#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2nys s ASP 4 N 0.00 6.13 -0.01 2.61 -1.08 -1.26 -4.93 116.67 118.13 2nys s ASP 4 Ca 0.00 0.13 0.16 0.00 -0.52 0.00 0.00 52.55 52.32 2nys s ASP 4 Cb 0.00 -2.14 -0.22 0.00 -1.46 0.00 0.00 42.92 39.10 2nys s ASP 4 CO 0.00 -0.05 0.48 1.41 0.52 0.00 0.00 175.17 177.54 2nys n HIS 5 N 4.83 0.00 -0.11 -5.34 8.25 -1.26 -4.63 115.22 116.96 2nys n HIS 5 Ca -0.13 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.18 2nys n HIS 5 Cb 0.52 -0.22 -0.13 0.00 1.12 0.00 0.00 29.99 31.27 2nys n HIS 5 CO 0.00 0.00 0.00 -0.89 0.64 0.00 0.00 176.34 176.09 2nys n ILE 6 N -1.78 1.47 -2.97 1.59 5.41 -1.26 -5.07 119.36 116.74 2nys n ILE 6 Ca -0.01 -0.67 -0.13 0.00 1.00 0.00 0.00 62.75 62.94 2nys n ILE 6 Cb 0.35 -1.10 0.01 0.00 -0.71 0.00 0.00 39.64 38.19 2nys n ILE 6 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 176.55 177.09 2nys n ARG 7 N -3.09 -2.34 -0.10 0.38 5.12 -1.26 -4.82 116.66 110.54 2nys n ARG 7 Ca -0.41 2.01 -0.12 0.00 -1.93 0.00 0.00 57.85 57.40 2nys n ARG 7 Cb 1.05 -4.90 -0.04 0.00 -1.16 0.00 0.00 32.46 27.41 2nys n ARG 7 CO 0.00 0.00 0.00 1.88 -1.93 0.00 0.00 177.63 177.58 2nys h TYR 8 N 2.10 0.77 -0.51 -1.55 0.05 -1.99 -3.03 116.97 112.82 2nys h TYR 8 Ca -0.11 -0.20 0.10 0.00 0.05 0.00 0.00 58.73 58.57 2nys h TYR 8 Cb 1.02 -0.18 -0.09 0.00 1.01 0.00 0.00 36.73 38.50 2nys h TYR 8 CO 0.07 0.90 -0.07 0.38 -1.05 0.00 0.00 178.16 178.40 2nys h ASP 9 N 0.42 -0.35 -0.04 3.88 2.03 -1.98 0.81 116.42 121.19 2nys h ASP 9 Ca 0.07 0.14 -0.05 0.00 -0.73 0.00 0.00 57.03 56.45 2nys h ASP 9 Cb 0.71 0.27 -0.01 0.00 -0.83 0.00 0.00 39.33 39.47 2nys h ASP 9 CO 0.05 -0.13 -0.11 0.40 -1.03 0.00 0.00 179.24 178.42 2nys h ILE 10 N 0.05 1.19 -0.10 4.15 5.03 -1.91 0.15 117.51 126.07 2nys h ILE 10 Ca 0.25 -0.83 -0.23 0.00 -0.12 0.00 0.00 64.86 63.93 2nys h ILE 10 Cb 0.39 1.16 0.01 0.00 -3.03 0.00 0.00 36.82 35.36 2nys h ILE 10 CO -0.48 0.26 -0.85 -0.07 -0.68 0.00 0.00 178.15 176.33 2nys h LEU 11 N 0.30 0.87 -0.52 1.44 3.38 -0.57 -2.55 115.31 117.66 2nys h LEU 11 Ca 0.06 -0.61 -0.12 0.00 0.09 0.00 0.00 57.88 57.30 2nys h LEU 11 Cb 0.39 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 2nys h LEU 11 CO 0.02 1.40 -0.16 0.00 0.09 0.00 0.00 178.44 179.79 2nys h ALA 12 N 0.57 0.72 -0.54 1.53 0.00 0.75 -2.34 119.26 119.96 2nys h ALA 12 Ca -0.07 -0.37 -0.04 0.00 0.00 0.00 0.00 54.91 54.43 2nys h ALA 12 Cb 1.48 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 19.06 2nys h ALA 12 CO 0.17 0.68 0.19 1.96 0.00 0.00 0.00 179.25 182.25 2nys h GLN 13 N 0.90 0.82 -0.12 0.00 4.20 -0.99 0.54 115.11 120.46 2nys h GLN 13 Ca 0.13 -0.16 -0.14 0.00 0.06 0.00 0.00 58.65 58.54 2nys h GLN 13 Cb 0.74 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 28.38 2nys h GLN 13 CO 0.06 0.73 -0.52 0.22 -0.67 0.00 0.00 178.83 178.65 2nys h ASP 14 N 0.73 0.37 0.10 1.46 -0.00 -1.45 -0.30 116.42 117.32 2nys h ASP 14 Ca 0.18 -0.19 -0.00 0.00 -0.00 0.00 0.00 57.03 57.01 2nys h ASP 14 Cb 0.24 -0.11 0.00 0.00 -0.00 0.00 0.00 39.33 39.46 2nys h ASP 14 CO -0.01 0.82 -0.05 0.00 -0.00 0.00 0.00 179.24 180.01 2nys h ALA 15 N 1.19 -0.13 -0.55 -0.78 0.00 -1.07 -0.94 119.26 116.98 2nys h ALA 15 Ca 0.01 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.75 2nys h ALA 15 Cb 1.00 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.82 2nys h ALA 15 CO 0.09 -0.47 0.13 -0.07 0.00 0.00 0.00 179.25 178.92 2nys h LEU 16 N -0.33 0.78 -2.05 0.00 3.38 -0.84 0.14 115.31 116.39 2nys h LEU 16 Ca -0.01 -0.14 0.04 0.00 0.09 0.00 0.00 57.88 57.85 2nys h LEU 16 Cb 0.28 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 2nys h LEU 16 CO 0.02 0.77 0.10 -0.09 0.09 0.00 0.00 178.44 179.33 2nys h ARG 17 N 0.81 0.00 0.00 1.13 9.65 -0.81 0.38 114.38 125.53 2nys h ARG 17 Ca 0.18 0.00 -0.02 0.00 -1.10 0.00 0.00 59.98 59.04 2nys h ARG 