#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1dnk s LYS 2 N 0.00 3.97 0.01 1.96 2.20 -1.26 -0.16 119.74 126.47 1dnk s LYS 2 Ca 0.00 -0.34 0.08 0.00 -0.36 0.00 0.00 55.97 55.35 1dnk s LYS 2 Cb 0.00 -3.28 -0.02 0.00 -1.51 0.00 0.00 37.83 33.02 1dnk s LYS 2 CO 0.00 0.20 -0.24 0.42 -0.36 0.00 0.00 175.35 175.37 1dnk s ILE 3 N 0.57 1.94 0.02 5.43 1.01 -0.78 -1.47 121.20 127.92 1dnk s ILE 3 Ca 0.04 -1.18 -0.01 0.00 0.00 0.00 0.00 60.65 59.50 1dnk s ILE 3 Cb -0.13 -1.64 -0.02 0.00 0.01 0.00 0.00 42.46 40.69 1dnk s ILE 3 CO 0.01 0.42 -0.01 0.00 0.00 0.00 0.00 174.94 175.36 1dnk s ALA 4 N -0.69 0.05 -0.13 9.38 0.00 -0.96 -1.08 121.76 128.34 1dnk s ALA 4 Ca 0.10 -0.47 0.02 0.00 0.00 0.00 0.00 51.96 51.60 1dnk s ALA 4 Cb -0.09 0.13 -0.00 0.00 0.00 0.00 0.00 23.12 23.15 1dnk s ALA 4 CO 0.01 -0.15 -0.19 0.00 0.00 0.00 0.00 175.76 175.43 1dnk s ALA 5 N -1.31 2.37 -0.10 0.00 0.00 -0.43 -0.35 121.76 121.95 1dnk s ALA 5 Ca -0.14 -1.02 -0.01 0.00 0.00 0.00 0.00 51.96 50.79 1dnk s ALA 5 Cb -0.09 -1.06 0.03 0.00 0.00 0.00 0.00 23.12 21.99 1dnk s ALA 5 CO -0.01 0.09 -0.05 0.12 0.00 0.00 0.00 175.76 175.91 1dnk s PHE 6 N 0.64 1.18 -0.38 0.00 5.36 0.22 -1.70 117.98 123.30 1dnk s PHE 6 Ca -0.10 -0.52 -0.20 0.00 -0.96 0.00 0.00 56.93 55.15 1dnk s PHE 6 Cb -0.16 -1.07 0.01 0.00 -0.34 0.00 0.00 43.02 41.46 1dnk s PHE 6 CO 0.02 -0.44 0.62 1.21 -1.46 0.00 0.00 175.22 175.18 1dnk s ASN 7 N 1.77 6.38 -0.41 6.13 3.84 -1.26 -0.94 114.94 130.45 1dnk s ASN 7 Ca 0.04 -0.00 -0.12 0.00 0.21 0.00 0.00 52.86 52.99 1dnk s ASN 7 Cb -0.13 -2.32 0.04 0.00 -0.55 0.00 0.00 41.25 38.30 1dnk s ASN 7 CO -0.07 -0.63 0.27 -0.63 -2.79 0.00 0.00 177.10 173.25 1dnk s ILE 8 N 2.70 4.76 -0.34 -5.21 1.01 -0.89 -4.48 121.20 118.76 1dnk s ILE 8 Ca 0.23 -0.96 -0.42 0.00 0.00 0.00 0.00 60.65 59.50 1dnk s ILE 8 Cb -0.14 -3.74 -0.17 0.00 0.01 0.00 0.00 42.46 38.42 1dnk s ILE 8 CO 0.16 -0.36 1.67 -1.14 0.00 0.00 0.00 174.94 175.27 1dnk n ARG 9 N 5.05 0.75 -4.08 2.79 0.63 -1.26 -2.20 116.66 118.34 1dnk n ARG 9 Ca -0.11 0.28 -0.38 0.00 -0.92 0.00 0.00 57.85 56.72 1dnk n ARG 9 Cb 0.45 -1.89 -0.02 0.00 0.45 0.00 0.00 32.46 31.45 1dnk n ARG 9 CO 0.00 0.00 0.00 2.41 -2.51 0.00 0.00 177.63 177.53 1dnk n THR 10 N 4.28 -1.84 -1.79 5.15 -1.04 -1.24 -4.86 114.28 112.94 1dnk n THR 10 Ca 0.28 -0.50 -0.42 0.00 -2.04 0.00 0.00 64.05 61.37 1dnk n THR 10 Cb 0.07 -1.61 -0.03 0.00 -1.82 0.00 0.00 70.33 66.94 1dnk n THR 10 CO 0.00 0.00 0.00 0.12 -0.64 0.00 0.00 175.07 174.55 1dnk s PHE 11 N -3.87 2.91 0.00 -1.42 2.19 -0.10 -4.78 117.98 112.91 1dnk s PHE 11 Ca 0.30 0.51 -0.00 0.00 0.33 0.00 0.00 56.93 58.06 1dnk s PHE 11 Cb -0.17 -4.07 0.00 0.00 -1.31 0.00 0.00 43.02 37.47 1dnk s PHE 11 CO 0.88 -3.94 0.02 0.41 1.83 0.00 0.00 175.22 174.41 1dnk n GLY 12 N 3.54 1.31 0.31 13.12 0.00 -1.26 -1.28 105.19 120.93 1dnk n GLY 12 Ca 0.14 -0.93 0.02 0.00 0.00 0.00 0.00 46.02 45.25 1dnk n GLY 12 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1dnk h GLU 13 N 0.00 0.69 -0.04 1.61 5.08 -1.90 -2.17 114.58 117.85 1dnk h GLU 13 Ca -0.00 -0.06 -0.01 0.00 -1.00 0.00 0.00 59.36 58.28 1dnk h GLU 13 Cb 0.02 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.13 1dnk h GLU 13 CO 0.01 0.51 -0.00 1.15 -1.00 0.00 0.00 179.01 179.67 1dnk h THR 14 N 0.70 1.26 -0.38 1.13 2.02 -1.96 -2.23 112.91 113.46 1dnk h THR 14 Ca 0.18 -0.79 -0.04 0.00 0.77 0.00 0.00 66.41 66.52 1dnk h THR 14 Cb 0.01 1.72 -0.01 0.00 -1.74 0.00 0.00 68.15 68.13 1dnk h THR 14 CO -0.03 0.21 0.06 0.50 0.37 0.00 0.00 175.52 176.63 1dnk h LYS 15 N -0.24 0.62 0.00 6.66 3.64 -1.83 -2.93 116.57 122.49 1dnk h LYS 15 Ca 0.01 -0.17 0.00 0.00 -1.27 0.00 0.00 60.65 59.22 1dnk h LYS 15 Cb 0.34 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.09 1dnk h LYS 15 CO 0.00 0.68 0.00 0.52 -2.27 0.00 0.00 179.45 178.39 1dnk h MET 16 N 0.47 0.00 -0.59 1.90 2.86 -1.41 -3.12 114.93 115.05 1dnk h MET 16 Ca 0.11 0.00 -0.08 0.00 -2.06 0.00 0.00 59.70 57.67 1dnk h MET 16 Cb 0.36 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.00 1dnk h MET 16 CO 0.01 0.00 0.03 0.77 1.06 0.00 0.00 176.91 178.78 1dnk h SER 17 N 0.00 0.96 -3.16 1.22 0.02 -1.20 -3.42 113.55 107.98 1dnk h SER 17 Ca 0.00 -0.25 -0.56 0.00 -0.84 0.00 0.00 61.79 60.14 1dnk h SER 17 Cb 0.49 -0.26 -0.08 0.00 0.14 0.00 0.00 62.40 62.70 1dnk h SER 17 CO 0.00 1.00 0.96 0.21 -1.14 0.00 0.00 176.83 177.86 1dnk s ASN 18 N -6.58 6.43 0.62 3.07 3.84 -1.18 -4.90 114.94 116.24 1dnk s ASN 18 Ca -0.11 0.05 0.29 0.00 0.21 0.00 0.00 52.86 53.30 1dnk s ASN 18 Cb 0.14 -2.55 1.54 0.00 -0.55 0.00 0.00 41.25 39.83 1dnk s ASN 18 CO 0.84 -1.48 1.91 0.00 -2.79 0.00 0.00 177.10 175.58 1dnk h ALA 19 N 9.55 1.80 0.08 1.71 0.00 -1.87 0.65 119.26 131.18 1dnk h ALA 19 Ca -0.25 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.65 1dnk h ALA 19 Cb 1.06 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.87 1dnk h ALA 19 CO 1.19 -0.53 -0.04 1.15 0.00 0.00 0.00 179.25 181.02 1dnk h THR 20 N 0.00 0.44 -0.49 0.00 2.02 -1.93 -2.21 112.91 110.73 1dnk h THR 20 Ca 0.11 -1.21 0.06 0.00 0.77 0.00 0.00 66.41 66.15 1dnk h THR 20 Cb 0.92 0.80 -0.05 0.00 -1.74 0.00 0.00 68.15 68.08 1dnk h THR 20 CO -0.00 0.14 0.21 -0.07 0.37 0.00 0.00 175.52 176.16 1dnk h LEU 21 N -1.00 0.25 -1.21 2.58 4.07 -1.58 -1.02 115.31 117.41 1dnk h LEU 21 Ca -0.01 0.05 0.08 0.00 0.08 0.00 0.00 57.88 58.07 1dnk h LEU 21 Cb 0.31 0.01 -0.06 0.00 1.08 0.00 0.00 40.66 42.00 1dnk h LEU 21 CO 0.02 0.18 0.56 0.00 -1.08 0.00 0.00 178.44 178.12 1dnk h ALA 22 N 1.30 1.59 -0.48 1.53 0.00 -1.01 -1.41 119.26 120.78 1dnk h ALA 22 Ca 0.23 -0.02 0.01 0.00 0.00 0.00 0.00 54.91 55.14 1dnk h ALA 22 Cb 0.20 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 1dnk h ALA 22 CO -0.20 0.26 0.30 1.03 0.00 0.00 0.00 179.25 180.64 1dnk h SER 23 N 0.93 0.50 0.36 0.00 0.87 -0.54 -1.36 113.55 114.30 1dnk h SER 23 Ca 0.38 -0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.92 1dnk h SER 23 Cb 0.28 -0.11 0.00 0.00 -0.44 0.00 0.00 62.40 62.13 1dnk h SER 23 CO -0.15 0.36 -0.17 1.88 -0.53 0.00 0.00 176.83 178.22 1dnk h TYR 24 N 0.60 -0.45 -0.62 2.24 0.05 -0.82 -2.35 116.97 115.63 1dnk h TYR 24 Ca 0.19 -0.01 0.12 0.00 0.05 0.00 0.00 58.73 59.08 1dnk h TYR 24 Cb -0.02 0.15 -0.12 0.00 1.01 0.00 0.00 36.73 37.75 1dnk h TYR 24 CO -0.06 -0.12 -0.21 0.82 -1.05 0.00 0.00 178.16 177.55 1dnk h ILE 25 N -0.83 0.30 -0.93 -2.88 2.04 -1.21 0.82 117.51 114.81 1dnk h ILE 25 Ca -0.05 0.00 0.07 0.00 1.00 0.00 0.00 64.86 65.88 1dnk h ILE 25 Cb 0.53 0.30 -0.06 0.00 -0.74 0.00 0.00 36.82 36.85 1dnk h ILE 25 CO 0.08 0.00 0.59 0.58 0.00 0.00 0.00 178.15 179.40 1dnk h VAL 26 N -0.05 1.06 -0.57 1.67 2.07 -1.25 -1.74 116.25 117.45 1dnk h VAL 26 Ca 0.29 -0.37 -0.11 0.00 0.82 0.00 0.00 66.70 67.33 1dnk h VAL 26 Cb 0.50 -0.11 -0.02 0.00 -1.52 0.00 0.00 31.29 30.14 1dnk h VAL 26 CO -0.66 0.20 -0.07 -0.09 0.02 0.00 0.00 177.57 176.96 1dnk h ARG 27 N 1.07 1.05 0.00 1.57 2.43 -0.44 -2.61 114.38 117.45 1dnk h ARG 27 Ca 0.41 -0.37 -0.00 0.00 -0.81 0.00 0.00 59.98 59.20 1dnk h ARG 27 Cb 0.18 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.65 1dnk h ARG 27 CO -0.18 1.07 -0.00 0.82 -1.51 0.00 0.00 179.97 180.17 1dnk h ILE 28 N 0.94 1.24 -0.74 1.20 2.04 -0.18 -3.23 117.51 118.77 1dnk h ILE 28 Ca 0.15 -0.72 0.08 0.00 1.00 0.00 0.00 64.86 65.37 1dnk h ILE 28 Cb 0.64 1.73 -0.05 0.00 -0.74 0.00 0.00 36.82 38.40 1dnk h ILE 28 CO 0.04 0.19 0.49 0.58 0.00 0.00 0.00 178.15 179.45 1dnk h VAL 29 N -0.31 0.99 0.00 1.67 2.07 -1.32 -2.29 116.25 117.05 1dnk h VAL 29 Ca -0.00 -0.25 0.00 0.00 0.82 0.00 0.00 66.70 67.27 1dnk h VAL 29 Cb 0.31 0.20 0.00 0.00 -1.52 0.00 0.00 31.29 30.28 1dnk h VAL 29 CO 0.00 0.13 0.00 0.54 0.02 0.00 0.00 177.57 178.26 1dnk n ARG 30 N -4.49 0.01 0.15 1.57 1.74 -0.99 -1.45 116.66 113.20 1dnk n ARG 30 Ca 0.12 0.27 0.02 0.00 -0.77 0.00 0.00 57.85 57.48 1dnk n ARG 30 Cb 0.27 -1.50 0.16 0.00 -1.02 0.00 0.00 32.46 30.37 1dnk n ARG 30 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1dnk h ARG 31 N 0.00 0.00 -6.20 5.56 3.08 -1.50 -3.46 114.38 111.86 1dnk h ARG 31 Ca 0.00 0.00 -0.53 0.00 0.07 0.00 0.00 59.98 59.52 1dnk h ARG 31 Cb 0.22 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 30.21 1dnk h ARG 31 CO 0.00 0.55 -0.54 0.71 -1.07 0.00 0.00 179.97 179.62 1dnk s TYR 32 N -3.31 3.12 -0.11 3.04 2.02 -0.53 -4.89 117.35 116.69 1dnk s TYR 32 Ca 0.01 -0.08 0.12 0.00 -0.37 0.00 0.00 57.07 56.75 1dnk s TYR 32 Cb 0.10 -1.44 -0.24 0.00 -0.40 0.00 0.00 41.96 39.99 1dnk s TYR 32 CO 0.74 0.52 0.42 -0.25 -1.57 