#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dca s PRO 2 N 0.00 2.13 0.43 3.23 0.04 -1.26 -4.93 135.00 134.64 2dca s PRO 2 Ca 0.00 1.16 0.17 0.00 0.04 0.00 0.00 61.00 62.37 2dca s PRO 2 Cb 0.00 -1.88 0.96 0.00 0.04 0.00 0.00 34.50 33.62 2dca s PRO 2 CO 0.00 -1.73 1.92 1.49 0.04 0.00 0.00 177.00 178.71 2dca h GLU 3 N -1.19 0.00 -4.55 4.56 4.81 -2.01 -3.44 114.58 112.76 2dca h GLU 3 Ca -0.44 0.00 -0.21 0.00 -0.13 0.00 0.00 59.36 58.58 2dca h GLU 3 Cb 1.24 0.00 -0.16 0.00 0.63 0.00 0.00 28.75 30.46 2dca h GLU 3 CO 0.51 0.27 -0.70 -1.12 -0.73 0.00 0.00 179.01 177.24 2dca s SER 4 N -6.71 0.96 -0.29 1.04 0.01 -1.26 -4.30 113.70 103.15 2dca s SER 4 Ca -0.03 -0.94 -0.15 0.00 1.31 0.00 0.00 55.95 56.14 2dca s SER 4 Cb 0.14 0.11 0.11 0.00 0.21 0.00 0.00 66.02 66.58 2dca s SER 4 CO 0.68 -0.45 0.77 0.12 0.41 0.00 0.00 173.24 174.77 2dca s PHE 5 N -3.35 -0.95 -0.24 2.43 2.19 -0.23 -4.96 117.98 112.86 2dca s PHE 5 Ca 0.08 1.86 -0.01 0.00 0.33 0.00 0.00 56.93 59.19 2dca s PHE 5 Cb 0.04 0.57 0.07 0.00 -1.31 0.00 0.00 43.02 42.39 2dca s PHE 5 CO -0.05 -0.47 0.01 0.34 1.83 0.00 0.00 175.22 176.88 2dca s ASP 6 N 1.73 3.58 0.57 6.13 -1.08 -1.26 -0.66 116.67 125.68 2dca s ASP 6 Ca -0.09 -1.18 0.28 0.00 -0.52 0.00 0.00 52.55 51.04 2dca s ASP 6 Cb -0.05 -0.92 1.49 0.00 -1.46 0.00 0.00 42.92 41.98 2dca s ASP 6 CO -0.18 -0.30 1.98 0.00 0.52 0.00 0.00 175.17 177.18 2dca h ALA 7 N 8.07 2.23 -0.65 3.66 0.00 -1.64 -0.23 119.26 130.70 2dca h ALA 7 Ca -0.16 -0.02 -0.05 0.00 0.00 0.00 0.00 54.91 54.69 2dca h ALA 7 Cb 1.08 0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.87 2dca h ALA 7 CO 0.40 -0.61 0.21 0.00 0.00 0.00 0.00 179.25 179.24 2dca h ARG 8 N 0.00 0.99 0.05 0.00 3.08 -1.87 -1.74 114.38 114.88 2dca h ARG 8 Ca 0.21 -0.19 -0.28 0.00 0.07 0.00 0.00 59.98 59.79 2dca h ARG 8 Cb 0.98 -0.15 -0.03 0.00 0.08 0.00 0.00 29.97 30.86 2dca h ARG 8 CO -0.00 0.84 -1.44 0.93 -1.07 0.00 0.00 179.97 179.23 2dca h GLU 9 N 0.96 0.11 0.00 0.04 5.08 -1.49 -3.34 114.58 115.94 2dca h GLU 9 Ca 0.21 -0.19 -0.11 0.00 -1.00 0.00 0.00 59.36 58.27 2dca h GLU 9 Cb 0.27 0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.57 2dca h GLU 9 CO -0.01 0.92 -0.53 1.96 -1.00 0.00 0.00 179.01 180.35 2dca h GLN 10 N 0.03 0.00 -2.30 2.33 1.08 -1.21 -3.35 115.11 111.68 2dca h GLN 10 Ca -0.19 0.00 -0.59 0.00 -1.45 0.00 0.00 58.65 56.42 2dca h GLN 10 Cb 1.95 0.00 -0.41 0.00 -0.05 0.00 0.00 27.48 28.97 2dca h GLN 10 CO 0.13 0.53 -0.77 0.91 -0.95 0.00 0.00 178.83 178.68 2dca n TRP 11 N -3.67 2.02 0.18 2.96 8.01 -0.67 -4.95 117.44 121.33 2dca n TRP 11 Ca -0.01 -3.93 0.17 0.00 -1.31 0.00 0.00 57.50 52.41 2dca n TRP 11 Cb 0.59 -0.43 0.79 0.00 -2.01 0.00 0.00 31.31 30.24 2dca n TRP 11 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 177.69 175.33 2dca h PRO 12 N 4.47 0.00 -0.13 -0.99 0.11 -1.71 -1.97 132.00 131.78 2dca h PRO 12 Ca 0.16 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.27 2dca h PRO 12 Cb 0.76 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.87 2dca h PRO 12 CO 0.67 0.00 0.00 0.09 -0.21 0.00 0.00 178.00 178.55 2dca n ASN 13 N -3.97 1.02 -3.85 -2.05 4.13 -1.26 -4.45 115.26 104.82 2dca n ASN 13 Ca 0.02 -1.73 -0.28 0.00 1.68 0.00 0.00 54.58 54.27 2dca n ASN 13 Cb 0.34 -0.09 -0.12 0.00 -1.54 0.00 0.00 39.78 38.37 2dca n ASN 13 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2dca h PRO 15 N 5.50 0.00 0.00 0.00 0.13 -1.82 -2.39 132.00 133.42 2dca h PRO 15 Ca 0.14 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.26 2dca h PRO 15 Cb 0.78 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.91 2dca h PRO 15 CO 0.68 0.00 -0.08 1.79 -0.23 0.00 0.00 178.00 180.16 2dca h THR 16 N 0.00 0.86 -0.02 1.56 1.35 -1.93 -1.41 112.91 113.32 2dca h THR 16 Ca -0.00 -0.30 0.01 0.00 -0.55 0.00 0.00 66.41 65.57 2dca h THR 16 Cb 0.04 1.17 -0.00 0.00 -1.73 0.00 0.00 68.15 67.63 2dca h THR 16 CO 0.00 0.08 0.02 0.40 -0.25 0.00 0.00 175.52 175.77 2dca h ILE 17 N 0.00 0.90 0.00 6.82 1.08 -1.78 -1.98 117.51 122.55 2dca h ILE 17 Ca -0.00 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.47 2dca h ILE 17 Cb 0.16 0.99 0.00 0.00 -3.07 0.00 0.00 36.82 34.90 2dca h ILE 17 CO 0.01 0.00 -0.77 0.29 -0.69 0.00 0.00 178.15 176.99 2dca n LYS 18 N -4.41 0.20 -2.66 2.37 5.02 -0.54 -4.81 118.16 113.33 2dca n LYS 18 Ca -0.02 0.02 -0.32 0.00 -2.02 0.00 0.00 58.31 55.97 2dca n LYS 18 Cb 0.11 -1.59 -0.04 0.00 -0.02 0.00 0.00 35.03 33.49 2dca n LYS 18 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 2dca s GLU 19 N -3.13 3.96 -0.08 1.97 -1.05 -0.75 -5.07 118.70 114.56 2dca s GLU 19 Ca 0.07 0.84 0.03 0.00 -0.15 0.00 0.00 54.97 55.76 2dca s GLU 19 Cb 0.15 -2.23 0.00 0.00 -0.44 0.00 0.00 34.13 31.61 2dca s GLU 19 CO 0.75 -0.13 -0.19 0.42 0.95 0.00 0.00 175.26 177.07 2dca s ILE 20 N -2.42 1.64 0.58 1.83 1.01 -1.26 -5.04 121.20 117.54 2dca s ILE 20 Ca 0.57 -0.78 0.09 0.00 0.00 0.00 0.00 60.65 60.53 2dca s ILE 20 Cb -0.10 -1.44 0.08 0.00 0.01 0.00 0.00 42.46 41.02 2dca s ILE 20 CO 0.27 0.47 0.72 -0.13 0.00 0.00 0.00 174.94 176.26 2dca s ARG 21 N 0.43 2.25 -0.18 2.79 0.52 -1.26 -4.77 118.95 118.73 2dca s ARG 21 Ca -0.16 -1.78 -0.02 0.00 -0.52 0.00 0.00 55.73 53.26 2dca s ARG 21 Cb -0.16 -2.50 0.05 0.00 0.52 0.00 0.00 34.95 32.86 2dca s ARG 21 CO 0.06 -0.86 0.01 0.34 0.02 0.00 0.00 175.30 174.87 2dca s ASP 22 N -4.60 2.86 0.00 0.23 3.68 -1.26 -1.60 116.67 115.98 2dca s ASP 22 Ca 0.55 -0.76 0.18 0.00 2.13 0.00 0.00 52.55 54.65 2dca s ASP 22 Cb -0.05 -0.68 0.82 0.00 -1.45 0.00 0.00 42.92 41.56 2dca s ASP 22 CO 0.35 -0.27 1.56 0.00 0.13 0.00 0.00 175.17 176.94 2dca n GLN 23 N 5.00 0.10 0.00 4.34 10.64 -0.41 -4.83 117.38 132.21 2dca n GLN 23 Ca -0.09 0.16 0.00 0.00 -1.83 0.00 0.00 57.00 55.24 2dca n GLN 23 Cb 0.47 -1.50 0.00 0.00 -0.86 0.00 0.00 30.24 28.35 2dca n GLN 23 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2dca n GLY 24 N 0.31 -0.54 2.68 2.61 0.00 -1.26 -3.90 105.19 105.09 2dca n GLY 24 Ca 0.06 -1.08 -0.42 0.00 0.00 0.00 0.00 46.02 44.58 2dca n GLY 24 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2dca n SER 25 N -1.58 5.14 -3.66 1.61 7.64 -1.26 -4.81 113.62 116.70 2dca n SER 25 Ca 0.00 -2.87 -0.12 0.00 1.01 0.00 0.00 58.87 56.89 2dca n SER 25 Cb 0.00 -1.59 -0.08 0.00 -1.01 0.00 0.00 64.21 61.53 2dca n SER 25 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2dca n GLY 27 N 3.29 4.10 1.73 0.00 0.00 -0.11 -4.54 105.19 109.66 2dca n GLY 27 Ca -0.16 -1.51 -0.05 0.00 0.00 0.00 0.00 46.02 44.29 2dca n GLY 27 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2dca n SER 28 N 3.06 4.24 -0.08 1.61 3.41 -1.26 -2.67 113.62 121.93 2dca n SER 28 Ca 0.69 -3.32 0.08 0.00 -0.26 0.00 0.00 58.87 56.06 2dca n SER 28 Cb 0.39 -0.71 0.45 0.00 -0.26 0.00 0.00 64.21 64.07 2dca n SER 28 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2dca h TRP 30 N 0.53 1.04 0.04 0.00 5.08 -1.82 -0.02 115.95 120.79 2dca h TRP 30 Ca 0.25 0.03 -0.27 0.00 1.08 0.00 0.00 58.89 59.97 2dca h TRP 30 Cb 0.30 -0.34 0.02 0.00 -3.00 0.00 0.00 29.16 26.14 2dca h TRP 30 CO -0.00 0.54 -1.09 0.00 -1.28 0.00 0.00 178.44 176.62 2dca h ALA 31 N 1.51 0.14 -0.18 0.11 0.00 -1.63 -3.20 119.26 116.01 2dca h ALA 31 Ca 0.39 -0.73 -0.05 0.00 0.00 0.00 0.00 54.91 54.52 2dca h ALA 31 Cb 0.19 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 2dca h ALA 31 CO -0.14 0.72 -0.07 0.74 0.00 0.00 0.00 179.25 180.50 2dca h PHE 32 N 0.32 0.42 -0.89 0.00 -1.00 -0.78 -1.21 116.94 113.80 2dca h PHE 32 Ca -0.14 -0.10 0.09 0.00 2.81 0.00 0.00 57.97 60.64 2dca h PHE 32 Cb 1.74 -0.10 -0.06 0.00 3.61 0.00 0.00 35.95 41.14 2dca h PHE 32 CO 0.10 0.65 0.57 0.78 -1.61 0.00 0.00 178.31 178.80 2dca h GLY 33 N 0.06 1.28 0.55 -1.45 0.00 -1.14 -1.25 103.07 101.13 2dca h GLY 33 Ca 0.04 -0.37 -0.02 0.00 0.00 0.00 0.00 47.33 46.98 2dca h GLY 33 CO 0.02 0.21 -0.21 0.00 0.00 0.00 0.00 176.54 176.56 2dca h ALA 34 N 1.55 -0.59 0.00 3.60 0.00 -1.51 -2.77 119.26 119.54 2dca h ALA 34 Ca 0.41 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 55.11 2dca h ALA 34 Cb 0.39 0.23 -0.00 0.00 0.00 0.00 0.00 17.79 18.40 2dca h ALA 34 CO -0.17 -0.61 -0.13 -0.39 0.00 0.00 0.00 179.25 177.95 2dca h VAL 35 N -1.05 1.04 0.19 0.00 -1.51 -1.10 0.95 116.25 114.77 2dca h VAL 35 Ca -0.06 -0.46 -0.01 0.00 -1.23 0.00 0.00 66.70 64.94 2dca h VAL 35 Cb 0.55 1.25 0.00 0.00 -2.13 0.00 0.00 31.29 30.96 2dca h VAL 35 CO 0.10 0.13 -0.09 -0.33 -1.23 0.00 0.00 177.57 176.15 2dca h GLU 36 N 0.00 -0.25 -0.50 5.19 5.08 -1.30 0.21 114.58 123.02 2dca h GLU 36 Ca -0.00 0.02 -0.05 0.00 -1.00 0.00 0.00 59.36 58.33 2dca h GLU 36 Cb 0.24 0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.52 2dca h GLU 36 CO 0.02 0.10 0.10 0.00 -1.00 0.00 0.00 179.01 178.23 2dca h ALA 37 N 0.08 1.25 -0.54 3.43 0.00 -1.19 -1.51 119.26 120.78 2dca h ALA 37 Ca -0.03 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.62 2dca h ALA 37 Cb 0.46 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.02 2dca h ALA 37 CO 0.04 0.52 0.08 0.82 0.00 0.00 0.00 179.25 180.71 2dca h ILE 38 N 0.74 1.25 -0.55 0.00 2.04 -0.77 0.76 117.51 120.99 2dca h ILE 38 Ca 0.16 -0.96 0.04 0.00 1.00 0.00 0.00 64.86 65.10 2dca h ILE 38 Cb 0.30 0.84 -0.04 0.00 -0.74 0.00 0.00 36.82 37.18 2dca h ILE 38 CO 0.00 0.35 0.30 0.28 0.00 0.00 0.00 178.15 179.08 2dca h SER 39 N 0.77 0.46 -0.20 1.72 0.02 -0.40 0.13 113.55 116.06 2dca h SER 39 Ca 0.16 0.02 0.00 0.00 -0.84 0.00 0.00 61.79 61.13 2dca h SER 39 Cb 0.41 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 62.87 2dca h SER 39 CO 0.01 0.32 0.13 0.44 -1.14 0.00 0.00 176.83 176.59 2dca h ASP 40 N 0.59 