17 Cb 0.30 0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 28.88 2nys h ARG 17 CO -0.00 0.00 -0.10 0.78 2.80 0.00 0.00 179.97 183.45 2nys h GLY 18 N 0.00 0.00 0.73 2.80 0.00 0.70 -2.81 103.07 104.49 2nys h GLY 18 Ca 0.06 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.31 2nys h GLY 18 CO -0.00 0.00 -0.25 -2.08 0.00 0.00 0.00 176.54 174.21 2nys h VAL 19 N 0.00 1.38 -0.23 4.60 2.07 0.05 -2.78 116.25 121.34 2nys h VAL 19 Ca -0.00 -1.54 0.07 0.00 0.82 0.00 0.00 66.70 66.05 2nys h VAL 19 Cb 0.64 2.09 -0.01 0.00 -1.52 0.00 0.00 31.29 32.49 2nys h VAL 19 CO 0.01 0.45 0.17 0.40 0.02 0.00 0.00 177.57 178.63 2nys h ILE 20 N -0.05 0.82 -0.09 4.57 1.08 -1.31 -0.70 117.51 121.82 2nys h ILE 20 Ca 0.00 0.00 -0.10 0.00 -0.39 0.00 0.00 64.86 64.37 2nys h ILE 20 Cb 0.84 0.88 0.00 0.00 -3.07 0.00 0.00 36.82 35.47 2nys h ILE 20 CO 0.05 0.00 -0.34 0.03 -0.69 0.00 0.00 178.15 177.21 2nys h ARG 21 N 0.00 0.40 -0.00 2.37 3.08 -1.31 -0.87 114.38 118.04 2nys h ARG 21 Ca 0.11 -0.30 -0.18 0.00 0.07 0.00 0.00 59.98 59.68 2nys h ARG 21 Cb 0.46 0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.55 2nys h ARG 21 CO -0.00 0.93 -0.80 1.57 -1.07 0.00 0.00 179.97 180.59 2nys h LYS 22 N -0.05 0.11 0.41 0.04 2.10 -1.15 0.33 116.57 118.35 2nys h LYS 22 Ca -0.02 -0.11 -0.02 0.00 -2.00 0.00 0.00 60.65 58.50 2nys h LYS 22 Cb 0.97 0.03 0.00 0.00 -0.90 0.00 0.00 32.23 32.34 2nys h LYS 22 CO 0.07 0.85 -0.20 0.28 -2.00 0.00 0.00 179.45 178.46 2nys h VAL 23 N 0.06 0.37 -0.47 0.07 2.07 -1.20 0.65 116.25 117.80 2nys h VAL 23 Ca -0.02 -0.62 0.03 0.00 0.82 0.00 0.00 66.70 66.91 2nys h VAL 23 Cb 1.41 0.57 -0.03 0.00 -1.52 0.00 0.00 31.29 31.72 2nys h VAL 23 CO 0.11 0.08 0.31 -0.07 0.02 0.00 0.00 177.57 178.02 2nys h LEU 24 N -1.00 0.46 -0.90 2.57 3.38 -1.20 -1.35 115.31 117.27 2nys h LEU 24 Ca -0.06 -0.01 -0.11 0.00 0.09 0.00 0.00 57.88 57.80 2nys h LEU 24 Cb 0.54 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.17 2nys h LEU 24 CO 0.09 0.32 -0.39 1.23 0.09 0.00 0.00 178.44 179.78 2nys h GLY 25 N 0.54 0.34 1.34 0.83 0.00 -0.25 -1.03 103.07 104.84 2nys h GLY 25 Ca 0.19 -0.32 -0.15 0.00 0.00 0.00 0.00 47.33 47.05 2nys h GLY 25 CO -0.05 0.29 -0.42 1.05 0.00 0.00 0.00 176.54 177.41 2nys h GLU 26 N 0.27 0.72 -0.22 4.80 9.09 0.26 -2.46 114.58 127.03 2nys h GLU 26 Ca 0.03 -0.38 -0.13 0.00 0.05 0.00 0.00 59.36 58.93 2nys h GLU 26 Cb 0.81 0.02 -0.00 0.00 -1.65 0.00 0.00 28.75 27.93 2nys h GLU 26 CO 0.06 1.00 -0.36 0.28 0.05 0.00 0.00 179.01 180.05 2nys h VAL 27 N 0.58 1.32 -0.41 -1.06 2.07 -1.27 -2.78 116.25 114.71 2nys h VAL 27 Ca 0.04 -1.57 0.06 0.00 0.82 0.00 0.00 66.70 66.06 2nys h VAL 27 Cb 0.97 1.79 -0.02 0.00 -1.52 0.00 0.00 31.29 32.51 2nys h VAL 27 CO 0.09 0.49 0.28 0.00 0.02 0.00 0.00 177.57 178.44 2nys h ALA 28 N 0.63 2.01 0.16 1.67 0.00 -1.14 0.40 119.26 122.99 2nys h ALA 28 Ca 0.02 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 2nys h ALA 28 Cb 0.95 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.67 2nys h ALA 28 CO 0.08 -0.09 -0.08 0.00 0.00 0.00 0.00 179.25 179.17 2nys h ALA 29 N 1.78 -1.00 0.53 0.00 0.00 -1.17 -3.36 119.26 116.04 2nys h ALA 29 Ca 0.18 -0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 2nys h ALA 29 Cb 0.34 0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.22 2nys h ALA 29 CO -0.04 -0.99 -0.25 1.79 0.00 0.00 0.00 179.25 179.76 2nys h THR 30 N -0.23 0.00 0.00 0.00 1.35 -1.35 -3.48 112.91 109.21 2nys h THR 30 Ca -0.02 -0.15 0.00 0.00 -0.55 0.00 0.00 66.41 65.69 2nys h THR 30 Cb 0.17 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 66.59 2nys h THR 30 CO 0.04 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.92 2nys n GLY 31 N -0.72 1.21 2.90 5.82 0.00 0.14 -5.11 105.19 109.43 2nys n GLY 31 Ca -0.09 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.81 2nys n GLY 31 