0.00 0.00 175.55 175.41 1dnk n ASP 33 N -0.84 0.77 -3.74 2.29 8.00 -0.54 -4.81 116.55 117.67 1dnk n ASP 33 Ca -0.08 0.25 -0.13 0.00 0.71 0.00 0.00 54.79 55.54 1dnk n ASP 33 Cb 0.57 0.17 -0.14 0.00 -0.02 0.00 0.00 41.12 41.69 1dnk n ASP 33 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 1dnk s ILE 34 N -2.56 -0.05 -0.02 0.53 1.01 -1.14 -1.58 121.20 117.40 1dnk s ILE 34 Ca -0.09 0.17 0.00 0.00 0.00 0.00 0.00 60.65 60.73 1dnk s ILE 34 Cb 0.07 -0.29 0.02 0.00 0.01 0.00 0.00 42.46 42.28 1dnk s ILE 34 CO 0.81 0.07 0.01 0.54 0.00 0.00 0.00 174.94 176.37 1dnk s VAL 35 N 1.18 0.07 -0.20 2.92 0.11 -0.55 -2.25 120.40 121.68 1dnk s VAL 35 Ca -0.09 0.12 -0.17 0.00 -2.93 0.00 0.00 61.98 58.91 1dnk s VAL 35 Cb -0.11 -0.17 -0.04 0.00 -1.53 0.00 0.00 36.38 34.54 1dnk s VAL 35 CO -0.07 0.10 0.44 -0.22 -3.33 0.00 0.00 175.10 172.02 1dnk s LEU 36 N 0.87 4.15 -0.12 2.54 2.96 0.53 -1.28 118.68 128.33 1dnk s LEU 36 Ca -0.08 0.56 -0.02 0.00 -0.22 0.00 0.00 54.13 54.37 1dnk s LEU 36 Cb -0.11 -2.57 -0.03 0.00 0.50 0.00 0.00 46.19 43.97 1dnk s LEU 36 CO -0.02 -0.11 -0.03 -0.63 -1.32 0.00 0.00 176.35 174.23 1dnk s ILE 37 N 1.43 3.96 0.29 6.68 1.09 0.16 0.73 121.20 135.53 1dnk s ILE 37 Ca 0.21 -0.35 0.11 0.00 -1.10 0.00 0.00 60.65 59.52 1dnk s ILE 37 Cb -0.15 -2.70 -0.05 0.00 -1.06 0.00 0.00 42.46 38.50 1dnk s ILE 37 CO 0.09 0.54 -0.18 -1.10 -0.10 0.00 0.00 174.94 174.18 1dnk s GLN 38 N -0.15 1.69 -0.55 2.79 -0.21 -0.11 -1.64 119.66 121.48 1dnk s GLN 38 Ca 0.03 -1.79 -0.02 0.00 0.02 0.00 0.00 55.36 53.60 1dnk s GLN 38 Cb -0.13 -1.73 0.00 0.00 1.00 0.00 0.00 33.01 32.15 1dnk s GLN 38 CO 0.02 0.29 0.47 -1.91 -2.12 0.00 0.00 175.29 172.05 1dnk n GLU 39 N -0.64 -3.18 -2.94 2.91 2.13 -1.25 -2.09 120.64 115.57 1dnk n GLU 39 Ca -0.05 0.36 -0.43 0.00 0.66 0.00 0.00 57.16 57.69 1dnk n GLU 39 Cb 0.61 -3.94 -0.04 0.00 0.27 0.00 0.00 31.44 28.33 1dnk n GLU 39 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 1dnk s VAL 40 N -3.14 4.50 -0.96 6.31 1.01 -1.24 -0.92 120.40 125.95 1dnk s VAL 40 Ca 0.15 -0.49 -0.03 0.00 0.00 0.00 0.00 61.98 61.61 1dnk s VAL 40 Cb -0.07 -4.60 0.24 0.00 0.00 0.00 0.00 36.38 31.96 1dnk s VAL 40 CO 0.31 -1.30 0.93 0.54 0.00 0.00 0.00 175.10 175.58 1dnk n ARG 41 N 7.22 3.02 -3.52 2.72 1.74 -0.40 -1.60 116.66 125.84 1dnk n ARG 41 Ca -0.05 -4.49 -0.28 0.00 -0.77 0.00 0.00 57.85 52.26 1dnk n ARG 41 Cb 0.45 -2.45 -0.11 0.00 -1.02 0.00 0.00 32.46 29.33 1dnk n ARG 41 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1dnk s ASP 42 N -0.06 2.62 0.19 0.55 2.15 -1.26 -4.48 116.67 116.38 1dnk s ASP 42 Ca 0.29 -2.80 -0.16 0.00 0.43 0.00 0.00 52.55 50.31 1dnk s ASP 42 Cb -0.06 -0.65 0.16 0.00 -0.30 0.00 0.00 42.92 42.08 1dnk s ASP 42 CO -0.09 -0.22 1.63 0.28 -0.17 0.00 0.00 175.17 176.60 1dnk h SER 43 N 6.23 -0.64 -0.54 -0.34 0.02 -1.96 -2.88 113.55 113.45 1dnk h SER 43 Ca 0.14 0.17 0.00 0.00 -0.84 0.00 0.00 61.79 61.27 1dnk h SER 43 Cb 0.92 0.38 0.00 0.00 0.14 0.00 0.00 62.40 63.84 1dnk h SER 43 CO 0.39 -0.22 0.00 1.41 -1.14 0.00 0.00 176.83 177.28 1dnk n HIS 44 N -5.40 1.50 -1.75 3.45 8.25 -1.26 -4.94 115.22 115.06 1dnk n HIS 44 Ca 0.05 -0.56 -0.10 0.00 -0.26 0.00 0.00 57.72 56.85 1dnk n HIS 44 Cb 0.30 -0.31 -0.03 0.00 1.12 0.00 0.00 29.99 31.07 1dnk n HIS 44 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 1dnk n LEU 45 N 0.79 -0.81 -0.08 2.41 4.32 -1.09 -4.81 117.00 117.73 1dnk n LEU 45 Ca 0.23 0.25 -0.13 0.00 -0.02 0.00 0.00 56.01 56.34 1dnk n LEU 45 Cb 0.90 -1.75 -0.05 0.00 -1.62 0.00 0.00 43.42 40.90 1dnk n LEU 45 CO 0.24 -0.36 0.59 0.58 -1.22 0.00 0.00 177.39 177.23 1dnk h VAL 46 N 0.00 1.32 -0.26 4.08 2.07 -1.92 -1.35 116.25 120.18 1dnk h VAL 46 Ca -0.22 -1.37 -0.11 0.00 0.82 0.00 0.00 66.70 65.83 1dnk h VAL 46 Cb 0.86 1.67 -0.00 0.00 -1.52 0.00 0.00 31.29 32.30 1dnk h VAL 46 CO 0.29 0.42 -0.26 0.00 0.02 0.00 0.00 177.57 178.05 1dnk h ALA 47 N 0.68 0.39 -0.92 1.67 0.00 -1.87 -2.08 119.26 117.13 1dnk h ALA 47 Ca 0.04 -0.39 0.05 0.00 0.00 0.00 0.00 54.91 54.62 1dnk h ALA 47 Cb 0.76 -0.08 -0.06 0.00 0.00 0.00 0.00 17.79 18.41 1dnk h ALA 47 CO 0.05 0.37 0.60 0.28 0.00 0.00 0.00 179.25 180.56 1dnk h VAL 48 N 0.37 1.10 -0.06 0.00 2.07 -1.93 -1.08 116.25 116.72 1dnk h VAL 48 Ca 0.04 -0.38 -0.01 0.00 0.82 0.00 0.00 66.70 67.18 1dnk h VAL 48 Cb 0.82 -0.09 -0.00 0.00 -1.52 0.00 0.00 31.29 30.50 1dnk h VAL 48 CO 0.06 0.20 0.01 1.23 0.02 0.00 0.00 177.57 179.10 1dnk h GLY 49 N 1.09 0.11 0.05 2.17 0.00 -1.13 -1.70 103.07 103.67 1dnk h GLY 49 Ca 0.38 -0.07 0.08 0.00 0.00 0.00 0.00 47.33 47.72 1dnk h GLY 49 CO -0.13 0.07 -0.19 0.50 0.00 0.00 0.00 176.54 176.78 1dnk h LYS 50 N -0.12 -0.11 -0.29 4.80 1.57 -0.52 0.61 116.57 122.51 1dnk h LYS 50 Ca 0.02 0.01 0.07 0.00 -1.87 0.00 0.00 60.65 58.87 1dnk h LYS 50 Cb 0.26 0.03 -0.07 0.00 0.08 0.00 0.00 32.23 32.52 1dnk h LYS 50 CO 0.00 -0.08 -0.18 1.25 -0.57 0.00 0.00 179.45 179.87 1dnk h LEU 51 N -0.12 -0.61 -1.63 2.94 5.85 -1.11 -0.73 115.31 119.90 1dnk h LEU 51 Ca 0.19 0.13 -0.04 0.00 0.84 0.00 0.00 57.88 59.00 1dnk h LEU 51 Cb 0.41 0.31 -0.01 0.00 0.37 0.00 0.00 40.66 41.75 1dnk h LEU 51 CO -0.46 -0.22 -0.19 -0.07 -0.34 0.00 0.00 178.44 177.16 1dnk h LEU 52 N -0.16 0.00 -0.57 2.25 3.38 -0.66 -1.23 115.31 118.32 1dnk h LEU 52 Ca 0.15 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.06 1dnk h LEU 52 Cb 0.39 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.12 1dnk h LEU 52 CO -0.38 0.19 0.10 0.44 0.09 0.00 0.00 178.44 178.88 1dnk h ASP 53 N 0.00 0.91 -0.04 -0.43 3.32 0.59 -0.89 116.42 119.87 1dnk h ASP 53 Ca -0.00 -0.26 -0.01 0.00 0.02 0.00 0.00 57.03 56.78 1dnk h ASP 53 Cb 0.34 -0.24 -0.00 0.00 0.22 0.00 0.00 39.33 39.65 1dnk h ASP 53 CO 0.02 0.93 -0.01 1.88 -1.72 0.00 0.00 179.24 180.35 1dnk h TYR 54 N 0.84 0.08 -0.78 4.55 0.05 -0.71 -2.20 116.97 118.80 1dnk h TYR 54 Ca 0.17 -0.02 0.03 0.00 0.05 0.00 0.00 58.73 58.97 1dnk h TYR 54 Cb 0.41 -0.02 -0.04 0.00 1.01 0.00 0.00 36.73 38.08 1dnk h TYR 54 CO 0.03 0.42 0.51 -0.07 -1.05 0.00 0.00 178.16 178.00 1dnk h LEU 55 N -0.28 0.82 -3.60 3.88 3.38 -1.19 -2.83 115.31 115.49 1dnk h LEU 55 Ca 0.01 -0.01 -0.22 0.00 0.09 0.00 0.00 57.88 57.75 1dnk h LEU 55 Cb 0.39 -0.19 -0.13 0.00 0.09 0.00 0.00 40.66 40.82 1dnk h LEU 55 CO 0.00 0.57 0.20 0.59 0.09 0.00 0.00 178.44 179.89 1dnk n ASN 56 N -4.45 3.92 0.13 -0.43 3.02 -0.35 -4.58 115.26 112.52 1dnk n ASN 56 Ca 0.10 -3.39 -0.02 0.00 -0.03 0.00 0.00 54.58 51.25 1dnk n ASN 56 Cb 0.12 -0.70 0.19 0.00 -0.61 0.00 0.00 39.78 38.78 1dnk n ASN 56 CO 0.00 0.00 0.00 0.06 -2.62 0.00 0.00 177.26 174.70 1dnk h GLN 57 N 1.84 0.08 0.00 3.52 3.07 -1.13 -3.14 115.11 119.34 1dnk h GLN 57 Ca 0.27 -0.05 0.00 0.00 0.09 0.00 0.00 58.65 58.96 1dnk h GLN 57 Cb 2.11 0.01 0.00 0.00 0.08 0.00 0.00 27.48 29.67 1dnk h GLN 57 CO 0.62 0.62 -0.78 -0.44 0.09 0.00 0.00 178.83 178.95 1dnk h ASP 58 N 0.06 0.00 -2.74 0.06 3.32 -1.83 -3.46 116.42 111.83 1dnk h ASP 58 Ca -0.00 -0.07 0.11 0.00 0.02 0.00 0.00 57.03 57.08 1dnk h ASP 58 Cb 1.02 0.00 -0.28 0.00 0.22 0.00 0.00 39.33 40.29 1dnk h ASP 58 CO 0.08 0.04 0.49 -0.62 -1.72 0.00 0.00 179.24 177.50 1dnk s ASP 59 N -5.08 -0.41 0.00 6.45 -1.08 -1.19 -5.05 116.67 110.31 1dnk s ASP 59 Ca 0.02 0.72 0.25 0.00 -0.52 0.00 0.00 52.55 53.02 1dnk s ASP 59 Cb 0.10 0.94 1.36 0.00 -1.46 0.00 0.00 42.92 43.86 1dnk s ASP 59 CO 0.76 -0.12 1.85 -0.81 0.52 0.00 0.00 175.17 177.37 1dnk n PRO 60 N 2.81 0.53 -2.08 4.34 -0.04 -1.24 -3.38 135.00 135.94 1dnk n PRO 60 Ca -0.15 0.03 -0.12 0.00 -0.04 0.00 0.00 63.50 63.22 1dnk n PRO 60 Cb 0.57 -1.50 0.05 0.00 -0.04 0.00 0.00 33.50 32.58 1dnk n PRO 60 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1dnk n ASN 61 N -1.17 3.34 0.09 3.54 3.02 -1.26 -4.65 115.26 118.16 1dnk n ASN 61 Ca 0.15 -3.14 -0.23 0.00 -0.03 0.00 0.00 54.58 51.32 1dnk n ASN 61 Cb 0.15 -0.40 -0.15 0.00 -0.61 0.00 0.00 39.78 38.77 1dnk n ASN 61 CO 0.00 0.00 0.00 0.74 -2.62 0.00 0.00 177.26 175.38 1dnk h THR 62 N 3.37 1.21 -3.61 3.41 2.02 -1.87 -3.42 112.91 114.02 1dnk h THR 62 Ca 0.14 -2.57 -0.28 0.00 0.77 0.00 0.00 66.41 64.47 1dnk h THR 62 Cb 1.42 2.96 -0.32 0.00 -1.74 0.00 0.00 68.15 70.48 1dnk h THR 62 CO 0.46 0.79 -0.73 -0.31 0.37 0.00 0.00 175.52 176.10 1dnk s TYR 63 N -2.54 0.06 0.39 3.16 1.51 -1.26 -3.99 117.35 114.68 1dnk s TYR 63 Ca -0.13 0.06 0.08 0.00 -1.01 0.00 0.00 57.07 56.07 1dnk s TYR 63 Cb 0.04 -0.17 -0.05 0.00 -0.11 0.00 0.00 41.96 41.67 1dnk s TYR 63 CO 0.87 -0.06 0.16 -1.01 -1.11 0.00 0.00 175.55 174.41 1dnk s HIS 64 N 0.65 2.62 0.18 2.71 3.76 0.25 -4.89 