0.23 0.25 3.07 3.32 -0.78 -2.70 116.42 120.41 2dca h ASP 40 Ca 0.23 -0.02 -0.09 0.00 0.02 0.00 0.00 57.03 57.17 2dca h ASP 40 Cb 0.09 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.57 2dca h ASP 40 CO -0.13 0.18 -0.37 0.03 -1.72 0.00 0.00 179.24 177.23 2dca h ARG 41 N 0.26 0.17 -0.72 3.56 3.08 -0.33 0.36 114.38 120.76 2dca h ARG 41 Ca 0.07 -0.07 -0.06 0.00 0.07 0.00 0.00 59.98 59.99 2dca h ARG 41 Cb -0.02 -0.01 -0.03 0.00 0.08 0.00 0.00 29.97 30.00 2dca h ARG 41 CO -0.02 0.53 0.19 0.82 -1.07 0.00 0.00 179.97 180.43 2dca h ILE 42 N 0.15 1.26 -0.16 2.04 2.04 -0.59 0.71 117.51 122.96 2dca h ILE 42 Ca 0.02 -0.94 -0.08 0.00 1.00 0.00 0.00 64.86 64.86 2dca h ILE 42 Cb 0.73 0.50 -0.00 0.00 -0.74 0.00 0.00 36.82 37.31 2dca h ILE 42 CO 0.05 0.37 -0.20 0.00 0.00 0.00 0.00 178.15 178.37 2dca h ILE 44 N 0.04 0.90 -2.35 0.00 1.08 -0.71 -3.11 117.51 113.35 2dca h ILE 44 Ca 0.02 0.00 -0.81 0.00 -0.39 0.00 0.00 64.86 63.68 2dca h ILE 44 Cb 0.76 0.90 -0.27 0.00 -3.07 0.00 0.00 36.82 35.13 2dca h ILE 44 CO 0.05 0.00 0.97 1.41 -0.69 0.00 0.00 178.15 179.89 2dca n HIS 45 N -5.14 2.70 0.00 1.37 8.25 0.22 -3.95 115.22 118.68 2dca n HIS 45 Ca -0.06 -2.59 0.00 0.00 -0.26 0.00 0.00 57.72 54.81 2dca n HIS 45 Cb 0.08 -1.19 0.00 0.00 1.12 0.00 0.00 29.99 29.99 2dca n HIS 45 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 2dca n SER 46 N 0.15 0.00 -4.25 0.41 3.41 -1.22 -4.87 113.62 107.25 2dca n SER 46 Ca 0.43 0.00 -0.43 0.00 -0.26 0.00 0.00 58.87 58.62 2dca n SER 46 Cb 0.27 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.15 2dca n SER 46 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 2dca s ASN 47 N 0.00 5.88 -0.04 4.04 2.47 -1.18 -4.94 114.94 121.17 2dca s ASN 47 Ca 0.00 -1.87 0.07 0.00 0.42 0.00 0.00 52.86 51.48 2dca s ASN 47 Cb 0.00 -2.08 -0.01 0.00 -1.45 0.00 0.00 41.25 37.70 2dca s ASN 47 CO 0.00 -0.75 -0.25 0.68 -3.72 0.00 0.00 177.10 173.05 2dca s VAL 50 N 1.45 2.04 -0.21 -5.21 -7.23 -1.26 -5.14 120.40 104.84 2dca s VAL 50 Ca 0.05 -1.08 -0.07 0.00 -1.81 0.00 0.00 61.98 59.07 2dca s VAL 50 Cb -0.28 -1.71 -0.03 0.00 0.56 0.00 0.00 36.38 34.92 2dca s VAL 50 CO 0.01 0.57 0.05 0.21 -0.31 0.00 0.00 175.10 175.63 2dca s ASN 51 N -0.35 5.29 -0.03 4.85 2.47 -1.26 -3.84 114.94 122.07 2dca s ASN 51 Ca 0.02 -0.07 -0.01 0.00 0.42 0.00 0.00 52.86 53.22 2dca s ASN 51 Cb -0.12 -1.92 0.03 0.00 -1.45 0.00 0.00 41.25 37.79 2dca s ASN 51 CO 0.02 0.09 0.05 0.54 -3.72 0.00 0.00 177.10 174.08 2dca s VAL 52 N 0.89 -0.04 -0.65 -5.21 0.11 -1.26 -5.09 120.40 109.15 2dca s VAL 52 Ca 0.03 0.16 -0.23 0.00 -2.93 0.00 0.00 61.98 59.01 2dca s VAL 52 Cb -0.14 -0.11 0.06 0.00 -1.53 0.00 0.00 36.38 34.66 2dca s VAL 52 CO 0.02 0.07 0.99 -1.61 -3.33 0.00 0.00 175.10 171.24 2dca s GLU 53 N 0.86 3.15 0.17 1.54 0.41 -1.26 -4.68 118.70 118.88 2dca s GLU 53 Ca -0.07 -0.68 -0.31 0.00 -0.41 0.00 0.00 54.97 53.51 2dca s GLU 53 Cb -0.10 -4.19 -0.09 0.00 -1.78 0.00 0.00 34.13 27.97 2dca s GLU 53 CO -0.03 -1.80 1.39 0.08 -0.49 0.00 0.00 175.26 174.41 2dca s VAL 54 N 4.22 3.12 -0.18 2.63 1.01 -1.26 0.04 120.40 129.97 2dca s VAL 54 Ca 0.25 0.85 -0.29 0.00 0.00 0.00 0.00 61.98 62.79 2dca s VAL 54 Cb -0.15 -3.55 -0.04 0.00 