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2nys s ARG 32 N 0.00 0.05 0.30 1.61 1.70 -1.25 -5.02 118.95 116.33 2nys s ARG 32 Ca 0.00 -0.01 -0.29 0.00 -0.47 0.00 0.00 55.73 54.96 2nys s ARG 32 Cb 0.00 0.02 -0.10 0.00 -0.57 0.00 0.00 34.95 34.30 2nys s ARG 32 CO 0.00 -0.01 1.15 -0.51 -1.08 0.00 0.00 175.30 174.86 2nys s LEU 33 N -0.09 4.51 0.25 -1.89 2.01 -1.26 -4.82 118.68 117.38 2nys s LEU 33 Ca -0.01 2.38 -0.24 0.00 0.01 0.00 0.00 54.13 56.27 2nys s LEU 33 Cb -0.01 -3.64 -0.09 0.00 0.01 0.00 0.00 46.19 42.46 2nys s LEU 33 CO -0.00 -0.26 0.83 -2.16 1.01 0.00 0.00 176.35 175.78 2nys s PRO 34 N -1.56 4.49 5.30 1.29 0.04 -1.26 -4.84 135.00 138.47 2nys s PRO 34 Ca 0.46 1.15 0.00 0.00 0.04 0.00 0.00 61.00 62.65 2nys s PRO 34 Cb -0.34 -2.97 0.00 0.00 0.04 0.00 0.00 34.50 31.23 2nys s PRO 34 CO 0.44 0.40 0.00 0.41 0.04 0.00 0.00 177.00 178.29 2nys n GLY 35 N 0.92 3.09 1.31 0.56 0.00 -1.26 -1.49 105.19 108.32 2nys n GLY 35 Ca -0.01 -0.14 0.09 0.00 0.00 0.00 0.00 46.02 45.95 2nys n GLY 35 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2nys n ASP 36 N 2.82 3.84 -4.75 1.61 8.00 -1.26 -4.98 116.55 121.83 2nys n ASP 36 Ca 0.00 -2.23 -0.41 0.00 0.71 0.00 0.00 54.79 52.86 2nys n ASP 36 Cb 0.00 -0.49 -0.03 0.00 -0.02 0.00 0.00 41.12 40.58 2nys n ASP 36 CO 0.00 0.00 0.00 -1.00 -0.39 0.00 0.00 177.20 175.81 2nys s HIS 37 N -1.55 3.18 -0.06 1.24 3.76 -0.56 -4.61 115.29 116.69 2nys s HIS 37 Ca 0.43 1.27 -0.24 0.00 -0.15 0.00 0.00 55.06 56.37 2nys s HIS 37 Cb 0.26 -3.64 0.05 0.00 1.11 0.00 0.00 32.58 30.36 2nys s HIS 37 CO 0.24 -1.93 0.54 -3.38 -0.85 0.00 0.00 174.74 169.37 2nys s HIS 38 N -0.35 -0.49 -0.05 1.40 -3.43 -1.26 -4.61 115.29 106.49 2nys s HIS 38 Ca 0.54 0.88 0.05 0.00 -0.80 0.00 0.00 55.06 55.73 2nys s HIS 38 Cb -0.38 0.28 -0.02 0.00 -1.43 0.00 0.00 32.58 31.03 2nys s HIS 38 CO 0.43 -0.50 -0.19 -0.06 -2.00 0.00 0.00 174.74 172.42 2nys s PHE 39 N -1.07 2.58 -0.38 0.38 0.08 -0.80 -4.18 117.98 114.59 2nys s PHE 39 Ca -0.11 -0.37 -0.12 0.00 0.12 0.00 0.00 56.93 56.46 2nys s PHE 39 Cb -0.02 -1.61 0.03 0.00 -0.57 0.00 0.00 43.02 40.84 2nys s PHE 39 CO 0.07 0.03 0.23 -0.06 -0.10 0.00 0.00 175.22 175.38 2nys s PHE 40 N -0.50 3.25 -0.24 0.36 0.40 0.20 -1.09 117.98 120.36 2nys s PHE 40 Ca 0.06 -0.90 -0.03 0.00 -0.60 0.00 0.00 56.93 55.46 2nys s PHE 40 Cb -0.11 -2.48 0.01 0.00 0.51 0.00 0.00 43.02 40.94 2nys s PHE 40 CO 0.01 -0.64 -0.04 0.42 0.70 0.00 0.00 175.22 175.67 2nys s ILE 41 N 1.58 3.23 -0.20 0.64 1.01 -0.24 -0.53 121.20 126.70 2nys s ILE 41 Ca 0.03 -0.73 -0.07 0.00 0.00 0.00 0.00 60.65 59.87 2nys s ILE 41 Cb -0.19 -2.56 -0.03 0.00 0.01 0.00 0.00 42.46 39.68 2nys s ILE 41 CO 0.07 0.29 0.05 -0.89 0.00 0.00 0.00 174.94 174.46 2nys s THR 42 N 1.42 4.43 0.32 2.92 2.01 0.01 -0.66 115.64 126.09 2nys s THR 42 Ca 0.03 -0.15 0.04 0.00 0.31 0.00 0.00 61.69 61.93 2nys s THR 42 Cb -0.16 -3.02 -0.03 0.00 0.01 0.00 0.00 72.50 69.30 2nys s THR 42 CO -0.03 0.42 0.19 0.72 -0.69 0.00 0.00 174.62 175.23 2nys s PHE 43 N 0.86 1.63 -0.37 4.92 -0.71 -1.26 0.49 117.98 123.55 2nys s PHE 43 Ca 0.03 -1.46 -0.18 0.00 -1.04 0.00 0.00 56.93 54.28 2nys s PHE 43 Cb -0.14 -0.82 0.00 0.00 -1.21 0.00 0.00 43.02 40.85 2nys s PHE 43 CO 0.02 -0.62 0.49 -0.51 -1.34 0.00 0.00 175.22 173.26 2nys s LEU 44 N -3.38 4.44 0.58 -1.99 1.43 -0.87 -4.31 118.68 114.58 2nys s LEU 44 Ca 0.36 -0.17 0.37 0.00 -1.03 0.00 0.00 54.13 53.65 2nys s LEU 44 Cb 0.04 -2.53 1.66 0.00 0.03 0.00 0.00 46.19 45.38 2nys s LEU 44 CO 0.20 -0.50 2.09 0.71 0.23 0.00 0.00 176.35 179.08 2nys h THR 45 N 5.64 0.01 0.10 5.49 1.35 -0.50 -3.02 112.91 121.98 2nys h THR 45 Ca -0.28 -0.38 -0.30 0.00 -0.55 0.00 0.00 66.41 64.90 2nys h THR 45 Cb 1.12 1.38 -0.01 0.00 -1.73 0.00 0.00 68.15 68.90 2nys h THR 45 CO 0.77 0.00 -1.56 1.23 -0.25 0.00 0.00 175.52 175.72 2nys h GLY 46 N 1.49 0.24 -3.41 