115.29 120.57 1dnk s HIS 64 Ca -0.06 -0.53 -0.07 0.00 -0.15 0.00 0.00 55.06 54.26 1dnk s HIS 64 Cb -0.08 -1.86 -0.02 0.00 1.11 0.00 0.00 32.58 31.73 1dnk s HIS 64 CO -0.02 0.23 0.24 1.52 -0.85 0.00 0.00 174.74 175.87 1dnk s TYR 65 N -2.55 0.60 -0.03 1.40 1.13 -1.26 -0.23 117.35 116.41 1dnk s TYR 65 Ca 0.40 -0.95 0.02 0.00 -1.41 0.00 0.00 57.07 55.13 1dnk s TYR 65 Cb 0.02 -0.18 0.01 0.00 -1.10 0.00 0.00 41.96 40.71 1dnk s TYR 65 CO 0.22 -0.71 -0.06 0.08 -2.51 0.00 0.00 175.55 172.58 1dnk s VAL 66 N -4.02 0.57 0.04 -3.49 1.01 0.34 -4.99 120.40 109.85 1dnk s VAL 66 Ca 0.23 -0.22 0.03 0.00 0.00 0.00 0.00 61.98 62.01 1dnk s VAL 66 Cb 0.04 -0.53 -0.02 0.00 0.00 0.00 0.00 36.38 35.86 1dnk s VAL 66 CO 0.04 0.20 -0.08 0.54 0.00 0.00 0.00 175.10 175.79 1dnk s VAL 67 N 0.39 0.60 0.41 2.92 0.11 -1.26 0.01 120.40 123.59 1dnk s VAL 67 Ca -0.05 -1.06 0.08 0.00 -2.93 0.00 0.00 61.98 58.01 1dnk s VAL 67 Cb -0.09 -0.65 -0.00 0.00 -1.53 0.00 0.00 36.38 34.10 1dnk s VAL 67 CO 0.00 -0.34 0.49 -0.94 -3.33 0.00 0.00 175.10 170.98 1dnk s SER 68 N -1.52 5.48 1.00 3.54 1.04 -0.51 -4.99 113.70 117.73 1dnk s SER 68 Ca -0.08 -0.51 -0.12 0.00 0.48 0.00 0.00 55.95 55.71 1dnk s SER 68 Cb -0.10 -0.69 0.19 0.00 0.10 0.00 0.00 66.02 65.52 1dnk s SER 68 CO 0.01 -0.68 1.10 -1.61 0.98 0.00 0.00 173.24 173.03 1dnk s GLU 69 N -4.25 0.40 0.07 4.02 0.41 -1.26 -4.47 118.70 113.62 1dnk s GLU 69 Ca 0.51 0.47 -0.31 0.00 -0.41 0.00 0.00 54.97 55.24 1dnk s GLU 69 Cb -0.08 -1.74 -0.08 0.00 -1.78 0.00 0.00 34.13 30.46 1dnk s GLU 69 CO 0.31 -2.74 1.57 -2.14 -0.49 0.00 0.00 175.26 171.77 1dnk s PRO 70 N -4.99 4.23 -0.09 0.39 0.02 -1.26 -4.50 135.00 128.80 1dnk s PRO 70 Ca 0.65 2.24 -0.00 0.00 0.02 0.00 0.00 61.00 63.91 1dnk s PRO 70 Cb -0.18 -3.50 -0.03 0.00 0.02 0.00 0.00 34.50 30.81 1dnk s PRO 70 CO 0.57 -0.66 -0.06 -0.51 -0.33 0.00 0.00 177.00 176.01 1dnk s LEU 71 N 2.24 3.18 0.00 -5.54 1.43 0.32 -4.82 118.68 115.50 1dnk s LEU 71 Ca 0.71 -0.05 0.00 0.00 -1.03 0.00 0.00 54.13 53.76 1dnk s LEU 71 Cb -0.38 -1.71 0.00 0.00 0.03 0.00 0.00 46.19 44.13 1dnk s LEU 71 CO 0.31 0.32 0.00 0.61 0.23 0.00 0.00 176.35 177.82 1dnk n GLY 72 N 2.52 2.75 0.13 -3.19 0.00 -1.24 -1.73 105.19 104.44 1dnk n GLY 72 Ca -0.18 -0.52 -0.17 0.00 0.00 0.00 0.00 46.02 45.15 1dnk n GLY 72 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1dnk h ARG 73 N 0.00 0.37 0.00 1.61 3.08 -1.76 -3.48 114.38 114.19 1dnk h ARG 73 Ca 0.00 -0.54 0.00 0.00 0.07 0.00 0.00 59.98 59.51 1dnk h ARG 73 Cb 0.00 0.19 0.00 0.00 0.08 0.00 0.00 29.97 30.24 1dnk h ARG 73 CO 0.00 1.22 0.00 0.09 -1.07 0.00 0.00 179.97 180.21 1dnk n ASN 74 N -3.63 0.00 -0.17 7.04 3.02 -1.26 -5.03 115.26 115.22 1dnk n ASN 74 Ca -0.09 0.00 -0.02 0.00 -0.03 0.00 0.00 54.58 54.44 1dnk n ASN 74 Cb 0.98 0.00 0.21 0.00 -0.61 0.00 0.00 39.78 40.35 1dnk n ASN 74 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 1dnk h SER 75 N 0.00 0.83 -2.89 6.41 4.64 -2.02 -3.42 113.55 117.09 1dnk h SER 75 Ca 0.00 -0.10 -0.53 0.00 -0.47 0.00 0.00 61.79 60.70 1dnk h SER 75 Cb 0.00 -0.21 0.03 0.00 -0.31 0.00 0.00 62.40 61.90 1dnk h SER 75 CO 0.00 0.72 0.82 -0.47 -0.87 0.00 0.00 176.83 177.03 1dnk s TYR 76 N -5.48 3.04 -0.01 4.77 5.04 -1.26 -5.01 117.35 118.44 1dnk s TYR 76 Ca -0.10 0.75 -0.03 0.00 -2.44 0.00 0.00 57.07 55.25 1dnk s TYR 76 Cb 0.16 -3.80 -0.00 0.00 0.35 0.00 0.00 41.96 38.68 1dnk s TYR 76 CO 0.80 -2.92 0.06 0.15 -1.34 0.00 0.00 175.55 172.30 1dnk s LYS 77 N 1.43 0.22 0.03 4.97 -0.14 -1.26 -4.36 119.74 120.62 1dnk s LYS 77 Ca 0.67 -0.16 0.01 0.00 -1.36 0.00 0.00 55.97 55.13 1dnk s LYS 77 Cb -0.39 0.09 -0.02 0.00 -1.68 0.00 0.00 37.83 35.83 1dnk s LYS 77 CO 0.30 -0.04 -0.05 -1.21 -0.76 0.00 0.00 175.35 173.60 1dnk s GLU 78 N -0.59 0.39 0.24 1.68 2.02 -0.70 -4.61 118.70 117.13 1dnk s GLU 78 Ca -0.07 -0.67 0.09 0.00 0.02 0.00 0.00 54.97 54.34 1dnk s GLU 78 Cb -0.04 -0.02 -0.04 0.00 0.10 0.00 0.00 34.13 34.12 1dnk s GLU 78 CO 0.00 -0.02 0.01 1.03 0.02 0.00 0.00 175.26 176.31 1dnk s ARG 79 N -1.55 2.37 -0.20 1.61 0.52 -0.63 0.12 118.95 121.19 1dnk s ARG 79 Ca -0.13 -1.30 -0.04 0.00 -0.52 0.00 0.00 55.73 53.74 1dnk s ARG 79 Cb -0.10 -2.25 -0.01 0.00 0.52 0.00 0.00 34.95 33.11 1dnk s ARG 79 CO -0.01 0.39 -0.04 0.71 0.02 0.00 0.00 175.30 176.37 1dnk s TYR 80 N -2.13 2.96 -0.19 -0.53 2.02 -1.26 -3.66 117.35 114.55 1dnk s TYR 80 Ca 0.30 -0.73 -0.01 0.00 -0.37 0.00 0.00 57.07 56.27 1dnk s TYR 80 Cb -0.07 -2.05 0.01 0.00 -0.40 0.00 0.00 41.96 39.44 1dnk s TYR 80 CO 0.20 -0.39 -0.14 -1.17 -1.57 0.00 0.00 175.55 172.48 1dnk s LEU 81 N 1.12 2.42 -0.35 -1.29 2.96 -0.65 -1.43 118.68 121.47 1dnk s LEU 81 Ca 0.02 -0.55 -0.10 0.00 -0.22 0.00 0.00 54.13 53.27 1dnk s LEU 81 Cb -0.15 -1.58 0.01 0.00 0.50 0.00 0.00 46.19 44.98 1dnk s LEU 81 CO -0.00 -0.00 0.18 -0.36 -1.32 0.00 0.00 176.35 174.85 1dnk s PHE 82 N 1.33 3.22 -0.09 5.38 0.40 0.10 0.37 117.98 128.68 1dnk s PHE 82 Ca 0.05 -0.81 -0.06 0.00 -0.60 0.00 0.00 56.93 55.50 1dnk s PHE 82 Cb -0.14 -2.40 -0.04 0.00 0.51 0.00 0.00 43.02 40.95 1dnk s PHE 82 CO -0.09 -0.57 0.15 -0.51 0.70 0.00 0.00 175.22 174.90 1dnk s LEU 83 N 1.58 4.37 -0.02 -0.37 1.43 -0.40 -0.51 118.68 124.75 1dnk s LEU 83 Ca 0.03 0.43 -0.24 0.00 -1.03 0.00 0.00 54.13 53.32 1dnk s LEU 83 Cb -0.18 -2.20 0.05 0.00 0.03 0.00 0.00 46.19 43.88 1dnk s LEU 83 CO 0.06 0.37 0.53 0.72 0.23 0.00 0.00 176.35 178.27 1dnk s PHE 84 N -1.10 -0.46 -0.79 0.29 -0.12 0.67 -1.48 117.98 114.99 1dnk s PHE 84 Ca 0.18 0.74 -0.22 0.00 -0.05 0.00 0.00 56.93 57.58 1dnk s PHE 84 Cb -0.12 0.30 0.08 0.00 -0.63 0.00 0.00 43.02 42.64 1dnk s PHE 84 CO 0.08 -0.54 1.13 1.03 -0.05 0.00 0.00 175.22 176.86 1dnk s ARG 85 N -1.44 3.31 0.60 1.99 0.52 -0.61 -0.58 118.95 122.75 1dnk s ARG 85 Ca -0.11 -1.00 0.28 0.00 -0.52 0.00 0.00 55.73 54.38 1dnk s ARG 85 Cb -0.02 -4.55 1.33 0.00 0.52 0.00 0.00 34.95 32.23 1dnk s ARG 85 CO 0.06 -1.92 1.74 -1.35 0.02 0.00 0.00 175.30 173.86 1dnk h PRO 86 N 9.50 0.00 -0.00 3.54 0.11 -1.73 0.41 132.00 143.83 1dnk h PRO 86 Ca -0.11 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.00 1dnk h PRO 86 Cb 1.05 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.16 1dnk h PRO 86 CO 1.22 0.00 -0.13 0.27 -0.21 0.00 0.00 178.00 179.15 1dnk n ASN 87 N -3.47 0.18 -0.00 -2.05 6.94 -1.26 -3.72 115.26 111.87 1dnk n ASN 87 Ca 0.10 0.13 0.05 0.00 -0.02 0.00 0.00 54.58 54.84 1dnk n ASN 87 Cb 0.83 -0.25 -0.08 0.00 -2.36 0.00 0.00 39.78 37.92 1dnk n ASN 87 CO 0.00 0.00 0.00 0.29 -1.03 0.00 0.00 177.26 176.52 1dnk n LYS 88 N -1.41 1.06 -3.47 -3.83 4.76 0.14 -5.08 118.16 110.34 1dnk n LYS 88 Ca 0.08 -0.08 -0.11 0.00 -2.87 0.00 0.00 58.31 55.33 1dnk n LYS 88 Cb 0.32 -1.20 -0.02 0.00 -1.84 0.00 0.00 35.03 32.29 1dnk n LYS 88 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1dnk s VAL 89 N -2.58 0.00 0.01 -0.18 0.11 -1.00 -4.22 120.40 112.55 1dnk s VAL 89 Ca -0.02 -0.11 -0.04 0.00 -2.93 0.00 0.00 61.98 58.88 1dnk s VAL 89 Cb 0.07 -1.10 -0.01 0.00 -1.53 0.00 0.00 36.38 33.81 1dnk s VAL 89 CO 0.45 -0.01 0.05 -0.94 -3.33 0.00 0.00 175.10 171.33 1dnk s SER 90 N -2.77 0.12 0.37 3.54 1.04 -1.14 -4.22 113.70 110.64 1dnk s SER 90 Ca 0.02 -0.33 -0.25 0.00 0.48 0.00 0.00 55.95 55.87 1dnk s SER 90 Cb -0.01 0.15 -0.10 0.00 0.10 0.00 0.00 66.02 66.16 1dnk s SER 90 CO -0.11 -0.32 1.00 -0.69 0.98 0.00 0.00 173.24 174.10 1dnk s VAL 91 N -1.36 3.96 -0.01 5.02 1.01 -1.26 -1.47 120.40 126.28 1dnk s VAL 91 Ca -0.15 1.54 0.01 0.00 0.00 0.00 0.00 61.98 63.39 1dnk s VAL 91 Cb -0.08 -3.82 -0.02 0.00 0.00 0.00 0.00 36.38 32.46 1dnk s VAL 91 CO 0.00 0.05 0.03 0.18 0.00 0.00 0.00 175.10 175.37 1dnk n LEU 92 N 0.18 0.01 0.00 3.92 4.77 -0.18 -4.87 117.00 120.84 1dnk n LEU 92 Ca 0.04 -0.09 0.00 0.00 -0.03 0.00 0.00 56.01 55.92 1dnk n LEU 92 Cb 0.50 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.59 1dnk n LEU 92 CO 0.44 0.00 0.00 -0.67 -1.33 0.00 0.00 177.39 175.84 1dnk n ASP 93 N -1.45 0.00 -3.69 -1.43 -0.08 -1.24 -5.01 116.55 103.64 1dnk n ASP 93 Ca -0.00 0.00 -0.10 0.00 -1.51 0.00 0.00 54.79 53.18 1dnk n ASP 93 Cb 0.03 0.00 -0.05 0.00 2.34 0.00 0.00 41.12 43.44 1dnk n ASP 93 CO 0.00 0.00 0.00 0.28 0.12 0.00 0.00 177.20 177.60 1dnk s THR 94 N -2.00 0.09 -0.10 5.18 -1.32 -1.26 -0.99 115.64 115.23 1dnk s THR 94 Ca 0.00 -0.71 -0.30 0.00 -1.21 0.00 0.00 61.69 59.47 1dnk s THR 94 Cb 0.00 -1.18 0.12 0.00 -1.51 0.00 0.00 72.50 69.92 1dnk s THR 94 CO 0.00 -0.39 0.99 -0.72 -2.21 0.00 0.00 174.62 172.29 1dnk s TYR 95 N -3.70 -0.32 -0.34 9.09 1.13 -0.40 -5.01 117.35 117.80 1dnk s TYR 95 Ca 0.03 