0.00 0.00 0.00 36.38 32.64 2dca s VAL 54 CO 0.12 0.10 1.78 -0.55 0.00 0.00 0.00 175.10 176.54 2dca s SER 55 N 0.76 6.22 0.31 3.32 0.15 -0.28 -4.54 113.70 119.64 2dca s SER 55 Ca 0.62 1.82 0.09 0.00 0.70 0.00 0.00 55.95 59.18 2dca s SER 55 Cb -0.38 -2.53 0.49 0.00 -1.71 0.00 0.00 66.02 61.89 2dca s SER 55 CO 0.35 -1.35 1.70 0.00 1.20 0.00 0.00 173.24 175.14 2dca h ALA 56 N 11.48 1.14 -0.40 5.45 0.00 -1.83 -3.01 119.26 132.10 2dca h ALA 56 Ca -0.37 -0.44 -0.01 0.00 0.00 0.00 0.00 54.91 54.09 2dca h ALA 56 Cb 1.18 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.87 2dca h ALA 56 CO 0.99 0.61 0.20 1.49 0.00 0.00 0.00 179.25 182.53 2dca h GLU 57 N 0.09 0.57 -0.43 0.00 4.57 -1.88 0.29 114.58 117.80 2dca h GLU 57 Ca 0.00 -0.08 -0.01 0.00 -1.18 0.00 0.00 59.36 58.09 2dca h GLU 57 Cb 0.86 -0.10 -0.02 0.00 -0.16 0.00 0.00 28.75 29.33 2dca h GLU 57 CO 0.07 0.49 0.21 0.22 -1.18 0.00 0.00 179.01 178.82 2dca h ASP 58 N 0.51 0.55 0.30 1.04 -0.00 -1.78 -1.00 116.42 116.04 2dca h ASP 58 Ca 0.14 -0.12 -0.01 0.00 -0.00 0.00 0.00 57.03 57.04 2dca h ASP 58 Cb 0.10 -0.14 0.00 0.00 -0.00 0.00 0.00 39.33 39.29 2dca h ASP 58 CO -0.02 0.51 -0.15 -0.03 -0.00 0.00 0.00 179.24 179.55 2dca h MET 59 N 0.55 -0.39 -0.52 0.28 4.05 -1.39 -1.31 114.93 116.19 2dca h MET 59 Ca 0.15 0.03 0.04 0.00 -0.28 0.00 0.00 59.70 59.64 2dca h MET 59 Cb 0.10 0.09 -0.04 0.00 -0.80 0.00 0.00 31.60 30.94 2dca h MET 59 CO -0.02 -0.15 0.28 1.25 0.23 0.00 0.00 176.91 178.49 2dca h LEU 60 N -0.58 0.41 0.03 3.39 6.46 -0.88 -2.98 115.31 121.15 2dca h LEU 60 Ca -0.04 0.02 -0.30 0.00 -0.12 0.00 0.00 57.88 57.44 2dca h LEU 60 Cb 0.42 -0.06 -0.04 0.00 -0.73 0.00 0.00 40.66 40.25 2dca h LEU 60 CO 0.07 0.28 -1.72 0.71 -0.62 0.00 0.00 178.44 177.16 2dca h THR 61 N 0.54 0.86 0.00 1.05 1.35 -1.23 -3.42 112.91 112.06 2dca h THR 61 Ca 0.23 -2.67 0.00 0.00 -0.55 0.00 0.00 66.41 63.41 2dca h THR 61 Cb 0.12 2.47 0.00 0.00 -1.73 0.00 0.00 68.15 69.00 2dca h THR 61 CO -0.15 0.59 -1.20 0.00 -0.25 0.00 0.00 175.52 174.52 2dca n GLY 64 N -0.44 -1.63 0.41 0.00 0.00 -1.26 -4.21 105.19 98.07 2dca n GLY 64 Ca -0.02 -1.48 0.23 0.00 0.00 0.00 0.00 46.02 44.75 2dca n GLY 64 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2dca h GLY 65 N 0.00 0.00 1.55 -0.02 0.00 -1.95 -0.88 103.07 101.77 2dca h GLY 65 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 47.33 47.39 2dca h GLY 65 CO 0.00 0.00 0.17 -2.09 0.00 0.00 0.00 176.54 174.62 2dca h GLU 66 N 0.00 0.00 -0.02 4.80 4.22 -1.97 -1.50 114.58 120.10 2dca h GLU 66 Ca 0.28 0.00 0.00 0.00 0.08 0.00 0.00 59.36 59.72 2dca h GLU 66 Cb 1.22 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.47 2dca h GLU 66 CO -0.00 0.00 -0.17 0.00 -2.18 0.00 0.00 179.01 176.66 2dca n GLY 68 N 1.12 0.13 2.56 0.00 0.00 -0.57 0.62 105.19 109.06 2dca n GLY 68 Ca 0.09 -1.49 -0.16 0.00 0.00 0.00 0.00 46.02 44.47 2dca n GLY 68 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2dca n ASP 69 N 0.00 2.29 0.00 1.61 4.64 0.51 -4.08 116.55 121.52 2dca n ASP 69 Ca 0.00 -3.05 0.00 0.00 -1.38 0.00 0.00 54.79 50.36 2dca n ASP 69 Cb 0.00 -0.53 0.00 0.00 -1.04 0.00 0.00 41.12 39.55 2dca n ASP 69 CO 0.00 0.00 0.00 0.61 -0.82 0.00 0.00 177.20 