5.82 0.00 -1.85 -3.47 103.07 101.89 2nys h GLY 46 Ca -0.00 -0.61 -0.59 0.00 0.00 0.00 0.00 47.33 46.13 2nys h GLY 46 CO 0.00 0.53 -0.70 0.00 0.00 0.00 0.00 176.54 176.38 2nys n ALA 47 N -2.66 -1.95 -1.77 3.60 0.00 -1.14 -4.90 120.51 111.68 2nys n ALA 47 Ca -0.17 -0.06 -0.37 0.00 0.00 0.00 0.00 53.44 52.85 2nys n ALA 47 Cb 1.04 -1.66 -0.00 0.00 0.00 0.00 0.00 19.45 18.82 2nys n ALA 47 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2nys s PRO 48 N -1.74 3.58 0.00 0.00 0.04 -1.26 -3.11 135.00 132.51 2nys s PRO 48 Ca 0.64 1.79 0.00 0.00 0.04 0.00 0.00 61.00 63.47 2nys s PRO 48 Cb -0.45 -2.29 0.00 0.00 0.04 0.00 0.00 34.50 31.79 2nys s PRO 48 CO 0.59 -0.70 0.00 0.41 0.04 0.00 0.00 177.00 177.34 2nys n GLY 49 N 0.42 2.04 3.70 0.56 0.00 -1.26 -4.82 105.19 105.83 2nys n GLY 49 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.68 2nys n GLY 49 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2nys s VAL 50 N -2.35 4.46 -0.37 1.61 1.01 -1.18 -4.47 120.40 119.10 2nys s VAL 50 Ca 0.00 1.76 0.03 0.00 0.00 0.00 0.00 61.98 63.77 2nys s VAL 50 Cb 0.00 -4.13 0.11 0.00 0.00 0.00 0.00 36.38 32.36 2nys s VAL 50 CO 0.00 0.06 0.11 -0.13 0.00 0.00 0.00 175.10 175.13 2nys s ARG 51 N 1.67 1.45 0.11 2.72 3.00 -0.33 -4.96 118.95 122.60 2nys s ARG 51 Ca 0.54 -1.91 0.04 0.00 0.00 0.00 0.00 55.73 54.41 2nys s ARG 51 Cb -0.23 -3.00 -0.04 0.00 0.00 0.00 0.00 34.95 31.68 2nys s ARG 51 CO 0.24 -0.99 -0.11 0.96 0.00 0.00 0.00 175.30 175.40 2nys s ILE 52 N 0.76 1.08 0.75 1.52 -4.36 -1.26 -1.80 121.20 117.88 2nys s ILE 52 Ca 0.12 -1.73 -0.11 0.00 -0.26 0.00 0.00 60.65 58.68 2nys s ILE 52 Cb -0.20 -1.48 0.05 0.00 1.25 0.00 0.00 42.46 42.07 2nys s ILE 52 CO -0.09 -0.55 1.09 -0.94 0.24 0.00 0.00 174.94 174.69 2nys s SER 53 N -2.57 4.67 0.41 4.36 1.04 -1.26 -4.78 113.70 115.57 2nys s SER 53 Ca 0.08 1.80 0.09 0.00 0.48 0.00 0.00 55.95 58.40 2nys s SER 53 Cb -0.02 -2.52 0.88 0.00 0.10 0.00 0.00 66.02 64.46 2nys s SER 53 CO 0.01 -1.92 2.02 0.06 0.98 0.00 0.00 173.24 174.38 2nys h GLN 54 N -1.00 0.54 0.20 4.02 -0.00 -2.01 0.11 115.11 116.96 2nys h GLN 54 Ca -0.44 -0.03 0.01 0.00 -0.00 0.00 0.00 58.65 58.19 2nys h GLN 54 Cb 1.23 -0.12 -0.04 0.00 -0.00 0.00 0.00 27.48 28.55 2nys h GLN 54 CO 0.52 0.36 -0.40 1.25 -0.00 0.00 0.00 178.83 180.56 2nys h HIS 55 N 0.56 -1.12 -0.18 0.06 -0.00 -1.99 -1.49 115.15 110.99 2nys h HIS 55 Ca 0.21 0.02 -0.20 0.00 -0.00 0.00 0.00 60.37 60.41 2nys h HIS 55 Cb 0.15 0.46 0.00 0.00 -0.00 0.00 0.00 27.41 28.03 2nys h HIS 55 CO -0.00 -0.52 -0.68 -0.07 -0.00 0.00 0.00 177.93 176.66 2nys h LEU 56 N -0.69 0.83 -1.83 0.26 3.38 -1.72 -1.86 115.31 113.68 2nys h LEU 56 Ca 0.01 -0.51 -0.03 0.00 0.09 0.00 0.00 57.88 57.44 2nys h LEU 56 Cb 0.68 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 41.19 2nys h LEU 56 CO -0.19 1.29 -0.14 0.50 0.09 0.00 0.00 178.44 179.99 2nys h LYS 57 N 0.51 0.00 0.09 1.13 3.11 -0.74 0.10 116.57 120.77 2nys h LYS 57 Ca -0.02 0.00 -0.32 0.00 -2.81 0.00 0.00 60.65 57.49 2nys h LYS 57 Cb 1.29 0.00 -0.02 0.00 -1.00 0.00 0.00 32.23 32.50 2nys h LYS 57 CO 0.14 0.14 -1.73 0.77 -2.81 0.00 0.00 179.45 175.96 2nys h SER 58 N 0.00 0.30 0.57 4.20 0.02 -1.23 -3.32 113.55 114.10 2nys h SER 58 Ca -0.00 -0.54 -0.08 0.00 -0.84 0.00 0.00 61.79 60.32 2nys h SER 58 Cb 0.35 -0.10 -0.01 0.00 0.14 0.00 0.00 62.40 62.78 2nys h SER 58 CO 0.02 1.47 -0.40 0.50 -1.14 0.00 0.00 176.83 177.28 2nys h LYS 59 N 0.05 0.00 -4.50 3.45 3.64 -0.93 -3.40 116.57 114.88 2nys h LYS 59 Ca -0.31 0.00 -0.58 0.00 -1.27 0.00 0.00 60.65 58.48 2nys h LYS 59 Cb 2.02 0.00 -0.37 0.00 -0.41 0.00 0.00 32.23 33.48 2nys h LYS 59 CO 0.12 0.40 -0.82 0.71 -2.27 0.00 0.00 179.45 177.59 2nys s TYR 60 N -3.88 2.02 0.00 1.91 1.51 0.32 -5.08 117.35 114.16 2nys s TYR 60 Ca -0.02 -1.18 -0.01 0.00 -1.01 0.00 0.00 57.07 54.85 2nys s TYR 60 Cb 0.13 -1.50 -0.01 0.00 -0.11 0.00 0.00 41.96 40.47 2nys s TYR 60 CO 0.71 -0.65 1.02 0.00 -1.11 0.00 0.00 175.55 175.52 2nys h ALA 61 N 8.07 -0.93 0.00 3.71 0.00 -1.80 -3.41 119.26 124.90 2nys h ALA 61 Ca -0.33 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.57 2nys h ALA 61 Cb 1.12 0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.02 2nys h ALA 61 CO 0.48 -0.93 -0.48 0.39 0.00 0.00 0.00 179.25 178.71 2nys n GLU 62 N -2.23 0.56 -3.37 0.00 1.02 -1.26 -4.73 120.64 110.63 2nys n GLU 62 Ca -0.01 0.00 -0.20 0.00 -0.02 0.00 0.00 57.16 56.93 2nys n GLU 62 Cb 0.02 -0.74 -0.01 0.00 -0.02 0.00 0.00 31.44 30.69 2nys n GLU 62 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 2nys n GLN 63 N -1.76 0.94 -3.68 3.49 6.02 -1.26 0.27 117.38 121.40 2nys n GLN 63 Ca 0.00 -2.56 -0.13 0.00 -0.01 0.00 0.00 57.00 54.30 2nys n GLN 63 Cb 0.24 0.37 -0.13 0.00 1.02 0.00 0.00 30.24 31.74 2nys n GLN 63 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 2nys s THR 65 N -2.07 -0.29 0.17 5.09 2.01 -1.26 -4.83 115.64 114.46 2nys s THR 65 Ca 0.18 0.22 0.06 0.00 0.31 0.00 0.00 61.69 62.46 2nys s THR 65 Cb -0.01 -0.45 -0.04 0.00 0.01 0.00 0.00 72.50 72.01 2nys s THR 65 CO 0.11 0.09 0.07 0.27 -0.69 0.00 0.00 174.62 174.48 2nys s ILE 66 N 2.03 4.13 -0.14 1.82 -4.36 0.16 -4.92 121.20 119.92 2nys s ILE 66 Ca -0.03 -1.25 0.01 0.00 -0.26 0.00 0.00 60.65 59.12 2nys s ILE 66 Cb -0.11 -3.10 0.02 0.00 1.25 0.00 0.00 42.46 40.52 2nys s ILE 66 CO -0.09 -0.11 -0.16 -0.69 0.24 0.00 0.00 174.94 174.13 2nys s VAL 67 N -1.75 1.64 -0.42 8.37 1.01 -1.26 -1.07 120.40 126.92 2nys s VAL 67 Ca 0.29 -0.69 -0.13 0.00 0.00 0.00 0.00 61.98 61.45 2nys s VAL 67 Cb -0.10 -1.52 0.04 0.00 0.00 0.00 0.00 36.38 34.81 2nys s VAL 67 CO 0.21 0.47 0.29 -0.63 0.00 0.00 0.00 175.10 175.45 2nys s ILE 68 N 1.32 4.97 0.00 2.22 1.01 -0.25 -4.85 121.20 125.63 2nys s ILE 68 Ca 0.02 -0.88 0.00 0.00 0.00 0.00 0.00 60.65 59.79 2nys s ILE 68 Cb -0.13 -3.84 0.00 0.00 0.01 0.00 0.00 42.46 38.49 2nys s ILE 68 CO -0.09 -0.37 0.00 1.67 0.00 0.00 0.00 174.94 176.15 2nys n GLN 69 N 5.10 0.00 -0.11 2.79 7.27 -1.26 -1.90 117.38 129.27 2nys n GLN 69 Ca -0.11 0.00 -0.22 0.00 0.07 0.00 0.00 57.00 56.73 2nys n GLN 69 Cb 0.46 0.00 -0.08 0.00 2.41 0.00 0.00 30.24 33.03 2nys n GLN 69 CO 0.00 0.00 0.00 0.72 0.07 0.00 0.00 177.06 177.85 2nys n HIS 70 N -2.46 0.00 -3.74 3.69 8.25 -1.26 -4.88 115.22 114.82 2nys n HIS 70 Ca 0.00 0.00 -0.35 0.00 -0.26 0.00 0.00 57.72 57.11 2nys n HIS 70 Cb 0.00 -0.76 -0.09 0.00 1.12 0.00 0.00 29.99 30.26 2nys n HIS 70 CO 0.00 0.00 0.00 -0.65 0.64 0.00 0.00 176.34 176.33 2nys s GLN 71 N -2.39 2.69 0.06 -0.41 -0.21 -1.26 -5.03 119.66 113.11 2nys s GLN 71 Ca -0.29 -2.82 0.04 0.00 0.02 0.00 0.00 55.36 52.30 2nys s GLN 71 Cb 0.11 -3.72 -0.03 0.00 1.00 0.00 0.00 33.01 30.37 2nys s GLN 71 CO 0.37 -1.20 -0.11 -0.59 -2.12 0.00 0.00 175.29 171.64 2nys s PHE 72 N -0.56 0.98 0.09 0.91 -0.71 -1.26 -4.30 117.98 113.12 2nys s PHE 72 Ca 0.20 -0.51 -0.09 0.00 -1.04 0.00 0.00 56.93 55.50 2nys s PHE 72 Cb -0.16 -0.56 0.00 0.00 -1.21 0.00 0.00 43.02 41.09 2nys s PHE 72 CO -0.07 -0.01 0.20 1.67 -1.34 0.00 0.00 175.22 175.68 2nys s TRP 73 N -1.49 0.12 0.37 3.49 1.48 0.08 -4.97 118.94 118.01 2nys s TRP 73 Ca -0.04 -0.54 0.00 0.00 -1.06 0.00 0.00 56.10 54.46 2nys s TRP 73 Cb -0.09 -0.04 0.00 0.00 -1.16 0.00 0.00 33.47 32.19 2nys s TRP 73 CO 0.01 -0.55 0.00 -0.25 -4.06 0.00 0.00 176.95 172.10 2nys n ASP 74 N -0.04 -7.15 0.00 -2.66 9.92 -1.26 -0.99 116.55 114.37 2nys n ASP 74 Ca -0.15 1.16 0.00 0.00 -0.53 0.00 0.00 54.79 55.26 2nys n ASP 74 Cb 0.62 -4.38 0.00 0.00 -0.64 0.00 0.00 41.12 36.72 2nys n ASP 74 CO 0.00 0.00 0.00 1.17 0.13 0.00 0.00 177.20 178.50 2nys n LYS 76 N -0.23 0.00 -3.22 -1.24 4.81 -0.50 -4.45 118.16 113.33 2nys n LYS 76 Ca 0.00 0.00 -0.39 0.00 -0.87 0.00 0.00 58.31 57.05 