0.36 -0.16 0.00 -1.41 0.00 0.00 57.07 55.89 1dnk s TYR 95 Cb 0.02 0.50 -0.01 0.00 -1.10 0.00 0.00 41.96 41.37 1dnk s TYR 95 CO -0.11 -0.40 0.39 -1.14 -2.51 0.00 0.00 175.55 171.78 1dnk s GLN 96 N -2.18 3.58 0.00 -3.49 2.00 -1.26 -0.73 119.66 117.59 1dnk s GLN 96 Ca 0.03 -0.36 0.00 0.00 -2.00 0.00 0.00 55.36 53.03 1dnk s GLN 96 Cb -0.01 -3.80 0.00 0.00 0.80 0.00 0.00 33.01 30.00 1dnk s GLN 96 CO -0.04 -0.54 0.00 0.98 -0.50 0.00 0.00 175.29 175.19 1dnk n TYR 97 N 5.45 0.00 0.00 1.67 9.36 0.26 -4.98 117.16 128.92 1dnk n TYR 97 Ca -0.08 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.14 1dnk n TYR 97 Cb 0.49 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.20 1dnk n TYR 97 CO 0.00 0.00 0.00 0.43 0.22 0.00 0.00 176.86 177.51 1dnk n SER 108 N 0.00 0.00 -4.12 2.98 7.64 -1.26 -4.66 113.62 114.19 1dnk n SER 108 Ca 0.00 0.00 -0.22 0.00 1.01 0.00 0.00 58.87 59.66 1dnk n SER 108 Cb 0.00 -0.08 -0.14 0.00 -1.01 0.00 0.00 64.21 62.98 1dnk n SER 108 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 1dnk s PHE 109 N -0.23 1.25 0.03 1.43 0.40 -1.26 -4.68 117.98 114.92 1dnk s PHE 109 Ca 0.00 -0.28 -0.21 0.00 -0.60 0.00 0.00 56.93 55.84 1dnk s PHE 109 Cb 0.00 -0.78 -0.16 0.00 0.51 0.00 0.00 43.02 42.59 1dnk s PHE 109 CO 0.00 0.00 1.31 1.03 0.70 0.00 0.00 175.22 178.26 1dnk h SER 110 N 5.48 0.34 -3.00 1.36 0.87 -1.98 -3.36 113.55 113.25 1dnk h SER 110 Ca -0.36 -0.51 -0.61 0.00 -1.23 0.00 0.00 61.79 59.08 1dnk h SER 110 Cb 1.17 -0.10 -0.41 0.00 -0.44 0.00 0.00 62.40 62.62 1dnk h SER 110 CO 0.47 0.79 -0.67 -0.13 -0.53 0.00 0.00 176.83 176.76 1dnk s ARG 111 N -4.18 2.08 0.20 2.24 0.52 -1.26 -3.61 118.95 114.93 1dnk s ARG 111 Ca -0.14 -3.02 -0.32 0.00 -0.52 0.00 0.00 55.73 51.73 1dnk s ARG 111 Cb 0.05 -2.96 -0.15 0.00 0.52 0.00 0.00 34.95 32.41 1dnk s ARG 111 CO 0.75 -1.30 1.22 -0.85 0.02 0.00 0.00 175.30 175.14 1dnk n GLU 112 N 2.25 1.41 -1.72 3.54 0.00 -1.26 -4.67 120.64 120.19 1dnk n GLU 112 Ca 0.21 0.50 -0.42 0.00 0.00 0.00 0.00 57.16 57.45 1dnk n GLU 112 Cb 0.38 -2.04 -0.01 0.00 0.00 0.00 0.00 31.44 29.76 1dnk n GLU 112 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.13 176.78 1dnk n PRO 113 N 1.79 2.44 -3.49 3.44 -0.04 -1.26 -4.73 135.00 133.14 1dnk n PRO 113 Ca 0.14 0.86 -0.37 0.00 -0.04 0.00 0.00 63.50 64.09 1dnk n PRO 113 Cb 0.27 -2.57 -0.07 0.00 -0.04 0.00 0.00 33.50 31.09 1dnk n PRO 113 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1dnk s ALA 114 N -0.37 3.58 -0.13 0.55 0.00 -1.23 0.90 121.76 125.06 1dnk s ALA 114 Ca 0.62 -0.38 0.01 0.00 0.00 0.00 0.00 51.96 52.22 1dnk s ALA 114 Cb -0.54 -2.44 -0.00 0.00 0.00 0.00 0.00 23.12 20.13 1dnk s ALA 114 CO 0.53 0.11 -0.18 0.08 0.00 0.00 0.00 175.76 176.31 1dnk s VAL 115 N 0.35 2.56 0.02 0.00 1.01 0.09 -1.57 120.40 122.87 1dnk s VAL 115 Ca 0.19 -0.83 0.08 0.00 0.00 0.00 0.00 61.98 61.43 1dnk s VAL 115 Cb -0.14 -2.05 -0.03 0.00 0.00 0.00 0.00 36.38 34.17 1dnk s VAL 115 CO 0.06 0.53 -0.24 -0.69 0.00 0.00 0.00 175.10 174.76 1dnk s VAL 116 N 0.55 2.26 -0.18 2.92 1.01 -0.72 -1.27 120.40 124.97 1dnk s VAL 116 Ca -0.11 -1.25 -0.04 0.00 0.00 0.00 0.00 61.98 60.59 1dnk s VAL 116 Cb -0.16 -1.87 -0.02 0.00 0.00 0.00 0.00 36.38 34.33 1dnk s VAL 116 CO 0.04 0.43 -0.04 -0.75 0.00 0.00 0.00 175.10 174.78 1dnk s LYS 117 N -1.07 3.58 0.09 2.72 2.20 -0.16 -0.80 119.74 126.30 1dnk s LYS 117 Ca 0.12 -0.55 0.10 0.00 -0.36 0.00 0.00 55.97 55.27 1dnk s LYS 117 Cb -0.10 -2.95 -0.03 0.00 -1.51 0.00 0.00 37.83 33.24 1dnk s LYS 117 CO 0.02 0.10 -0.26 -0.06 -0.36 0.00 0.00 175.35 174.79 1dnk s PHE 118 N 0.72 2.26 -0.16 4.03 0.08 -0.50 -1.01 117.98 123.40 1dnk s PHE 118 Ca -0.02 -0.39 -0.06 0.00 0.12 0.00 0.00 56.93 56.58 1dnk s PHE 118 Cb -0.14 -1.28 -0.04 0.00 -0.57 0.00 0.00 43.02 40.99 1dnk s PHE 118 CO 0.02 0.24 0.04 0.45 -0.10 0.00 0.00 175.22 175.88 1dnk s SER 119 N -1.71 5.51 -0.24 1.36 0.15 -0.54 -1.72 113.70 116.50 1dnk s SER 119 Ca 0.12 0.09 -0.01 0.00 0.70 0.00 0.00 55.95 56.85 1dnk s SER 119 Cb -0.10 -1.88 0.07 0.00 -1.71 0.00 0.00 66.02 62.40 1dnk s SER 119 CO 0.04 0.22 0.03 -0.55 1.20 0.00 0.00 173.24 174.18 1dnk s SER 120 N 0.10 3.54 0.19 5.45 0.15 0.34 -2.90 113.70 120.58 1dnk s SER 120 Ca 0.04 -1.20 0.04 0.00 0.70 0.00 0.00 55.95 55.53 1dnk s SER 120 Cb -0.12 -0.85 0.10 0.00 -1.71 0.00 0.00 66.02 63.44 1dnk s SER 120 CO 0.01 -0.33 1.45 0.45 1.20 0.00 0.00 173.24 176.03 1dnk h HIS 121 N 8.11 0.27 -0.17 3.44 3.86 -1.81 -3.34 115.15 125.51 1dnk h HIS 121 Ca -0.15 -0.13 0.00 0.00 -1.16 0.00 0.00 60.37 58.92 1dnk h HIS 121 Cb 1.07 -0.04 0.00 0.00 1.06 0.00 0.00 27.41 29.51 1dnk h HIS 121 CO 0.36 0.89 0.00 -1.13 0.86 0.00 0.00 177.93 178.91 1dnk n SER 122 N -3.73 1.36 -4.59 2.45 3.41 -1.26 -4.94 113.62 106.32 1dnk n SER 122 Ca -0.03 -1.75 -0.27 0.00 -0.26 0.00 0.00 58.87 56.56 1dnk n SER 122 Cb 0.73 -0.11 -0.11 0.00 -0.26 0.00 0.00 64.21 64.46 1dnk n SER 122 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1dnk s THR 123 N -1.77 1.88 0.09 6.66 -4.23 -1.25 -4.92 115.64 112.10 1dnk s THR 123 Ca 0.28 -2.01 -0.29 0.00 -1.18 0.00 0.00 61.69 58.48 1dnk s THR 123 Cb 0.14 -2.95 -0.14 0.00 1.34 0.00 0.00 72.50 70.89 1dnk s THR 123 CO 0.22 -0.01 1.65 0.11 -0.54 0.00 0.00 174.62 176.04 1dnk h LYS 124 N 1.84 -0.58 -6.58 3.99 1.57 -0.68 -3.39 116.57 112.74 1dnk h LYS 124 Ca -0.43 0.04 -0.52 0.00 -1.87 0.00 0.00 60.65 57.87 1dnk h LYS 124 Cb 1.24 0.13 -0.01 0.00 0.08 0.00 0.00 32.23 33.67 1dnk h LYS 124 CO 0.79 -0.39 0.42 0.54 -0.57 0.00 0.00 179.45 180.24 1dnk s VAL 125 N -6.08 4.26 -0.17 0.50 0.11 -1.26 -4.97 120.40 112.79 1dnk s VAL 125 Ca -0.16 1.85 -0.05 0.00 -2.93 0.00 0.00 61.98 60.69 1dnk s VAL 125 Cb 0.05 -4.18 -0.23 0.00 -1.53 0.00 0.00 36.38 30.49 1dnk s VAL 125 CO 0.64 0.27 0.16 0.29 -3.33 0.00 0.00 175.10 173.13 1dnk n LYS 126 N 2.84 0.72 -4.39 1.54 4.76 -1.26 -4.68 118.16 117.69 1dnk n LYS 126 Ca 0.03 0.24 -0.19 0.00 -2.87 0.00 0.00 58.31 55.52 1dnk n LYS 126 Cb 0.48 -1.65 -0.15 0.00 -1.84 0.00 0.00 35.03 31.88 1dnk n LYS 126 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 1dnk s GLU 127 N -2.54 0.76 0.05 1.97 2.02 -1.26 0.13 118.70 119.83 1dnk s GLU 127 Ca -0.27 -0.35 -0.27 0.00 0.02 0.00 0.00 54.97 54.11 1dnk s GLU 127 Cb 0.07 -0.74 0.07 0.00 0.10 0.00 0.00 34.13 33.64 1dnk s GLU 127 CO 0.71 0.20 0.63 -0.59 0.02 0.00 0.00 175.26 176.23 1dnk s PHE 128 N -0.24 -0.59 0.21 1.61 -0.12 -0.70 -4.84 117.98 113.31 1dnk s PHE 128 Ca 0.03 0.73 0.09 0.00 -0.05 0.00 0.00 56.93 57.73 1dnk s PHE 128 Cb -0.04 0.47 -0.04 0.00 -0.63 0.00 0.00 43.02 42.78 1dnk s PHE 128 CO -0.00 -0.72 -0.04 0.00 -0.05 0.00 0.00 175.22 174.41 1dnk s ALA 129 N -2.42 3.09 -0.13 1.99 0.00 -0.42 -1.42 121.76 122.45 1dnk s ALA 129 Ca -0.05 -1.51 0.01 0.00 0.00 0.00 0.00 51.96 50.40 1dnk s ALA 129 Cb -0.00 -0.81 0.02 0.00 0.00 0.00 0.00 23.12 22.32 1dnk s ALA 129 CO -0.01 0.40 -0.13 0.42 0.00 0.00 0.00 175.76 176.43 1dnk s ILE 130 N -1.93 1.47 -0.20 0.00 1.01 0.02 -0.21 121.20 121.36 1dnk s ILE 130 Ca 0.28 -0.58 -0.09 0.00 0.00 0.00 0.00 60.65 60.26 1dnk s ILE 130 Cb -0.08 -1.38 -0.04 0.00 0.01 0.00 0.00 42.46 40.96 1dnk s ILE 130 CO 0.18 0.44 0.10 -0.69 0.00 0.00 0.00 174.94 174.96 1dnk s VAL 131 N 1.40 5.06 -0.13 2.92 1.01 -0.46 -1.76 120.40 128.44 1dnk s VAL 131 Ca 0.02 0.06 -0.06 0.00 0.00 0.00 0.00 61.98 62.01 1dnk s VAL 131 Cb -0.13 -3.30 -0.04 0.00 0.00 0.00 0.00 36.38 32.91 1dnk s VAL 131 CO -0.08 0.44 0.07 0.00 0.00 0.00 0.00 175.10 175.53 1dnk s ALA 132 N 0.47 3.55 -0.11 5.51 0.00 -0.61 -2.00 121.76 128.58 1dnk s ALA 132 Ca 0.05 -0.72 -0.05 0.00 0.00 0.00 0.00 51.96 51.24 1dnk s ALA 132 Cb -0.12 -1.80 0.05 0.00 0.00 0.00 0.00 23.12 21.25 1dnk s ALA 132 CO -0.00 0.47 0.24 -1.17 0.00 0.00 0.00 175.76 175.30 1dnk s LEU 133 N -0.55 0.22 -0.39 0.00 2.96 -0.91 -3.55 118.68 116.47 1dnk s LEU 133 Ca 0.11 0.52 0.01 0.00 -0.22 0.00 0.00 54.13 54.55 1dnk s LEU 133 Cb -0.12 0.69 0.11 0.00 0.50 0.00 0.00 46.19 47.37 1dnk s LEU 133 CO 0.02 -0.19 0.15 -2.28 -1.32 0.00 0.00 176.35 172.73 1dnk s HIS 134 N 1.59 3.64 0.90 5.38 5.65 -1.26 -2.42 115.29 128.78 1dnk s HIS 134 Ca -0.06 -2.77 -0.13 0.00 0.25 0.00 0.00 55.06 52.35 1dnk s HIS 134 Cb -0.11 -3.06 0.13 0.00 -1.18 0.00 0.00 32.58 28.37 1dnk s HIS 134 CO -0.08 -0.94 1.16 -1.54 -0.65 0.00 0.00 174.74 172.69 1dnk s SER 135 N 1.18 3.62 -0.14 9.88 1.04 -0.15 -4.66 113.70 124.47 1dnk s SER 135 Ca 0.11 0.85 -0.20 0.00 0.48 0.00 0.00 55.95 57.19 1dnk s SER 135 Cb -0.21 -1.35 -0.04 0.00 0.10 0.00 0.00 66.02 64.52 1dnk s SER 135 CO -0.06 -2.47 0.57 