176.99 2dca n GLY 70 N -0.12 3.08 0.00 0.27 0.00 -1.24 -0.47 105.19 106.72 2dca n GLY 70 Ca 0.20 0.21 0.07 0.00 0.00 0.00 0.00 46.02 46.50 2dca n GLY 70 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dca n ASN 72 N -1.23 2.42 0.00 0.00 4.13 0.39 -0.93 115.26 120.04 2dca n ASN 72 Ca 0.08 -1.85 0.00 0.00 1.68 0.00 0.00 54.58 54.49 2dca n ASN 72 Cb 0.10 -0.17 0.00 0.00 -1.54 0.00 0.00 39.78 38.17 2dca n ASN 72 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2dca n GLY 73 N 1.28 2.76 1.35 7.41 0.00 -0.83 -4.82 105.19 112.34 2dca n GLY 73 Ca 0.17 -1.93 -0.04 0.00 0.00 0.00 0.00 46.02 44.23 2dca n GLY 73 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dca n GLY 74 N 0.45 1.83 3.25 -0.02 0.00 -1.26 -0.36 105.19 109.09 2dca n GLY 74 Ca 0.00 -1.17 -0.37 0.00 0.00 0.00 0.00 46.02 44.48 2dca n GLY 74 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2dca s PHE 75 N -6.09 3.24 0.21 1.61 2.99 0.20 -4.87 117.98 115.27 2dca s PHE 75 Ca 0.07 -1.51 -0.16 0.00 0.00 0.00 0.00 56.93 55.33 2dca s PHE 75 Cb -0.02 -2.23 0.21 0.00 0.00 0.00 0.00 43.02 40.99 2dca s PHE 75 CO 0.05 -0.74 1.60 -1.35 -0.00 0.00 0.00 175.22 174.79 2dca h PRO 76 N 8.16 -0.07 -0.06 0.24 0.11 -1.87 0.17 132.00 138.69 2dca h PRO 76 Ca -0.23 0.00 0.01 0.00 0.11 0.00 0.00 66.00 65.89 2dca h PRO 76 Cb 1.08 0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.20 2dca h PRO 76 CO 0.58 -0.04 0.04 0.66 -0.21 0.00 0.00 178.00 179.03 2dca h SER 77 N -0.07 0.03 -0.24 -2.05 4.64 -1.95 -0.38 113.55 113.53 2dca h SER 77 Ca 0.29 -0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.52 2dca h SER 77 Cb 0.52 -0.01 -0.02 0.00 -0.31 0.00 0.00 62.40 62.59 2dca h SER 77 CO -0.69 0.02 -0.14 1.23 -0.87 0.00 0.00 176.83 176.37 2dca h GLY 78 N 0.03 0.71 0.92 -0.77 0.00 -0.93 -2.46 103.07 100.58 2dca h GLY 78 Ca 0.03 -0.54 -0.03 0.00 0.00 0.00 0.00 47.33 46.79 2dca h GLY 78 CO -0.00 0.49 0.11 0.00 0.00 0.00 0.00 176.54 177.15 2dca h ALA 79 N 1.25 0.48 0.00 3.60 0.00 -0.53 -1.77 119.26 122.28 2dca h ALA 79 Ca 0.10 -0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.79 2dca h ALA 79 Cb 0.58 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 2dca h ALA 79 CO 0.04 0.12 -0.26 -1.49 0.00 0.00 0.00 179.25 177.66 2dca h TRP 80 N 0.44 0.00 -0.39 0.00 4.06 -1.38 -2.30 115.95 116.38 2dca h TRP 80 Ca 0.12 0.00 -0.07 0.00 2.06 0.00 0.00 58.89 61.00 2dca h TRP 80 Cb 0.25 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.40 2dca h TRP 80 CO 0.01 0.26 -0.02 -0.91 -3.56 0.00 0.00 178.44 174.22 2dca h ASN 81 N 0.00 0.70 -0.79 -3.49 2.35 -1.01 -2.69 115.58 110.64 2dca h ASN 81 Ca -0.00 -0.32 0.05 0.00 -0.55 0.00 0.00 56.30 55.47 2dca h ASN 81 Cb 0.52 -0.19 -0.05 0.00 0.05 0.00 0.00 38.32 38.65 2dca h ASN 81 CO 0.03 0.85 0.49 0.15 -1.65 0.00 0.00 177.43 177.31 2dca h PHE 82 N 0.53 0.92 -1.00 1.19 3.04 -0.80 0.87 116.94 121.69 2dca h PHE 82 Ca 0.11 0.03 0.07 0.00 3.98 0.00 0.00 57.97 62.16 2dca h PHE 82 Cb 0.50 -0.30 -0.07 0.00 2.56 0.00 0.00 35.95 38.64 2dca h PHE 82 CO 0.04 0.50 0.64 2.35 -2.02 0.00 0.00 178.31 179.82 2dca h TRP 83 N 0.94 1.19 0.00 0.41 7.01 -1.20 0.38 115.95 124.67 2dca h TRP 83 Ca 0.33 0.03 -0.20 0.00 2.11 0.00 0.00 