2nys n LYS 76 Cb 0.00 0.00 -0.06 0.00 0.02 0.00 0.00 35.03 34.99 2nys n LYS 76 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 2nys s VAL 77 N 0.00 5.08 0.00 3.15 1.01 -1.26 -0.52 120.40 127.86 2nys s VAL 77 Ca 0.00 1.15 0.00 0.00 0.00 0.00 0.00 61.98 63.13 2nys s VAL 77 Cb 0.00 -3.90 0.00 0.00 0.00 0.00 0.00 36.38 32.48 2nys s VAL 77 CO 0.00 0.34 0.00 1.07 0.00 0.00 0.00 175.10 176.51 2nys n THR 78 N 3.39 0.00 0.03 3.92 5.66 -0.20 -5.00 114.28 122.09 2nys n THR 78 Ca -0.06 0.00 -0.21 0.00 -3.05 0.00 0.00 64.05 60.73 2nys n THR 78 Cb 0.51 -0.08 -0.14 0.00 -1.55 0.00 0.00 70.33 69.07 2nys n THR 78 CO 0.00 0.00 0.00 1.05 -3.05 0.00 0.00 175.07 173.07 2nys h GLU 79 N 0.00 0.27 -0.14 1.09 9.09 -2.02 -3.38 114.58 119.49 2nys h GLU 79 Ca 0.00 -0.46 -0.18 0.00 0.05 0.00 0.00 59.36 58.76 2nys h GLU 79 Cb 0.00 0.17 0.01 0.00 -1.65 0.00 0.00 28.75 27.28 2nys h GLU 79 CO 0.00 1.22 -0.63 0.00 0.05 0.00 0.00 179.01 179.66 2nys h THR 80 N -0.34 1.32 0.00 -1.06 1.03 -1.97 -3.48 112.91 108.41 2nys h THR 80 Ca -0.23 -1.88 0.00 0.00 -0.01 0.00 0.00 66.41 64.29 2nys h THR 80 Cb 1.70 2.06 0.00 0.00 -1.07 0.00 0.00 68.15 70.85 2nys h THR 80 CO 0.10 0.58 0.00 0.61 -0.01 0.00 0.00 175.52 176.81 2nys n GLY 81 N 0.68 2.17 3.43 2.99 0.00 -1.26 -1.27 105.19 111.92 2nys n GLY 81 Ca -0.08 0.07 -0.10 0.00 0.00 0.00 0.00 46.02 45.92 2nys n GLY 81 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2nys s PHE 82 N 0.98 0.39 -0.01 1.61 -0.71 0.79 -1.03 117.98 119.99 2nys s PHE 82 Ca 0.00 -0.74 0.06 0.00 -1.04 0.00 0.00 56.93 55.21 2nys s PHE 82 Cb 0.00 0.03 -0.01 0.00 -1.21 0.00 0.00 43.02 41.83 2nys s PHE 82 CO 0.00 -0.83 -0.19 -1.21 -1.34 0.00 0.00 175.22 171.66 2nys s GLU 83 N -3.99 1.51 0.01 1.99 2.02 0.32 0.11 118.70 120.68 2nys s GLU 83 Ca 0.20 -0.67 -0.07 0.00 0.02 0.00 0.00 54.97 54.44 2nys s GLU 83 Cb 0.02 -1.46 -0.00 0.00 0.10 0.00 0.00 34.13 32.78 2nys s GLU 83 CO 0.04 0.40 0.14 -1.50 0.02 0.00 0.00 175.26 174.36 2nys s ILE 84 N -0.44 0.10 -0.17 -1.63 1.10 0.50 -1.40 121.20 119.26 2nys s ILE 84 Ca 0.07 -0.80 0.01 0.00 -0.51 0.00 0.00 60.65 59.43 2nys s ILE 84 Cb -0.07 -0.59 0.01 0.00 0.15 0.00 0.00 42.46 41.96 2nys s ILE 84 CO -0.01 -0.44 -0.19 -0.83 -2.11 0.00 0.00 174.94 171.36 2nys s GLY 85 N -1.63 1.40 0.30 1.50 0.00 -0.16 0.13 107.32 108.86 2nys s GLY 85 Ca -0.12 -1.15 0.03 0.00 0.00 0.00 0.00 44.72 43.48 2nys s GLY 85 CO -0.00 0.15 0.15 1.08 0.00 0.00 0.00 173.10 174.48 2nys s LEU 86 N 1.08 1.66 -0.10 0.66 2.01 -0.98 -0.75 118.68 122.26 2nys s LEU 86 Ca -0.00 -1.53 0.03 0.00 0.01 0.00 0.00 54.13 52.63 2nys s LEU 86 Cb -0.14 0.18 -0.01 0.00 0.01 0.00 0.00 46.19 46.23 2nys s LEU 86 CO -0.07 -0.87 -0.19 -0.94 1.01 0.00 0.00 176.35 175.29 2nys s SER 87 N -3.36 3.52 -0.22 2.29 1.04 -1.26 0.41 113.70 116.12 2nys s SER 87 Ca 0.36 -0.44 0.02 0.00 0.48 0.00 0.00 55.95 56.37 2nys s SER 87 Cb 0.05 -1.37 0.04 0.00 0.10 0.00 0.00 66.02 64.85 2nys s SER 87 CO 0.17 0.19 -0.13 -0.36 0.98 0.00 0.00 173.24 174.08 2nys s PHE 88 N 0.19 2.86 -1.50 5.02 0.08 -1.04 -4.71 117.98 118.88 2nys s PHE 88 Ca -0.11 -1.90 -0.11 0.00 0.12 0.00 0.00 56.93 54.93 2nys s PHE 88 Cb -0.16 -1.84 0.07 0.00 -0.57 0.00 0.00 43.02 40.52 2nys s PHE 88 CO 0.06 -0.82 0.87 -1.13 -0.10 0.00 0.00 175.22 174.11 2nys n SER 89 N 4.57 -3.63 0.00 1.36 3.41 -1.26 -2.23 113.62 115.84 2nys n SER 89 Ca -0.16 -0.83 0.00 0.00 -0.26 0.00 0.00 58.87 57.62 2nys n SER 89 Cb 0.46 -3.74 0.00 0.00 -0.26 0.00 0.00 64.21 60.67 2nys n SER 89 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2nys n ASP 90 N -2.87 -1.35 -4.33 4.04 8.00 -1.26 -5.01 116.55 113.77 2nys n ASP 90 Ca -0.05 0.00 -0.37 0.00 0.71 0.00 0.00 54.79 55.09 2nys n ASP 90 Cb 0.56 -0.98 -0.13 0.00 -0.02 0.00 0.00 41.12 40.56 2nys n ASP 90 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 2nys s THR 91 N -2.61 3.81 0.53 -3.53 -1.32 -0.95 -5.08 115.64 106.49 2nys s THR 91 Ca 0.00 -0.73 -0.21 0.00 -1.21 0.00 0.00 61.69 59.54 2nys s THR 91 Cb 0.00 -2.96 -0.07 0.00 -1.51 0.00 0.00 72.50 67.97 2nys s THR 91 CO 0.00 0.10 1.07 -2.65 -2.21 0.00 0.00 174.62 170.93 2nys n PRO 92 N 4.84 1.25 -4.12 7.08 -0.02 -1.26 -2.49 135.00 140.28 2nys n PRO 92 Ca -0.15 0.46 -0.12 0.00 -2.02 0.00 0.00 63.50 61.67 2nys n PRO 92 Cb 0.48 -2.22 -0.11 0.00 -0.02 0.00 0.00 33.50 31.63 2nys n PRO 92 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 2nys s GLU 93 N -2.53 0.68 -0.10 -0.52 0.41 0.17 -4.89 118.70 111.92 2nys s GLU 93 Ca 0.70 -1.02 0.03 0.00 -0.41 0.00 0.00 54.97 54.27 2nys s GLU 93 Cb -0.46 -0.28 0.01 0.00 -1.78 0.00 0.00 34.13 31.61 2nys s GLU 93 CO 0.51 0.03 -0.21 0.21 -0.49 0.00 0.00 175.26 175.31 2nys s LYS 94 N -2.58 2.69 -0.04 1.61 2.47 -1.26 -2.31 119.74 120.33 2nys s LYS 94 Ca 0.00 -0.75 0.05 0.00 -1.56 0.00 0.00 55.97 53.70 2nys s LYS 94 Cb -0.03 -2.09 -0.00 0.00 -1.46 0.00 0.00 37.83 34.24 2nys s LYS 94 CO -0.02 0.10 -0.18 -0.51 0.16 0.00 0.00 175.35 174.90 2nys s LEU 95 N 0.52 1.95 -0.27 5.43 1.43 0.12 -4.56 118.68 123.30 2nys s LEU 95 Ca -0.16 -0.38 -0.01 0.00 -1.03 0.00 0.00 54.13 52.56 2nys s LEU 95 Cb -0.17 -1.03 0.04 0.00 0.03 0.00 0.00 46.19 45.06 2nys s LEU 95 CO 0.06 0.17 -0.05 -0.69 0.23 0.00 0.00 176.35 176.07 2nys s VAL 96 N -0.02 2.79 -0.25 -1.59 1.01 -0.75 -0.37 120.40 121.23 2nys s VAL 96 Ca -0.03 -1.25 0.01 0.00 0.00 0.00 0.00 61.98 60.71 2nys s VAL 96 Cb -0.12 -2.52 0.05 0.00 0.00 0.00 0.00 36.38 33.79 2nys s VAL 96 CO 0.02 0.06 -0.10 -0.63 0.00 0.00 0.00 175.10 174.46 2nys s ILE 97 N 1.26 2.42 0.23 2.22 -1.09 0.12 -1.19 121.20 125.17 2nys s ILE 97 Ca -0.03 -1.38 -0.30 0.00 -2.23 0.00 0.00 60.65 56.72 2nys s ILE 97 Cb -0.18 -2.33 -0.09 0.00 -1.58 0.00 0.00 42.46 38.29 2nys s ILE 97 CO -0.03 0.08 1.09 -2.16 -1.23 0.00 0.00 174.94 172.69 2nys s PRO 98 N 1.20 4.64 0.38 2.79 0.04 -1.26 -0.15 135.00 142.63 2nys s PRO 98 Ca -0.05 1.74 0.19 0.00 0.04 0.00 0.00 61.00 62.92 2nys s PRO 98 Cb -0.18 -3.24 1.15 0.00 0.04 0.00 0.00 34.50 32.27 2nys s PRO 98 CO -0.05 0.18 1.69 1.88 0.04 0.00 0.00 177.00 180.73 2nys h TYR 99 N 4.46 0.76 0.00 0.56 0.05 -1.49 0.40 116.97 121.70 2nys h TYR 99 Ca -0.45 0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.36 2nys h TYR 99 Cb 1.21 -0.21 0.00 0.00 1.01 0.00 0.00 36.73 38.74 2nys h TYR 99 CO 0.61 -0.09 0.00 0.09 -1.05 0.00 0.00 178.16 177.72 2nys n ASN 100 N -4.82 0.00 0.02 3.88 5.03 -1.26 -2.27 115.26 115.83 2nys n ASN 100 Ca 0.31 -0.49 0.11 0.00 0.87 0.00 0.00 54.58 55.37 2nys n ASN 100 Cb 1.04 -0.11 -0.07 0.00 -1.02 0.00 0.00 39.78 39.62 2nys n ASN 100 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2nys n ALA 101 N -1.11 3.21 -1.97 5.41 0.00 0.14 -4.79 120.51 121.39 2nys n ALA 101 Ca 0.16 -0.44 -0.42 0.00 0.00 0.00 0.00 53.44 52.74 2nys n ALA 101 Cb 0.12 -0.89 -0.03 0.00 0.00 0.00 0.00 19.45 18.66 2nys n ALA 101 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2nys s ILE 102 N -3.32 2.91 -0.17 0.00 1.01 -0.96 -2.04 121.20 118.62 2nys s ILE 102 Ca -0.01 0.71 0.05 0.00 0.00 0.00 0.00 60.65 61.41 2nys s ILE 102 Cb 0.14 -3.46 -0.14 0.00 0.01 0.00 0.00 42.46 39.01 2nys s ILE 102 CO 0.85 0.09 -0.09 -1.14 0.00 0.00 0.00 174.94 174.64 2nys n ARG 103 N 3.02 0.85 -3.80 2.79 0.63 0.18 -4.47 116.66 115.86 2nys n ARG 103 Ca 0.09 0.07 -0.12 0.00 -0.92 0.00 0.00 57.85 56.97 2nys n ARG 103 Cb 0.41 -1.38 -0.08 0.00 0.45 0.00 0.00 32.46 31.86 2nys n ARG 103 CO 0.00 0.00 0.00 0.20 -2.51 0.00 0.00 177.63 175.32 2nys s GLY 104 N -5.49 -0.06 -0.05 5.14 0.00 -0.92 -0.26 107.32 105.69 2nys s GLY 104 Ca -0.19 -0.02 -0.01 0.00 0.00 0.00 0.00 44.72 44.49 2nys s GLY 104 CO 0.49 -0.21 0.04 -0.12 0.00 0.00 0.00 173.10 173.30 2nys s PHE 105 N -2.09 0.25 -0.01 1.90 5.36 -0.11 -0.81 