0.00 0.98 0.00 0.00 173.24 172.26 1dnk s ALA 136 N -3.39 3.47 0.20 5.32 0.00 -1.26 -4.86 121.76 121.25 1dnk s ALA 136 Ca 0.64 -0.17 -0.10 0.00 0.00 0.00 0.00 51.96 52.34 1dnk s ALA 136 Cb -0.13 -2.82 0.27 0.00 0.00 0.00 0.00 23.12 20.44 1dnk s ALA 136 CO 0.52 -0.22 1.73 -1.35 0.00 0.00 0.00 175.76 176.44 1dnk h PRO 137 N 7.02 0.33 0.00 0.00 0.11 -1.95 0.17 132.00 137.68 1dnk h PRO 137 Ca -0.38 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.71 1dnk h PRO 137 Cb 1.17 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 32.21 1dnk h PRO 137 CO 0.76 0.22 0.00 0.43 -0.21 0.00 0.00 178.00 179.19 1dnk n SER 138 N -5.05 0.14 -1.47 -2.05 7.64 -1.26 -3.66 113.62 107.92 1dnk n SER 138 Ca 0.08 0.53 0.04 0.00 1.01 0.00 0.00 58.87 60.53 1dnk n SER 138 Cb 0.28 -0.56 0.02 0.00 -1.01 0.00 0.00 64.21 62.94 1dnk n SER 138 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 1dnk n ASP 139 N -1.65 1.01 -0.07 6.43 2.03 -0.65 -4.93 116.55 118.72 1dnk n ASP 139 Ca 0.04 -2.05 -0.10 0.00 0.52 0.00 0.00 54.79 53.20 1dnk n ASP 139 Cb 0.23 -0.31 -0.04 0.00 -0.72 0.00 0.00 41.12 40.29 1dnk n ASP 139 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1dnk h ALA 140 N 0.99 0.30 0.16 -1.67 0.00 -1.07 -2.21 119.26 115.76 1dnk h ALA 140 Ca -0.22 -0.09 0.02 0.00 0.00 0.00 0.00 54.91 54.61 1dnk h ALA 140 Cb 1.87 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 19.53 1dnk h ALA 140 CO 0.10 -0.14 -0.41 0.28 0.00 0.00 0.00 179.25 179.08 1dnk h VAL 141 N 0.24 0.17 -0.97 0.00 2.07 -1.87 0.44 116.25 116.33 1dnk h VAL 141 Ca 0.08 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.72 1dnk h VAL 141 Cb 0.12 0.17 -0.08 0.00 -1.52 0.00 0.00 31.29 29.99 1dnk h VAL 141 CO -0.01 0.00 0.62 0.00 0.02 0.00 0.00 177.57 178.20 1dnk h ALA 142 N -0.19 1.59 0.08 1.67 0.00 -1.94 -2.58 119.26 117.88 1dnk h ALA 142 Ca 0.01 0.02 -0.26 0.00 0.00 0.00 0.00 54.91 54.68 1dnk h ALA 142 Cb 0.68 -0.20 0.01 0.00 0.00 0.00 0.00 17.79 18.28 1dnk h ALA 142 CO -0.21 0.18 -1.13 0.93 0.00 0.00 0.00 179.25 179.01 1dnk h GLU 143 N 0.94 0.43 -0.23 0.00 5.08 -0.71 -2.27 114.58 117.82 1dnk h GLU 143 Ca 0.48 -0.57 -0.10 0.00 -1.00 0.00 0.00 59.36 58.17 1dnk h GLU 143 Cb 0.51 0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.93 1dnk h GLU 143 CO -0.24 1.22 -0.28 0.82 -1.00 0.00 0.00 179.01 179.53 1dnk h ILE 144 N 0.19 1.27 -0.43 3.13 2.04 0.08 -2.98 117.51 120.81 1dnk h ILE 144 Ca -0.13 -1.31 -0.12 0.00 1.00 0.00 0.00 64.86 64.30 1dnk h ILE 144 Cb 1.81 1.40 -0.01 0.00 -0.74 0.00 0.00 36.82 39.28 1dnk h ILE 144 CO 0.20 0.41 -0.21 -1.13 0.00 0.00 0.00 178.15 177.42 1dnk h ASN 145 N 0.39 0.94 0.21 1.72 -1.24 -1.47 -2.87 115.58 113.27 1dnk h ASN 145 Ca 0.05 -0.40 -0.02 0.00 0.71 0.00 0.00 56.30 56.64 1dnk h ASN 145 Cb 0.70 -0.26 -0.00 0.00 0.73 0.00 0.00 38.32 39.48 1dnk h ASN 145 CO 0.05 1.13 -0.10 0.28 -1.29 0.00 0.00 177.43 177.51 1dnk h SER 146 N 0.74 0.00 0.00 1.15 0.02 -1.38 -0.31 113.55 113.77 1dnk h SER 146 Ca 0.10 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.05 1dnk h SER 146 Cb 0.78 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.32 1dnk h SER 146 CO 0.06 0.10 0.10 -0.07 -1.14 0.00 0.00 176.83 175.88 1dnk h LEU 147 N 0.00 0.00 -0.24 5.07 3.38 -1.35 0.33 115.31 122.51 1dnk h LEU 147 Ca -0.00 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.85 1dnk h LEU 147 Cb 0.23 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.98 1dnk h LEU 147 CO 0.01 0.00 -0.30 0.22 0.09 0.00 0.00 178.44 178.46 1dnk h TYR 148 N 0.00 0.76 -0.01 1.13 3.20 -1.20 -1.27 116.97 119.57 1dnk h TYR 148 Ca 0.00 -0.24 0.01 0.00 3.14 0.00 0.00 58.73 61.64 1dnk h TYR 148 Cb 0.20 -0.15 -0.02 0.00 1.54 0.00 0.00 36.73 38.30 1dnk h TYR 148 CO 0.00 0.97 -0.06 -0.44 -1.64 0.00 0.00 178.16 176.99 1dnk h ASP 149 N 0.32 -0.19 -0.95 -2.11 3.32 -0.51 -1.44 116.42 114.87 1dnk h ASP 149 Ca 0.03 0.03 0.11 0.00 0.02 0.00 0.00 57.03 57.22 1dnk h ASP 149 Cb 0.87 0.08 -0.07 0.00 0.22 0.00 0.00 39.33 40.43 1dnk h ASP 149 CO 0.07 -0.09 0.61 0.58 -1.72 0.00 0.00 179.24 178.68 1dnk h VAL 150 N -0.11 0.93 0.31 -1.35 2.07 -1.25 0.42 116.25 117.27 1dnk h VAL 150 Ca 0.03 -0.31 -0.01 0.00 0.82 0.00 0.00 66.70 67.23 1dnk h VAL 150 Cb 0.15 -0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 29.84 1dnk h VAL 150 CO -0.08 0.17 -0.21 0.22 0.02 0.00 0.00 177.57 177.69 1dnk h TYR 151 N 0.92 -0.54 -0.93 1.57 3.20 -0.46 0.29 116.97 121.01 1dnk h TYR 151 Ca 0.46 -0.00 0.06 0.00 3.14 0.00 0.00 58.73 62.39 1dnk h TYR 151 Cb 0.49 0.20 -0.06 0.00 1.54 0.00 0.00 36.73 38.89 1dnk h TYR 151 CO -0.00 -0.32 0.59 -0.07 -1.64 0.00 0.00 178.16 176.72 1dnk h LEU 152 N -0.51 0.93 0.12 2.82 4.07 -0.24 -1.07 115.31 121.43 1dnk h LEU 152 Ca -0.03 0.01 0.01 0.00 0.08 0.00 0.00 57.88 57.95 1dnk h LEU 152 Cb 0.43 -0.19 -0.02 0.00 1.08 0.00 0.00 40.66 41.96 1dnk h LEU 152 CO 0.02 0.60 -0.17 -0.78 -1.08 0.00 0.00 178.44 177.03 1dnk h ASP 153 N 1.07 -0.46 -0.68 -0.43 3.58 0.70 -1.31 116.42 118.89 1dnk h ASP 153 Ca 0.40 0.05 0.05 0.00 0.42 0.00 0.00 57.03 57.95 1dnk h ASP 153 Cb 0.16 0.17 -0.05 0.00 1.72 0.00 0.00 39.33 41.33 1dnk h ASP 153 CO -0.17 -0.25 0.40 0.58 -2.88 0.00 0.00 179.24 176.92 1dnk h VAL 154 N -0.34 1.02 -0.25 2.25 2.07 0.08 -2.21 116.25 118.87 1dnk h VAL 154 Ca 0.02 -0.26 0.00 0.00 0.82 0.00 0.00 66.70 67.28 1dnk h VAL 154 Cb 0.35 0.20 -0.01 0.00 -1.52 0.00 0.00 31.29 30.30 1dnk h VAL 154 CO -0.08 0.14 0.16 1.56 0.02 0.00 0.00 177.57 179.37 1dnk h GLN 155 N 0.75 0.31 -0.00 1.57 4.20 -0.91 -1.51 115.11 119.53 1dnk h GLN 155 Ca 0.29 -0.02 -0.00 0.00 0.06 0.00 0.00 58.65 58.99 1dnk h GLN 155 Cb 0.13 -0.07 -0.00 0.00 0.30 0.00 0.00 27.48 27.84 1dnk h GLN 155 CO -0.15 0.21 0.00 1.96 -0.67 0.00 0.00 178.83 180.17 1dnk h GLN 156 N 0.32 0.00 0.31 1.46 4.20 -0.93 0.27 115.11 120.74 1dnk h GLN 156 Ca 0.09 -0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.79 1dnk h GLN 156 Cb -0.03 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.76 1dnk h GLN 156 CO -0.03 0.06 -0.15 0.87 -0.67 0.00 0.00 178.83 178.92 1dnk h LYS 157 N -0.06 -0.40 -0.00 1.46 1.57 -1.39 -3.36 116.57 114.39 1dnk h LYS 157 Ca 0.00 0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.81 1dnk h LYS 157 Cb 0.06 0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.46 1dnk h LYS 157 CO -0.00 -0.15 -0.90 0.91 -0.57 0.00 0.00 179.45 178.74 1dnk n TRP 158 N -5.19 0.00 -3.40 -1.35 8.01 -0.57 -4.99 117.44 109.95 1dnk n TRP 158 Ca -0.10 0.00 -0.21 0.00 -1.31 0.00 0.00 57.50 55.88 1dnk n TRP 158 Cb 0.23 0.00 0.07 0.00 -2.01 0.00 0.00 31.31 29.60 1dnk n TRP 158 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.69 177.40 1dnk n HIS 159 N -1.31 -2.43 -4.91 -5.99 8.25 0.95 -4.96 115.22 104.81 1dnk n HIS 159 Ca 0.04 0.84 -0.28 0.00 -0.26 0.00 0.00 57.72 58.07 1dnk n HIS 159 Cb 0.33 -4.46 -0.16 0.00 1.12 0.00 0.00 29.99 26.82 1dnk n HIS 159 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 1dnk s LEU 160 N -6.41 1.91 -0.15 2.41 2.96 -1.24 -5.01 118.68 113.16 1dnk s LEU 160 Ca 0.49 -0.40 0.18 0.00 -0.22 0.00 0.00 54.13 54.18 1dnk s LEU 160 Cb -0.21 -1.08 -0.26 0.00 0.50 0.00 0.00 46.19 45.14 1dnk s LEU 160 CO 0.60 0.14 0.17 0.59 -1.32 0.00 0.00 176.35 176.54 1dnk n ASN 161 N 3.32 0.18 -4.55 3.68 5.03 -1.26 -4.11 115.26 117.55 1dnk n ASN 161 Ca -0.19 0.00 -0.41 0.00 0.87 0.00 0.00 54.58 54.85 1dnk n ASN 161 Cb 0.53 1.24 -0.03 0.00 -1.02 0.00 0.00 39.78 40.50 1dnk n ASN 161 CO 0.00 0.00 0.00 -1.81 -1.83 0.00 0.00 177.26 173.62 1dnk s ASP 162 N -5.15 6.19 -0.03 6.41 1.01 -1.26 -2.81 116.67 121.04 1dnk s ASP 162 Ca -0.09 -0.56 -0.01 0.00 0.71 0.00 0.00 52.55 52.60 1dnk s ASP 162 Cb 0.08 -2.56 0.03 0.00 1.01 0.00 0.00 42.92 41.48 1dnk s ASP 162 CO 0.82 -1.80 0.06 -0.69 0.21 0.00 0.00 175.17 173.77 1dnk s VAL 163 N 5.61 -0.08 -0.22 -1.27 1.01 -1.16 -1.31 120.40 122.98 1dnk s VAL 163 Ca 0.36 0.28 -0.08 0.00 0.00 0.00 0.00 61.98 62.54 1dnk s VAL 163 Cb -0.07 -0.12 -0.04 0.00 0.00 0.00 0.00 36.38 36.14 1dnk s VAL 163 CO 0.12 0.12 0.09 -0.32 0.00 0.00 0.00 175.10 175.11 1dnk s MET 164 N 1.46 3.87 -0.18 2.72 1.75 0.71 -2.18 119.30 127.45 1dnk s MET 164 Ca -0.04 -0.38 -0.01 0.00 -1.25 0.00 0.00 55.69 54.01 1dnk s MET 164 Cb -0.13 -3.33 -0.00 0.00 2.84 0.00 0.00 34.83 34.22 1dnk s MET 164 CO -0.03 0.05 -0.13 -0.51 -0.65 0.00 0.00 175.02 173.75 1dnk s LEU 165 N 1.01 2.55 0.10 4.11 1.02 0.28 -1.35 118.68 126.40 1dnk s LEU 165 Ca 0.05 -0.47 -0.11 0.00 0.02 0.00 0.00 54.13 53.61 1dnk s LEU 165 Cb -0.14 -1.60 0.01 0.00 0.02 0.00 0.00 46.19 44.48 1dnk s LEU 165 CO 0.03 