58.89 61.16 2dca h TRP 83 Cb 0.09 -0.39 -0.03 0.00 -2.10 0.00 0.00 29.16 26.73 2dca h TRP 83 CO -0.04 0.59 -0.96 1.79 -2.79 0.00 0.00 178.44 177.04 2dca h THR 84 N 1.14 1.66 0.00 2.65 1.35 -0.98 -1.40 112.91 117.34 2dca h THR 84 Ca 0.44 -3.33 -0.11 0.00 -0.55 0.00 0.00 66.41 62.86 2dca h THR 84 Cb 0.21 2.81 -0.02 0.00 -1.73 0.00 0.00 68.15 69.42 2dca h THR 84 CO -0.19 0.94 -0.67 0.11 -0.25 0.00 0.00 175.52 175.47 2dca h LYS 85 N 0.00 0.00 0.00 4.72 6.56 -0.28 -3.42 116.57 124.14 2dca h LYS 85 Ca -0.01 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.58 2dca h LYS 85 Cb 1.73 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 33.39 2dca h LYS 85 CO 0.13 0.79 -1.48 1.63 -2.06 0.00 0.00 179.45 178.45 2dca n LYS 86 N -4.54 0.73 -0.08 3.15 4.76 0.12 -5.08 118.16 117.22 2dca n LYS 86 Ca -0.19 -0.11 0.01 0.00 -2.87 0.00 0.00 58.31 55.15 2dca n LYS 86 Cb 0.51 -1.30 -0.00 0.00 -1.84 0.00 0.00 35.03 32.40 2dca n LYS 86 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2dca n GLY 87 N 1.66 -1.74 2.92 0.72 0.00 -0.65 -4.88 105.19 103.22 2dca n GLY 87 Ca -0.02 -1.49 -0.17 0.00 0.00 0.00 0.00 46.02 44.35 2dca n GLY 87 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2dca s LEU 88 N -4.12 1.77 0.76 0.99 1.43 0.46 -4.66 118.68 115.31 2dca s LEU 88 Ca 0.00 -0.09 -0.07 0.00 -1.03 0.00 0.00 54.13 52.94 2dca s LEU 88 Cb 0.00 -0.29 0.11 0.00 0.03 0.00 0.00 46.19 46.04 2dca s LEU 88 CO 0.00 0.02 1.07 0.68 0.23 0.00 0.00 176.35 178.34 2dca s VAL 89 N 0.22 2.20 0.63 -1.59 -7.23 -1.26 0.07 120.40 113.44 2dca s VAL 89 Ca -0.02 -0.31 -0.10 0.00 -1.81 0.00 0.00 61.98 59.74 2dca s VAL 89 Cb -0.06 -2.89 -0.01 0.00 0.56 0.00 0.00 36.38 33.98 2dca s VAL 89 CO -0.00 0.00 1.01 -0.94 -0.31 0.00 0.00 175.10 174.86 2dca s SER 90 N -4.65 5.84 0.00 4.85 1.04 -1.26 -1.12 113.70 118.40 2dca s SER 90 Ca 0.65 1.15 0.00 0.00 0.48 0.00 0.00 55.95 58.23 2dca s SER 90 Cb -0.08 -2.13 0.00 0.00 0.10 0.00 0.00 66.02 63.91 2dca s SER 90 CO 0.46 -1.05 0.00 0.61 0.98 0.00 0.00 173.24 174.24 2dca n GLY 91 N -2.77 1.34 0.00 7.32 0.00 0.11 -0.62 105.19 110.57 2dca n GLY 91 Ca 0.06 0.45 0.00 0.00 0.00 0.00 0.00 46.02 46.52 2dca n GLY 91 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dca n GLY 92 N 0.00 1.18 3.68 -0.02 0.00 0.61 -3.76 105.19 106.88 2dca n GLY 92 Ca 0.00 -1.85 -0.30 0.00 0.00 0.00 0.00 46.02 43.87 2dca n GLY 92 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2dca s LEU 93 N 0.00 2.29 0.24 0.99 1.43 -1.26 -1.27 118.68 121.10 2dca s LEU 93 Ca 0.00 1.72 -0.31 0.00 -1.03 0.00 0.00 54.13 54.50 2dca s LEU 93 Cb 0.00 -4.09 -0.13 0.00 0.03 0.00 0.00 46.19 42.01 2dca s LEU 93 CO 0.00 -2.92 1.55 0.00 0.23 0.00 0.00 176.35 175.21 2dca n TYR 94 N -4.09 2.51 -1.37 0.29 4.19 -1.25 -1.76 117.16 115.68 2dca n TYR 94 Ca 0.08 0.28 -0.13 0.00 3.31 0.00 0.00 57.90 61.44 2dca n TYR 94 Cb 0.54 -2.56 -0.05 0.00 0.49 0.00 0.00 39.34 37.76 2dca n TYR 94 CO 0.00 0.00 0.00 -1.71 0.91 0.00 0.00 176.86 176.06 2dca n ASN 95 N 2.68 -5.30 0.10 2.98 2.85 -1.26 -4.85 115.26 112.46 2dca n ASN 95 Ca 0.12 0.31 0.04 0.00 -0.11 0.00 0.00 54.58 54.95 2dca n ASN 95 Cb 0.33 -3.91 -0.00 0.00 1.24 0.00 0.00 39.78 37.44 2dca n ASN 95 CO 0.00 