.32 0.84 0.00 -0.85 0.00 0.00 174.74 175.07 2omk s THR 198 N -2.10 1.69 0.00 0.00 2.01 -0.46 -3.65 115.64 113.13 2omk s THR 198 Ca 0.20 -0.74 0.00 0.00 0.31 0.00 0.00 61.69 61.46 2omk s THR 198 Cb -0.01 -1.54 0.00 0.00 0.01 0.00 0.00 72.50 70.96 2omk s THR 198 CO 0.01 0.48 0.00 0.61 -0.69 0.00 0.00 174.62 175.02 2omk n GLY 199 N 4.36 0.18 3.79 4.40 0.00 -1.26 -0.56 105.19 116.10 2omk n GLY 199 Ca -0.19 -2.30 -0.33 0.00 0.00 0.00 0.00 46.02 43.20 2omk n GLY 199 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2omk s GLU 200 N -0.02 3.10 0.31 1.61 2.02 -1.26 -0.92 118.70 123.54 2omk s GLU 200 Ca 0.00 -0.47 -0.18 0.00 0.02 0.00 0.00 54.97 54.34 2omk s GLU 200 Cb 0.00 -2.88 0.03 0.00 0.10 0.00 0.00 34.13 31.37 2omk s GLU 200 CO 0.00 0.65 0.71 1.52 0.02 0.00 0.00 175.26 178.17 2omk s TYR 201 N -1.21 -0.03 -0.04 1.61 -0.85 -0.44 -1.74 117.35 114.65 2omk s TYR 201 Ca 0.23 -0.48 0.01 0.00 -0.52 0.00 0.00 57.07 56.32 2omk s TYR 201 Cb -0.12 0.69 0.02 0.00 0.38 0.00 0.00 41.96 42.92 2omk s TYR 201 CO 0.14 -1.31 -0.06 -1.17 -1.52 0.00 0.00 175.55 171.64 2omk s LEU 202 N -2.98 1.48 -0.13 -3.49 2.96 0.25 -0.75 118.68 116.02 2omk s LEU 202 Ca 0.14 -0.14 -0.01 0.00 -0.22 0.00 0.00 54.13 53.90 2omk s LEU 202 Cb -0.05 -0.47 -0.02 0.00 0.50 0.00 0.00 46.19 46.15 2omk s LEU 202 CO 0.09 -0.02 -0.11 -0.69 -1.32 0.00 0.00 176.35 174.29 2omk s VAL 203 N 0.69 3.21 -0.26 1.68 1.01 -0.44 -0.58 120.40 125.71 2omk s VAL 203 Ca -0.10 -0.61 -0.06 0.00 0.00 0.00 0.00 61.98 61.21 2omk s VAL 203 Cb -0.13 -2.35 -0.01 0.00 0.00 0.00 0.00 36.38 33.89 2omk s VAL 203 CO 0.01 0.52 0.05 0.12 0.00 0.00 0.00 175.10 175.80 2omk s PHE 204 N 0.27 3.07 -0.37 5.22 5.36 0.82 -0.52 117.98 131.83 2omk s PHE 204 Ca -0.08 -0.71 -0.12 0.00 -0.96 0.00 0.00 56.93 55.05 2omk s PHE 204 Cb -0.15 -2.21 0.01 0.00 -0.34 0.00 0.00 43.02 40.33 2omk s PHE 204 CO 0.05 -0.47 0.24 -0.51 -1.46 0.00 0.00 175.22 173.07 2omk s LEU 205 N 1.55 4.73 0.40 6.12 1.43 -0.39 -0.94 118.68 131.57 2omk s LEU 205 Ca 0.05 -0.79 -0.25 0.00 -1.03 0.00 0.00 54.13 52.11 2omk s LEU 205 Cb -0.16 -2.09 -0.08 0.00 0.03 0.00 0.00 46.19 43.89 2omk s LEU 205 CO 0.02 -0.35 1.17 0.00 0.23 0.00 0.00 176.35 177.41 2omk s ALA 206 N 1.64 3.16 -1.36 4.21 0.00 -0.91 -1.54 121.76 126.96 2omk s ALA 206 Ca 0.04 0.96 0.00 0.00 0.00 0.00 0.00 51.96 52.97 2omk s ALA 206 Cb -0.18 -3.38 0.00 0.00 0.00 0.00 0.00 23.12 19.56 2omk s ALA 206 CO 0.08 -0.52 0.34 0.66 0.00 0.00 0.00 175.76 176.33