0.04 0.26 0.00 0.02 0.00 0.00 176.35 176.71 1dnk s MET 166 N 1.08 0.93 0.00 1.70 0.23 -0.85 0.11 119.30 122.50 1dnk s MET 166 Ca -0.00 -0.88 0.00 0.00 -1.03 0.00 0.00 55.69 53.77 1dnk s MET 166 Cb -0.14 0.39 0.00 0.00 -1.53 0.00 0.00 34.83 33.54 1dnk s MET 166 CO -0.03 -0.32 0.00 0.41 -2.03 0.00 0.00 175.02 173.04 1dnk n GLY 167 N -0.12 0.20 3.49 3.16 0.00 -0.76 -2.14 105.19 109.02 1dnk n GLY 167 Ca -0.15 -1.74 -0.44 0.00 0.00 0.00 0.00 46.02 43.70 1dnk n GLY 167 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1dnk s ASP 168 N -2.78 6.93 0.00 1.61 2.15 -1.01 -0.98 116.67 122.59 1dnk s ASP 168 Ca 0.00 -2.66 0.30 0.00 0.43 0.00 0.00 52.55 50.62 1dnk s ASP 168 Cb 0.00 -2.44 1.52 0.00 -0.30 0.00 0.00 42.92 41.69 1dnk s ASP 168 CO 0.00 -0.92 2.02 0.49 -0.17 0.00 0.00 175.17 176.59 1dnk n PHE 169 N 6.49 0.00 -3.27 -5.34 3.72 -1.03 -0.98 117.46 117.05 1dnk n PHE 169 Ca 0.37 0.00 -0.22 0.00 -0.05 0.00 0.00 57.45 57.54 1dnk n PHE 169 Cb 0.45 -0.07 0.00 0.00 -0.94 0.00 0.00 39.48 38.92 1dnk n PHE 169 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 1dnk n ASN 170 N -0.77 -3.96 -1.80 4.37 3.02 -1.06 -4.67 115.26 110.39 1dnk n ASN 170 Ca 0.20 -0.34 -0.06 0.00 -0.03 0.00 0.00 54.58 54.34 1dnk n ASN 170 Cb 0.22 -3.27 -0.09 0.00 -0.61 0.00 0.00 39.78 36.02 1dnk n ASN 170 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1dnk n ALA 171 N -3.44 5.14 -3.39 5.41 0.00 -1.22 -4.12 120.51 118.89 1dnk n ALA 171 Ca -0.03 -0.97 0.03 0.00 0.00 0.00 0.00 53.44 52.47 1dnk n ALA 171 Cb 0.55 -1.75 0.01 0.00 0.00 0.00 0.00 19.45 18.26 1dnk n ALA 171 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1dnk n ASP 172 N 2.08 -0.78 0.00 0.00 2.03 -1.26 -4.72 116.55 113.90 1dnk n ASP 172 Ca 0.23 -1.42 0.00 0.00 0.52 0.00 0.00 54.79 54.12 1dnk n ASP 172 Cb 0.70 1.27 0.00 0.00 -0.72 0.00 0.00 41.12 42.37 1dnk n ASP 172 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1dnk h SER 174 N 0.00 0.00 0.91 0.00 4.64 -1.99 -3.32 113.55 113.79 1dnk h SER 174 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1dnk h SER 174 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1dnk h SER 174 CO 0.00 0.05 -1.03 -1.22 -0.87 0.00 0.00 176.83 173.76 1dnk n TYR 175 N -3.17 0.87 -3.39 4.77 4.01 -0.42 -4.75 117.16 115.08 1dnk n TYR 175 Ca 0.00 0.25 -0.13 0.00 -0.16 0.00 0.00 57.90 57.87 1dnk n TYR 175 Cb 0.32 -0.89 -0.09 0.00 -0.31 0.00 0.00 39.34 38.36 1dnk n TYR 175 CO 0.00 0.00 0.00 0.08 -0.46 0.00 0.00 176.86 176.48 1dnk s VAL 176 N -3.35 -0.51 0.59 -0.72 1.01 -1.11 -4.21 120.40 112.10 1dnk s VAL 176 Ca -0.00 -0.18 -0.01 0.00 0.00 0.00 0.00 61.98 61.79 1dnk s VAL 176 Cb 0.10 -0.83 0.04 0.00 0.00 0.00 0.00 36.38 35.69 1dnk s VAL 176 CO 0.79 -0.22 0.84 0.42 0.00 0.00 0.00 175.10 176.94 1dnk s THR 177 N 2.46 2.63 0.23 3.92 -4.23 -1.26 -3.98 115.64 115.41 1dnk s THR 177 Ca 0.10 -0.53 -0.08 0.00 -1.18 0.00 0.00 61.69 60.01 1dnk s THR 177 Cb -0.15 -3.03 0.21 0.00 1.34 0.00 0.00 72.50 70.87 1dnk s THR 177 CO -0.20 -0.03 1.68 0.28 -0.54 0.00 0.00 174.62 175.82 1dnk h SER 178 N -0.12 -0.09 0.71 3.99 0.02 -2.01 -1.92 113.55 114.15 1dnk h SER 178 Ca -0.43 0.14 -0.12 0.00 -0.84 0.00 0.00 61.79 60.54 1dnk h SER 178 Cb 1.30 0.21 -0.02 0.00 0.14 0.00 0.00 62.40 64.04 1dnk h SER 178 CO 0.55 -0.05 -0.56 0.77 -1.14 0.00 0.00 176.83 176.40 1dnk h SER 179 N 0.21 0.00 1.24 3.07 4.64 -2.03 -3.25 113.55 117.43 1dnk h SER 179 Ca 0.36 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.68 1dnk h SER 179 Cb 0.59 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.68 1dnk h SER 179 CO -0.49 0.56 0.00 1.56 -0.87 0.00 0.00 176.83 177.58 1dnk h GLN 180 N 0.00 0.00 0.00 4.77 4.20 -1.73 -3.25 115.11 119.10 1dnk h GLN 180 Ca -0.01 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.68 1dnk h GLN 180 Cb 1.06 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.84 1dnk h GLN 180 CO 0.07 0.00 -0.10 -1.49 -0.67 0.00 0.00 178.83 176.64 1dnk h TRP 181 N 0.00 0.00 0.00 2.96 -0.00 -1.57 -2.87 115.95 114.47 1dnk h TRP 181 Ca 0.00 0.00 -0.04 0.00 -0.00 0.00 0.00 58.89 58.85 1dnk h TRP 181 Cb 0.62 0.00 -0.01 0.00 -0.00 0.00 0.00 29.16 29.77 1dnk h TRP 181 CO 0.00 0.10 -0.19 0.66 -0.00 0.00 0.00 178.44 179.01 1dnk h SER 182 N 0.00 0.00 -0.48 -3.49 4.64 -1.80 -2.94 113.55 109.48 1dnk h SER 182 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1dnk h SER 182 Cb 0.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.32 1dnk h SER 182 CO 0.01 0.19 0.00 -1.54 -0.87 0.00 0.00 176.83 174.63 1dnk n SER 183 N -3.58 4.87 -4.06 4.97 3.41 -1.08 -4.78 113.62 113.37 1dnk n SER 183 Ca -0.01 -2.75 -0.33 0.00 -0.26 0.00 0.00 58.87 55.52 1dnk n SER 183 Cb 0.33 -0.65 -0.14 0.00 -0.26 0.00 0.00 64.21 63.49 1dnk n SER 183 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1dnk s ILE 184 N -2.43 2.56 0.40 -1.33 1.01 -1.11 -4.90 121.20 115.39 1dnk s ILE 184 Ca 0.45 -2.13 0.12 0.00 0.00 0.00 0.00 60.65 59.09 1dnk s ILE 184 Cb 0.34 -2.78 0.34 0.00 0.01 0.00 0.00 42.46 40.37 1dnk s ILE 184 CO 0.13 -0.52 1.91 0.03 0.00 0.00 0.00 174.94 176.49 1dnk h ARG 185 N 7.76 0.52 0.00 2.79 3.08 -1.86 -0.52 114.38 126.16 1dnk h ARG 185 Ca -0.09 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 59.92 1dnk h ARG 185 Cb 1.03 -0.12 -0.00 0.00 0.08 0.00 0.00 29.97 30.96 1dnk h ARG 185 CO 0.56 0.35 -0.05 1.25 -1.07 0.00 0.00 179.97 181.00 1dnk h LEU 186 N 0.54 0.00 0.00 3.04 5.85 -1.81 -1.76 115.31 121.17 1dnk h LEU 186 Ca 0.39 0.00 -0.12 0.00 0.84 0.00 0.00 57.88 58.99 1dnk h LEU 186 Cb 0.75 0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.76 1dnk h LEU 186 CO -0.15 0.05 -1.07 -1.14 -0.34 0.00 0.00 178.44 175.79 1dnk n ARG 187 N -3.25 0.51 -0.04 1.25 3.00 -0.32 -4.50 116.66 113.31 1dnk n ARG 187 Ca -0.01 0.44 0.00 0.00 -0.00 0.00 0.00 57.85 58.28 1dnk n ARG 187 Cb 0.25 -1.63 0.30 0.00 0.00 0.00 0.00 32.46 31.38 1dnk n ARG 187 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.63 179.42 1dnk h THR 188 N -1.00 1.18 -3.26 5.15 1.35 -1.26 -3.42 112.91 111.66 1dnk h THR 188 Ca -0.18 -0.64 -0.53 0.00 -0.55 0.00 0.00 66.41 64.51 1dnk h THR 188 Cb 0.95 0.74 0.06 0.00 -1.73 0.00 0.00 68.15 68.17 1dnk h THR 188 CO -0.11 0.24 0.80 -0.55 -0.25 0.00 0.00 175.52 175.65 1dnk s SER 189 N -6.67 6.60 0.00 5.36 0.15 -0.66 -4.85 113.70 113.63 1dnk s SER 189 Ca -0.08 2.69 0.30 0.00 0.70 0.00 0.00 55.95 59.56 1dnk s SER 189 Cb 0.16 -2.62 1.75 0.00 -1.71 0.00 0.00 66.02 63.60 1dnk s SER 189 CO 0.77 -0.76 2.13 -1.54 1.20 0.00 0.00 173.24 175.04 1dnk n SER 190 N 2.66 0.14 -0.05 5.45 3.41 -1.26 -3.36 113.62 120.61 1dnk n SER 190 Ca 0.08 -1.09 -0.06 0.00 -0.26 0.00 0.00 58.87 57.55 1dnk n SER 190 Cb 0.39 -0.00 0.14 0.00 -0.26 0.00 0.00 64.21 64.48 1dnk n SER 190 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 1dnk h THR 191 N 0.22 1.27 -3.15 6.66 2.02 -1.93 -3.44 112.91 114.55 1dnk h THR 191 Ca 0.00 -1.28 -0.60 0.00 0.77 0.00 0.00 66.41 65.29 1dnk h THR 191 Cb 0.05 1.24 -0.09 0.00 -1.74 0.00 0.00 68.15 67.61 1dnk h THR 191 CO 0.00 0.42 -0.31 -0.36 0.37 0.00 0.00 175.52 175.64 1dnk s PHE 192 N -4.59 3.54 -0.18 3.16 0.08 -1.21 -4.44 117.98 114.34 1dnk s PHE 192 Ca -0.08 0.69 -0.02 0.00 0.12 0.00 0.00 56.93 57.63 1dnk s PHE 192 Cb 0.13 -2.29 -0.01 0.00 -0.57 0.00 0.00 43.02 40.28 1dnk s PHE 192 CO 0.81 0.38 -0.08 1.14 -0.10 0.00 0.00 175.22 177.38 1dnk s GLN 193 N -0.04 3.40 -0.63 0.44 -2.07 -0.30 -4.94 119.66 115.52 1dnk s GLN 193 Ca 0.18 -0.64 -0.23 0.00 -1.82 0.00 0.00 55.36 52.85 1dnk s GLN 193 Cb -0.14 -2.84 0.07 0.00 -1.09 0.00 0.00 33.01 29.01 1dnk s GLN 193 CO 0.06 0.00 0.94 -1.58 -1.32 0.00 0.00 175.29 173.39 1dnk s TRP 194 N 0.93 2.72 0.31 9.60 0.52 -1.26 -2.03 118.94 129.73 1dnk s TRP 194 Ca -0.01 -0.47 0.05 0.00 0.02 0.00 0.00 56.10 55.69 1dnk s TRP 194 Cb -0.15 -4.21 0.52 0.00 -1.15 0.00 0.00 33.47 28.48 1dnk s TRP 194 CO 0.00 -1.56 1.77 -0.07 0.02 0.00 0.00 176.95 177.11 1dnk h LEU 195 N 11.18 0.36 -8.33 2.99 3.38 -1.77 -3.38 115.31 119.75 1dnk h LEU 195 Ca -0.28 -0.11 -0.71 0.00 0.09 0.00 0.00 57.88 56.86 1dnk h LEU 195 Cb 1.07 -0.10 -0.25 0.00 0.09 0.00 0.00 40.66 41.48 1dnk h LEU 195 CO 1.15 0.62 -0.48 -0.63 0.09 0.00 0.00 178.44 179.19 1dnk s ILE 196 N -4.48 4.66 0.84 1.22 -1.09 -1.25 -4.86 121.20 116.23 1dnk s ILE 196 Ca -0.06 -0.97 -0.11 0.00 -2.23 0.00 0.00 60.65 57.28 1dnk s ILE 196 Cb 0.14 -3.67 0.09 0.00 -1.58 0.00 0.00 42.46 37.45 1dnk s ILE 196 CO 0.77 -0.34 1.09 -2.16 -1.23 0.00 0.00 174.94 173.08 1dnk s PRO 197 N 1.55 1.74 0.00 2.79 0.04 -1.26 -4.80 135.00 135.07 1dnk s PRO 197 Ca 0.03 