117.98 122.48 2nys s PHE 105 Ca -0.08 0.11 0.03 0.00 -0.96 0.00 0.00 56.93 56.02 2nys s PHE 105 Cb -0.03 -0.55 -0.01 0.00 -0.34 0.00 0.00 43.02 42.10 2nys s PHE 105 CO -0.01 -0.22 -0.10 -0.47 -1.46 0.00 0.00 175.22 172.97 2nys s TYR 106 N 1.93 0.88 -0.50 10.12 5.04 0.32 0.09 117.35 135.23 2nys s TYR 106 Ca 0.03 -0.17 0.03 0.00 -2.44 0.00 0.00 57.07 54.52 2nys s TYR 106 Cb -0.12 -0.57 0.14 0.00 0.35 0.00 0.00 41.96 41.76 2nys s TYR 106 CO -0.03 -0.02 0.27 0.34 -1.34 0.00 0.00 175.55 174.77 2nys s ASP 107 N -0.22 4.01 0.48 4.32 -1.08 0.11 0.60 116.67 124.88 2nys s ASP 107 Ca 0.04 -2.91 0.26 0.00 -0.52 0.00 0.00 52.55 49.42 2nys s ASP 107 Cb -0.04 -1.35 1.31 0.00 -1.46 0.00 0.00 42.92 41.38 2nys s ASP 107 CO -0.00 -0.23 1.84 -0.65 0.52 0.00 0.00 175.17 176.64 2nys h PRO 108 N 6.50 0.18 -0.91 4.34 0.11 -1.85 -1.73 132.00 138.64 2nys h PRO 108 Ca -0.03 -0.01 0.21 0.00 0.11 0.00 0.00 66.00 66.29 2nys h PRO 108 Cb 0.90 -0.04 -0.12 0.00 0.11 0.00 0.00 31.00 31.85 2nys h PRO 108 CO 0.60 0.12 0.45 1.03 -0.21 0.00 0.00 178.00 179.98 2nys h SER 109 N 0.19 0.45 0.00 -2.05 0.87 -1.83 -2.71 113.55 108.47 2nys h SER 109 Ca 0.51 0.14 -0.10 0.00 -1.23 0.00 0.00 61.79 61.11 2nys h SER 109 Cb 1.65 0.09 -0.21 0.00 -0.44 0.00 0.00 62.40 63.49 2nys h SER 109 CO -0.12 0.06 -0.79 1.33 -0.53 0.00 0.00 176.83 176.78 2nys n VAL 110 N -4.98 0.98 -4.05 2.23 0.24 -0.86 -5.01 118.33 106.88 2nys n VAL 110 Ca 0.22 -1.99 -0.37 0.00 -2.04 0.00 0.00 64.34 60.16 2nys n VAL 110 Cb 0.64 0.44 -0.01 0.00 -1.47 0.00 0.00 33.84 33.44 2nys n VAL 110 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 2nys n ASN 111 N -0.23 -2.45 -4.19 -1.34 5.15 -0.71 -4.93 115.26 106.56 2nys n ASN 111 Ca 0.12 -1.12 -0.34 0.00 -0.60 0.00 0.00 54.58 52.64 2nys n ASN 111 Cb 0.94 -1.35 -0.15 0.00 -0.53 0.00 0.00 39.78 38.70 2nys n ASN 111 CO 0.00 0.00 0.00 0.12 1.40 0.00 0.00 177.26 178.78 2nys s PHE 112 N -3.85 2.95 0.03 1.20 5.36 -1.06 -4.99 117.98 117.61 2nys s PHE 112 Ca 0.32 -1.48 0.06 0.00 -0.96 0.00 0.00 56.93 54.87 2nys s PHE 112 Cb -0.18 -2.01 -0.02 0.00 -0.34 0.00 0.00 43.02 40.47 2nys s PHE 112 CO 0.84 -0.72 -0.17 -2.00 -1.46 0.00 0.00 175.22 171.71 2nys s GLU 113 N 1.34 1.17 -0.00 10.12 2.12 -1.26 -0.71 118.70 131.48 2nys s GLU 113 Ca 0.03 -0.77 0.04 0.00 0.36 0.00 0.00 54.97 54.63 2nys s GLU 113 Cb -0.15 -1.21 -0.01 0.00 0.26 0.00 0.00 34.13 33.02 2nys s GLU 113 CO -0.07 0.31 -0.12 -0.51 -0.54 0.00 0.00 175.26 174.33 2nys s LEU 114 N -0.95 2.05 0.08 2.70 1.43 0.11 -4.98 118.68 119.12 2nys s LEU 114 Ca 0.05 -0.25 0.06 0.00 -1.03 0.00 0.00 54.13 52.95 2nys s LEU 114 Cb -0.08 -0.59 -0.03 0.00 0.03 0.00 0.00 46.19 45.52 2nys s LEU 114 CO 0.01 0.12 -0.16 -1.61 0.23 0.00 0.00 176.35 174.94 2nys s GLU 115 N -0.43 0.92 0.27 1.70 2.02 -1.26 -0.93 118.70 120.99 2nys s GLU 115 Ca 0.04 -1.04 0.02 0.00 0.02 0.00 0.00 54.97 54.01 2nys s GLU 115 Cb -0.05 -0.99 -0.04 0.00 0.10 0.00 0.00 34.13 33.15 2nys s GLU 115 CO -0.00 0.22 0.16 -0.06 0.02 0.00 0.00 175.26 175.60 2nys s PHE 116 N -1.32 1.47 -1.14 1.61 0.08 0.65 -4.98 117.98 114.35 2nys s PHE 116 Ca 0.01 -1.40 -0.10 0.00 0.12 0.00 0.00 56.93 55.56 2nys s PHE 116 Cb -0.10 -0.74 0.25 0.00 -0.57 0.00 0.00 43.02 41.87 2nys s PHE 116 CO 0.03 -0.60 1.25 -0.25 -0.10 0.00 0.00 175.22 175.54 2nys n ASP 117 N -0.76 5.51 -0.04 1.36 8.00 -1.26 -4.85 116.55 124.51 2nys n ASP 117 Ca 0.02 -3.06 0.03 0.00 0.71 0.00 0.00 54.79 52.50 2nys n ASP 117 Cb 0.65 -1.42 0.38 0.00 -0.02 0.00 0.00 41.12 40.71 2nys n ASP 117 CO 0.00 0.00 0.00 1.62 -0.39 0.00 0.00 177.20 178.43 2nys h VAL 118 N 3.87 1.13 0.00 2.53 3.04 -1.87 -3.51 116.25 121.44 2nys h VAL 118 Ca 0.22 -0.28 0.00 0.00 -1.01 0.00 0.00 66.70 65.63 2nys h VAL 118 Cb 0.84 0.46 0.00 0.00 -2.01 0.00 0.00 31.29 30.58 2nys h VAL 118 CO 1.12 0.13 0.00 -0.81 -1.01 0.00 0.00 177.57 177.00