0.84 0.16 0.00 0.04 0.00 0.00 61.00 62.06 1dnk s PRO 197 Cb -0.20 -1.86 0.74 0.00 0.04 0.00 0.00 34.50 33.21 1dnk s PRO 197 CO 0.06 -1.91 1.47 -0.25 0.04 0.00 0.00 177.00 176.42 1dnk n ASP 198 N -3.66 0.00 -0.11 6.66 8.00 -1.26 -2.24 116.55 123.94 1dnk n ASP 198 Ca 0.07 0.26 0.12 0.00 0.71 0.00 0.00 54.79 55.95 1dnk n ASP 198 Cb 0.55 -0.38 0.19 0.00 -0.02 0.00 0.00 41.12 41.45 1dnk n ASP 198 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1dnk n SER 199 N -1.38 0.89 -4.80 -2.24 3.41 -1.26 -4.48 113.62 103.75 1dnk n SER 199 Ca 0.06 -0.69 -0.35 0.00 -0.26 0.00 0.00 58.87 57.63 1dnk n SER 199 Cb 0.15 0.39 -0.04 0.00 -0.26 0.00 0.00 64.21 64.44 1dnk n SER 199 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1dnk s ALA 200 N -2.82 2.97 -0.27 7.33 0.00 -0.95 -5.01 121.76 123.02 1dnk s ALA 200 Ca 0.15 0.59 -0.07 0.00 0.00 0.00 0.00 51.96 52.63 1dnk s ALA 200 Cb 0.18 -3.24 -0.02 0.00 0.00 0.00 0.00 23.12 20.04 1dnk s ALA 200 CO 0.67 -0.19 0.08 0.34 0.00 0.00 0.00 175.76 176.66 1dnk s ASP 201 N -1.88 5.13 -0.02 0.00 2.15 -1.26 -3.41 116.67 117.38 1dnk s ASP 201 Ca 0.63 -0.38 0.03 0.00 0.43 0.00 0.00 52.55 53.26 1dnk s ASP 201 Cb -0.17 -1.91 0.06 0.00 -0.30 0.00 0.00 42.92 40.60 1dnk s ASP 201 CO 0.21 -0.09 1.03 0.35 -0.17 0.00 0.00 175.17 176.50 1dnk n THR 202 N 4.91 1.13 -4.17 1.71 -2.24 -0.82 -4.77 114.28 110.03 1dnk n THR 202 Ca -0.16 -1.18 -0.30 0.00 -2.27 0.00 0.00 64.05 60.14 1dnk n THR 202 Cb 0.50 0.39 -0.08 0.00 -2.10 0.00 0.00 70.33 69.04 1dnk n THR 202 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1dnk s THR 203 N -1.27 3.93 -0.51 4.28 -4.23 -1.26 0.70 115.64 117.27 1dnk s THR 203 Ca 0.06 -0.97 0.24 0.00 -1.18 0.00 0.00 61.69 59.83 1dnk s THR 203 Cb 0.05 -2.85 0.24 0.00 1.34 0.00 0.00 72.50 71.28 1dnk s THR 203 CO 0.01 0.16 1.54 0.00 -0.54 0.00 0.00 174.62 175.79 1dnk h ALA 204 N 3.61 0.88 -2.19 3.99 0.00 0.69 -3.45 119.26 122.78 1dnk h ALA 204 Ca -0.48 0.00 -0.44 0.00 0.00 0.00 0.00 54.91 53.99 1dnk h ALA 204 Cb 1.17 0.00 0.16 0.00 0.00 0.00 0.00 17.79 19.12 1dnk h ALA 204 CO 0.58 0.00 0.29 0.95 0.00 0.00 0.00 179.25 181.07 1dnk s THR 205 N -3.20 1.87 0.26 0.00 -4.23 -1.24 -4.89 115.64 104.22 1dnk s THR 205 Ca 0.07 0.00 -0.05 0.00 -1.18 0.00 0.00 61.69 60.53 1dnk s THR 205 Cb 0.09 -2.75 0.21 0.00 1.34 0.00 0.00 72.50 71.39 1dnk s THR 205 CO 0.67 0.00 1.88 0.77 -0.54 0.00 0.00 174.62 177.40 1dnk h SER 206 N -1.88 1.02 -3.14 3.99 4.64 -1.96 -3.44 113.55 112.78 1dnk h SER 206 Ca -0.47 -0.09 -0.58 0.00 -0.47 0.00 0.00 61.79 60.18 1dnk h SER 206 Cb 1.29 -0.26 0.16 0.00 -0.31 0.00 0.00 62.40 63.28 1dnk h SER 206 CO 0.46 0.82 -0.15 0.35 -0.87 0.00 0.00 176.83 177.44 1dnk n THR 207 N -4.34 2.74 -3.41 2.95 -2.24 -1.26 -4.96 114.28 103.77 1dnk n THR 207 Ca 0.08 -0.50 -0.33 0.00 -2.27 0.00 0.00 64.05 61.03 1dnk n THR 207 Cb 0.10 -0.89 -0.06 0.00 -2.10 0.00 0.00 70.33 67.39 1dnk n THR 207 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1dnk n ASN 208 N 0.12 4.51 -4.37 3.42 2.85 -1.26 -4.77 115.26 115.76 1dnk n ASN 208 Ca 0.12 -3.34 -0.29 0.00 -0.11 0.00 0.00 54.58 50.96 1dnk n ASN 208 Cb 0.46 -0.93 -0.13 0.00 1.24 0.00 0.00 39.78 40.42 1dnk n ASN 208 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1dnk n ALA 210 N 1.10 5.30 0.13 0.00 0.00 -1.22 -1.94 120.51 123.89 1dnk n ALA 210 Ca -0.18 -4.78 -0.11 0.00 0.00 0.00 0.00 53.44 48.37 1dnk n ALA 210 Cb 0.53 -2.35 -0.07 0.00 0.00 0.00 0.00 19.45 17.56 1dnk n ALA 210 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 177.50 179.38 1dnk h TYR 211 N 5.30 -0.36 -3.46 0.00 0.05 -1.88 -3.35 116.97 113.27 1dnk h TYR 211 Ca 0.24 -0.01 -0.53 0.00 0.05 0.00 0.00 58.73 58.49 1dnk h TYR 211 Cb 0.58 0.12 -0.01 0.00 1.01 0.00 0.00 36.73 38.43 1dnk h TYR 211 CO 1.06 -0.01 0.42 -0.51 -1.05 0.00 0.00 178.16 178.07 1dnk s ASP 212 N -5.17 7.35 0.12 3.88 1.11 -1.26 -2.46 116.67 120.23 1dnk s ASP 212 Ca -0.12 1.85 -0.01 0.00 0.18 0.00 0.00 52.55 54.44 1dnk s ASP 212 Cb 0.01 -2.58 -0.04 0.00 1.07 0.00 0.00 42.92 41.38 1dnk s ASP 212 CO 0.46 -0.22 0.05 -0.13 1.18 0.00 0.00 175.17 176.51 1dnk s ARG 213 N 0.39 0.88 -0.11 8.23 1.81 -0.15 -4.94 118.95 125.06 1dnk s ARG 213 Ca 0.51 -1.39 -0.02 0.00 -1.72 0.00 0.00 55.73 53.11 1dnk s ARG 213 Cb -0.25 0.24 0.04 0.00 -0.45 0.00 0.00 34.95 34.53 1dnk s ARG 213 CO 0.30 -0.24 0.02 0.42 -0.68 0.00 0.00 175.30 175.12 1dnk s ILE 214 N -4.02 0.38 -0.05 1.52 1.01 -1.26 -1.83 121.20 116.94 1dnk s ILE 214 Ca 0.21 -0.08 0.04 0.00 0.00 0.00 0.00 60.65 60.82 1dnk s ILE 214 Cb 0.07 -0.67 -0.03 0.00 0.01 0.00 0.00 42.46 41.85 1dnk s ILE 214 CO -0.00 0.09 -0.16 -0.69 0.00 0.00 0.00 174.94 174.18 1dnk s VAL 215 N 1.96 2.95 -0.02 2.92 1.01 0.30 -1.86 120.40 127.65 1dnk s VAL 215 Ca 0.03 -0.77 0.02 0.00 0.00 0.00 0.00 61.98 61.26 1dnk s VAL 215 Cb -0.14 -2.14 0.01 0.00 0.00 0.00 0.00 36.38 34.10 1dnk s VAL 215 CO -0.06 0.59 -0.06 0.68 0.00 0.00 0.00 175.10 176.24 1dnk s VAL 216 N -0.71 0.59 0.25 2.92 -7.23 -0.86 0.10 120.40 115.46 1dnk s VAL 216 Ca 0.11 -0.24 0.12 0.00 -1.81 0.00 0.00 61.98 60.15 1dnk s VAL 216 Cb -0.11 -0.54 -0.05 0.00 0.56 0.00 0.00 36.38 36.24 1dnk s VAL 216 CO 0.00 0.20 -0.19 0.00 -0.31 0.00 0.00 175.10 174.80 1dnk s ALA 217 N 0.30 2.74 0.00 1.32 0.00 -0.93 -1.15 121.76 124.05 1dnk s ALA 217 Ca -0.04 -1.79 0.00 0.00 0.00 0.00 0.00 51.96 50.14 1dnk s ALA 217 Cb -0.08 -0.34 0.00 0.00 0.00 0.00 0.00 23.12 22.70 1dnk s ALA 217 CO 0.00 0.32 0.00 0.41 0.00 0.00 0.00 175.76 176.49 1dnk n GLY 218 N -0.40 -2.21 0.19 0.00 0.00 -1.12 -3.00 105.19 98.64 1dnk n GLY 218 Ca -0.07 -1.18 0.08 0.00 0.00 0.00 0.00 46.02 44.85 1dnk n GLY 218 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1dnk h SER 219 N 0.00 0.00 0.53 1.61 4.64 -1.95 -1.23 113.55 117.14 1dnk h SER 219 Ca 0.00 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 61.29 1dnk h SER 219 Cb 0.00 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.10 1dnk h SER 219 CO 0.00 0.24 -0.25 0.25 -0.87 0.00 0.00 176.83 176.20 1dnk h LEU 220 N 0.00 -0.60 0.41 5.97 7.12 -1.97 0.54 115.31 126.78 1dnk h LEU 220 Ca -0.00 -0.05 -0.01 0.00 0.13 0.00 0.00 57.88 57.94 1dnk h LEU 220 Cb 1.11 0.15 -0.02 0.00 -0.53 0.00 0.00 40.66 41.37 1dnk h LEU 220 CO 0.03 -0.22 -0.45 0.25 -0.13 0.00 0.00 178.44 177.92 1dnk h LEU 221 N -1.04 -1.25 -1.13 2.25 6.46 -1.83 -0.50 115.31 118.26 1dnk h LEU 221 Ca -0.07 0.10 0.30 0.00 -0.12 0.00 0.00 57.88 58.09 1dnk h LEU 221 Cb 0.62 0.42 -0.13 0.00 -0.73 0.00 0.00 40.66 40.84 1dnk h LEU 221 CO 0.12 -0.58 0.63 1.56 -0.62 0.00 0.00 178.44 179.55 1dnk h GLN 222 N -0.87 0.39 0.00 1.25 4.20 -1.32 2.71 115.11 121.47 1dnk h GLN 222 Ca -0.05 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.64 1dnk h GLN 222 Cb 0.76 -0.09 0.00 0.00 0.30 0.00 0.00 27.48 28.46 1dnk h GLN 222 CO -0.08 0.26 0.00 -1.13 -0.67 0.00 0.00 178.83 177.21 1dnk n SER 223 N -4.86 0.00 -0.29 1.46 3.41 0.18 -3.19 113.62 110.34 1dnk n SER 223 Ca 0.29 0.46 0.11 0.00 -0.26 0.00 0.00 58.87 59.48 1dnk n SER 223 Cb 0.93 -0.49 0.08 0.00 -0.26 0.00 0.00 64.21 64.47 1dnk n SER 223 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 1dnk n SER 224 N -1.49 1.45 -4.73 4.04 3.41 0.91 -4.89 113.62 112.32 1dnk n SER 224 Ca 0.07 -1.15 -0.41 0.00 -0.26 0.00 0.00 58.87 57.11 1dnk n SER 224 Cb 0.29 0.49 -0.04 0.00 -0.26 0.00 0.00 64.21 64.70 1dnk n SER 224 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1dnk s VAL 225 N -2.64 3.93 -0.37 -3.33 1.01 -0.93 0.64 120.40 118.71 1dnk s VAL 225 Ca 0.17 1.58 -0.22 0.00 0.00 0.00 0.00 61.98 63.51 1dnk s VAL 225 Cb 0.18 -4.01 0.01 0.00 0.00 0.00 0.00 36.38 32.56 1dnk s VAL 225 CO 0.64 0.23 0.74 -0.69 0.00 0.00 0.00 175.10 176.01 1dnk s VAL 226 N 0.11 4.77 0.31 2.92 1.01 -0.31 -4.90 120.40 124.31 1dnk s VAL 226 Ca 0.52 0.73 -0.29 0.00 0.00 0.00 0.00 61.98 62.93 1dnk s VAL 226 Cb -0.29 -4.18 -0.13 0.00 0.00 0.00 0.00 36.38 31.78 1dnk s VAL 226 CO 0.34 -0.43 1.29 -0.81 0.00 0.00 0.00 175.10 175.48 1dnk n PRO 227 N 6.34 2.00 -0.98 2.72 -0.04 -1.26 -2.12 135.00 141.65 1dnk n PRO 227 Ca 0.02 0.70 0.00 0.00 -0.04 0.00 0.00 63.50 64.18 1dnk n PRO 227 Cb 0.48 -2.28 0.00 0.00 -0.04 0.00 0.00 33.50 31.66 1dnk n PRO 227 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1dnk n GLY 228 N 1.21 0.64 0.08 0.55 0.00 -1.26 -4.89 105.19 101.52 1dnk n GLY 228 Ca 0.07 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.02 1dnk n GLY 228 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1dnk n SER 229 N -0.05 0.84 -4.72 1.61 3.41 -0.90 -4.90 113.62 108.91 1dnk n SER 229 Ca 0.00 0.40 -0.41 0.00 -0.26 0.00 0.00 58.87 58.59 1dnk n SER 229 Cb 0.02 0.00 -0.04 0.00 -0.26 0.00 0.00 64.21 63.94 1dnk n SER 229 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1dnk s ALA 230 N -2.64 3.30 -0.13 7.33 0.00 -1.25 -4.31 121.76 124.06 1dnk s ALA 230 Ca -0.05 0.71 -0.34 0.00 0.00 0.00 0.00 51.96 52.29 1dnk s ALA 230 Cb 0.08 -3.35 0.13 0.00 0.00 0.00 0.00 23.12 19.98 1dnk s ALA 230 CO 0.82 -0.23 1.25 0.00 0.00 0.00 0.00 175.76 177.61 1dnk s ALA 231 N 0.40 -2.14 0.71 0.00 0.00 -0.60 -4.94 121.76 115.19 1dnk s ALA 231 Ca 0.52 1.28 -0.14 0.00 0.00 0.00 0.00 51.96 53.62 1dnk s ALA 231 Cb -0.26 0.05 0.03 0.00 0.00 0.00 0.00 23.12 22.93 1dnk s ALA 231 CO 0.31 -0.76 1.13 -2.14 0.00 0.00 0.00 175.76 174.30 1dnk s PRO 232 N -2.40 2.43 -0.31 0.00 0.02 -1.26 -1.53 135.00 131.95 1dnk s PRO 232 Ca 0.11 1.46 0.03 0.00 0.02 0.00 0.00 61.00 62.62 1dnk s PRO 232 Cb 0.01 -1.90 0.08 0.00 0.02 0.00 0.00 34.50 32.71 1dnk s PRO 232 CO -0.04 -1.55 -0.01 0.12 -0.33 0.00 0.00 177.00 175.19 1dnk s PHE 233 N -2.35 3.51 -0.64 6.54 5.36 0.75 -4.86 117.98 126.30 1dnk s PHE 233 Ca 0.68 -2.60 -0.22 0.00 -0.96 0.00 0.00 56.93 53.82 1dnk s PHE 233 Cb -0.22 -2.47 0.07 0.00 -0.34 0.00 0.00 43.02 40.06 1dnk s PHE 233 CO 0.45 -0.91 0.93 0.34 -1.46 0.00 0.00 175.22 174.58 1dnk s ASP 234 N 1.07 6.19 0.35 6.13 2.15 -1.26 -3.81 116.67 127.49 1dnk s ASP 234 Ca 0.01 -0.96 0.18 0.00 0.43 0.00 0.00 52.55 52.22 1dnk s ASP 234 Cb -0.20 -2.41 0.53 0.00 -0.30 0.00 0.00 42.92 40.54 1dnk s ASP 234 CO -0.06 -1.38 1.66 2.19 -0.17 0.00 0.00 175.17 177.40 1dnk h PHE 235 N 9.50 0.00 0.85 -5.34 -5.15 -1.97 -1.01 116.94 113.82 1dnk h PHE 235 Ca -0.29 0.00 -0.04 0.00 -0.20 0.00 0.00 57.97 57.45 1dnk h PHE 235 Cb 1.07 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.24 1dnk h PHE 235 CO 0.95 0.40 -0.48 0.37 -2.00 0.00 0.00 178.31 177.55 1dnk h GLN 236 N 0.00 -1.18 0.34 6.09 4.15 -1.91 0.23 115.11 122.83 1dnk h GLN 236 Ca -0.00 0.08 -0.02 0.00 0.77 0.00 0.00 58.65 59.48 1dnk h GLN 236 Cb 1.03 0.27 0.00 0.00 0.21 0.00 0.00 27.48 28.99 1dnk h GLN 236 CO 0.05 -0.79 -0.16 0.00 -1.93 0.00 0.00 178.83 176.00 1dnk h ALA 237 N -1.27 -0.46 -0.83 3.38 0.00 -1.86 1.09 119.26 119.32 1dnk h ALA 237 Ca -0.11 -0.10 0.11 0.00 0.00 0.00 0.00 54.91 54.80 1dnk h ALA 237 Cb 0.97 0.18 -0.06 0.00 0.00 0.00 0.00 17.79 18.88 1dnk h ALA 237 CO 0.14 -0.75 0.54 0.00 0.00 0.00 0.00 179.25 179.18 1dnk h ALA 238 N 0.20 1.76 -0.33 0.00 0.00 -1.13 -1.64 119.26 118.11 1dnk h ALA 238 Ca -0.05 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.86 1dnk h ALA 238 Cb 0.36 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1dnk h ALA 238 CO 0.08 0.06 0.00 0.66 0.00 0.00 0.00 179.25 180.05 1dnk n TYR 239 N -4.52 0.43 -3.89 0.00 4.01 0.81 -4.97 117.16 109.03 1dnk n TYR 239 Ca 0.14 -0.28 -0.30 0.00 -0.16 0.00 0.00 57.90 57.31 1dnk n TYR 239 Cb 0.35 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.38 1dnk n TYR 239 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1dnk n GLY 240 N 1.13 -0.53 3.94 2.72 0.00 0.33 -4.94 105.19 107.84 1dnk n GLY 240 Ca 0.16 0.27 -0.24 0.00 0.00 0.00 0.00 46.02 46.20 1dnk n GLY 240 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1dnk s LEU 241 N -6.87 3.87 0.35 0.99 1.43 0.13 -5.01 118.68 113.57 1dnk s LEU 241 Ca 0.20 0.47 -0.14 0.00 -1.03 0.00 0.00 54.13 53.64 1dnk s LEU 241 Cb -0.08 -3.35 -0.08 0.00 0.03 0.00 0.00 46.19 42.70 1dnk s LEU 241 CO 0.89 -0.44 0.75 -0.94 0.23 0.00 0.00 176.35 176.85 1dnk s SER 242 N -4.09 6.71 0.29 2.29 1.04 -1.26 -4.78 113.70 113.90 1dnk s SER 242 Ca 0.43 1.25 0.05 0.00 0.48 0.00 0.00 55.95 58.16 1dnk s SER 242 Cb -0.10 -2.36 0.75 0.00 0.10 0.00 0.00 66.02 64.40 1dnk s SER 242 CO 0.38 -0.27 1.71 -1.13 0.98 0.00 0.00 173.24 174.91 1dnk h ASN 243 N 1.96 0.43 -0.61 7.02 -0.73 -1.98 0.22 115.58 121.89 1dnk h ASN 243 Ca -0.48 0.14 -0.09 0.00 1.87 0.00 0.00 56.30 57.75 1dnk h ASN 243 Cb 1.18 0.10 -0.02 0.00 0.27 0.00 0.00 38.32 39.84 1dnk h ASN 243 CO 0.65 0.05 0.03 -0.33 -0.37 0.00 0.00 177.43 177.45 1dnk h GLU 244 N 0.47 1.06 0.05 6.67 3.07 -1.99 -0.30 114.58 123.61 1dnk h GLU 244 Ca 0.57 -0.32 -0.00 0.00 -0.50 0.00 0.00 59.36 59.10 1dnk h GLU 244 Cb 1.06 -0.10 0.00 0.00 -0.84 0.00 0.00 28.75 28.87 1dnk h GLU 244 CO -0.50 1.02 -0.02 1.98 -1.40 0.00 0.00 179.01 180.09 1dnk h MET 245 N 0.96 -0.06 -0.30 2.33 4.05 -1.21 -2.48 114.93 118.22 1dnk h MET 245 Ca 0.18 0.00 0.06 0.00 -0.28 0.00 0.00 59.70 59.66 1dnk h MET 245 Cb 0.53 0.01 -0.08 0.00 -0.80 0.00 0.00 31.60 31.26 1dnk h MET 245 CO 0.03 0.25 -0.39 0.00 0.23 0.00 0.00 176.91 177.03 1dnk h ALA 246 N 0.55 -0.40 -0.01 0.39 0.00 -0.58 -1.15 119.26 118.05 1dnk h ALA 246 Ca -0.01 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1dnk h ALA 246 Cb 0.34 0.78 -0.00 0.00 0.00 0.00 0.00 17.79 18.92 1dnk h ALA 246 CO 0.01 -0.84 0.01 -0.07 0.00 0.00 0.00 179.25 178.36 1dnk h LEU 247 N -0.36 0.00 -1.43 0.00 4.07 -1.07 -1.62 115.31 114.89 1dnk h LEU 247 Ca 0.13 0.00 -0.06 0.00 0.08 0.00 0.00 57.88 58.03 1dnk h LEU 247 Cb 0.58 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 42.31 1dnk h LEU 247 CO -0.49 0.00 -0.29 0.00 -1.08 0.00 0.00 178.44 176.58 1dnk h ALA 248 N 1.99 1.44 0.07 1.53 0.00 -0.72 -2.99 119.26 120.59 1dnk h ALA 248 Ca 0.01 -0.26 -0.14 0.00 0.00 0.00 0.00 54.91 54.51 1dnk h ALA 248 Cb 0.02 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.77 1dnk h ALA 248 CO -0.00 0.36 -0.69 0.82 0.00 0.00 0.00 179.25 179.74 1dnk h ILE 249 N 0.00 1.46 0.00 0.00 2.04 -1.14 -3.50 117.51 116.37 1dnk h ILE 249 Ca -0.00 -2.41 0.00 0.00 1.00 0.00 0.00 64.86 63.45 1dnk h ILE 249 Cb 0.53 3.08 0.00 0.00 -0.74 0.00 0.00 36.82 39.69 1dnk h ILE 249 CO 0.04 0.63 0.00 -0.24 0.00 0.00 0.00 178.15 178.58 1dnk n SER 250 N -4.29 0.00 -0.21 1.72 2.88 -0.80 -4.26 113.62 108.65 1dnk n SER 250 Ca -0.16 0.00 0.14 0.00 -1.33 0.00 0.00 58.87 57.52 1dnk n SER 250 Cb 0.70 0.00 0.61 0.00 -0.75 0.00 0.00 64.21 64.77 1dnk n SER 250 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 1dnk n ASP 251 N 0.00 0.75 -4.41 -3.46 5.75 -1.26 -4.13 116.55 109.79 1dnk n ASP 251 Ca 0.00 -0.94 -0.25 0.00 -0.01 0.00 0.00 54.79 53.60 1dnk n ASP 251 Cb 0.00 -0.01 -0.11 0.00 -1.03 0.00 0.00 41.12 39.97 1dnk n ASP 251 CO 0.00 0.00 0.00 -1.00 -0.11 0.00 0.00 177.20 176.09 1dnk s HIS 252 N -2.28 2.17 0.16 2.11 3.76 -1.26 0.12 115.29 120.07 1dnk s HIS 252 Ca 0.34 -0.38 0.06 0.00 -0.15 0.00 0.00 55.06 54.92 1dnk s HIS 252 Cb 0.20 -1.04 -0.04 0.00 1.11 0.00 0.00 32.58 32.81 1dnk s HIS 252 CO 0.43 0.51 0.08 0.71 -0.85 0.00 0.00 174.74 175.61 1dnk s TYR 253 N -1.99 3.04 0.52 1.40 2.02 0.22 -4.60 117.35 117.95 1dnk s TYR 253 Ca 0.22 -0.05 -0.21 0.00 -0.37 0.00 0.00 57.07 56.65 1dnk s TYR 253 Cb -0.07 -1.47 -0.06 0.00 -0.40 0.00 0.00 41.96 39.96 1dnk s TYR 253 CO 0.10 0.52 1.22 -2.14 -1.57 0.00 0.00 175.55 173.67 1dnk s PRO 254 N -2.95 3.39 -0.07 -1.71 0.02 -1.25 -4.73 135.00 127.71 1dnk s PRO 254 Ca 0.29 1.88 0.01 0.00 0.02 0.00 0.00 61.00 63.20 1dnk s PRO 254 Cb -0.10 -2.22 -0.03 0.00 0.02 0.00 0.00 34.50 32.17 1dnk s PRO 254 CO 0.21 -0.88 -0.08 0.14 -0.33 0.00 0.00 177.00 176.06 1dnk s VAL 255 N -1.52 3.61 0.19 3.83 -7.23 -0.69 -0.18 120.40 118.41 1dnk s VAL 255 Ca 0.70 -0.51 -0.01 0.00 -1.81 0.00 0.00 61.98 60.35 1dnk s VAL 255 Cb -0.31 -2.47 -0.04 0.00 0.56 0.00 0.00 36.38 34.12 1dnk s VAL 255 CO 0.36 0.60 0.11 -1.83 -0.31 0.00 0.00 175.10 174.03 1dnk s GLU 256 N -0.77 1.15 0.26 4.82 -1.05 -0.58 -1.32 118.70 121.20 1dnk s GLU 256 Ca 0.12 -1.59 -0.14 0.00 -0.15 0.00 0.00 54.97 53.21 1dnk s GLU 256 Cb -0.11 0.24 -0.00 0.00 -0.44 0.00 0.00 34.13 33.82 1dnk s GLU 256 CO 0.01 -0.36 0.51 0.54 0.95 0.00 0.00 175.26 176.92 1dnk s VAL 257 N -4.12 0.00 -0.04 1.83 0.11 -0.24 -1.56 120.40 116.39 1dnk s VAL 257 Ca 0.36 -1.36 0.00 0.00 -2.93 0.00 0.00 61.98 58.05 1dnk s VAL 257 Cb 0.07 -2.20 0.03 0.00 -1.53 0.00 0.00 36.38 32.75 1dnk s VAL 257 CO 0.10 0.00 -0.00 -0.89 -3.33 0.00 0.00 175.10 170.97 1dnk s THR 258 N -3.96 0.24 0.10 5.04 2.01 -1.26 -1.86 115.64 115.95 1dnk s THR 258 Ca 0.21 0.08 0.02 0.00 0.31 0.00 0.00 61.69 62.31 1dnk s THR 258 Cb -0.01 -0.34 -0.04 0.00 0.01 0.00 0.00 72.50 72.12 1dnk s THR 258 CO 0.09 0.17 0.19 -0.76 -0.69 0.00 0.00 174.62 173.62 1dnk s LEU 259 N 1.16 4.16 0.00 4.42 1.43 0.78 -1.16 118.68 129.47 1dnk s LEU 259 Ca -0.08 0.13 0.00 0.00 -1.03 0.00 0.00 54.13 53.15 1dnk s LEU 259 Cb -0.13 -2.77 0.00 0.00 0.03 0.00 0.00 46.19 43.31 1dnk s LEU 259 CO -0.02 0.12 0.46 1.07 0.23 0.00 0.00 176.35 178.21