0.00 0.00 0.77 -2.11 0.00 0.00 177.26 175.92 2dca h SER 96 N 0.00 0.00 -1.36 1.20 4.64 -1.70 -3.47 113.55 112.87 2dca h SER 96 Ca -0.26 0.00 -0.39 0.00 -0.47 0.00 0.00 61.79 60.67 2dca h SER 96 Cb 1.08 0.00 -0.12 0.00 -0.31 0.00 0.00 62.40 63.05 2dca h SER 96 CO 0.38 0.37 -0.39 1.41 -0.87 0.00 0.00 176.83 177.73 2dca n HIS 97 N -2.98 -0.23 -3.48 4.77 8.25 -1.26 -4.96 115.22 115.33 2dca n HIS 97 Ca -0.02 0.00 -0.38 0.00 -0.26 0.00 0.00 57.72 57.06 2dca n HIS 97 Cb 0.71 -3.34 -0.08 0.00 1.12 0.00 0.00 29.99 28.40 2dca n HIS 97 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2dca s VAL 98 N -2.77 5.25 0.00 1.59 1.01 -1.26 -4.99 120.40 119.24 2dca s VAL 98 Ca 0.00 0.55 0.00 0.00 0.00 0.00 0.00 61.98 62.53 2dca s VAL 98 Cb 0.00 -3.66 0.00 0.00 0.00 0.00 0.00 36.38 32.72 2dca s VAL 98 CO 0.00 0.29 0.00 0.61 0.00 0.00 0.00 175.10 176.00 2dca n GLY 99 N 3.96 -1.16 0.20 4.51 0.00 -1.26 -0.29 105.19 111.15 2dca n GLY 99 Ca -0.10 -1.58 -0.15 0.00 0.00 0.00 0.00 46.02 44.19 2dca n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2dca s ARG 101 N -5.77 1.30 0.77 0.00 0.52 0.21 -0.61 118.95 115.37 2dca s ARG 101 Ca -0.15 -2.17 -0.13 0.00 -0.52 0.00 0.00 55.73 52.76 2dca s ARG 101 Cb 0.04 -2.17 0.06 0.00 0.52 0.00 0.00 34.95 33.41 2dca s ARG 101 CO 0.62 -1.24 1.17 -2.14 0.02 0.00 0.00 175.30 173.74 2dca s PRO 102 N 0.08 1.93 0.27 3.54 0.02 -1.26 -4.32 135.00 135.26 2dca s PRO 102 Ca 0.22 1.63 -0.30 0.00 0.02 0.00 0.00 61.00 62.57 2dca s PRO 102 Cb -0.14 -1.82 -0.11 0.00 0.02 0.00 0.00 34.50 32.45 2dca s PRO 102 CO -0.07 -1.97 1.52 -0.47 -0.33 0.00 0.00 177.00 175.68 2dca s TYR 103 N -2.26 2.88 -2.76 6.54 5.04 -0.39 -4.81 117.35 121.58 2dca s TYR 103 Ca 0.71 0.91 0.24 0.00 -2.44 0.00 0.00 57.07 56.49 2dca s TYR 103 Cb -0.26 -3.95 0.33 0.00 0.35 0.00 0.00 41.96 38.43 2dca s TYR 103 CO 0.49 -3.12 1.34 -1.13 -1.34 0.00 0.00 175.55 171.79 2dca n SER 104 N 2.19 3.12 -4.46 4.32 3.41 -1.26 -3.88 113.62 117.06 2dca n SER 104 Ca 0.07 -1.98 -0.36 0.00 -0.26 0.00 0.00 58.87 56.35 2dca n SER 104 Cb 0.39 -0.10 -0.12 0.00 -0.26 0.00 0.00 64.21 64.11 2dca n SER 104 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2dca s ILE 105 N -1.79 4.30 0.38 -1.33 1.01 -1.26 -5.06 121.20 117.45 2dca s ILE 105 Ca 0.33 -0.18 -0.26 0.00 0.00 0.00 0.00 60.65 60.54 2dca s ILE 105 Cb 0.21 -3.00 -0.11 0.00 0.01 0.00 0.00 42.46 39.57 2dca s ILE 105 CO 0.31 0.36 1.13 -2.65 0.00 0.00 0.00 174.94 174.09 2dca n PRO 106 N 4.71 1.65 -1.83 2.79 -0.02 -1.26 -4.66 135.00 136.38 2dca n PRO 106 Ca -0.16 0.59 -0.33 0.00 -2.02 0.00 0.00 63.50 61.57 2dca n PRO 106 Cb 0.52 -2.15 0.04 0.00 -0.02 0.00 0.00 33.50 31.88 2dca n PRO 106 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2dca s PRO 107 N -1.95 2.94 0.33 0.52 0.04 -1.26 -4.27 135.00 131.34 2dca s PRO 107 Ca 0.60 1.34 -0.07 0.00 0.04 0.00 0.00 61.00 62.90 2dca s PRO 107 Cb -0.57 -1.97 0.01 0.00 0.04 0.00 0.00 34.50 32.01 2dca s PRO 107 CO 0.59 -1.13 0.53 0.00 0.04 0.00 0.00 177.00 177.02 2dca s GLU 109 N -3.16 3.94 -0.63 0.00 0.41 0.04 -4.80 118.70 114.50 2dca s GLU 109 Ca 0.26 0.56 -0.17 0.00 -0.41 0.00 0.00 54.97 55.20 2dca s GLU 109 Cb -0.01 -3.74 0.13 0.00 -1.78 0.00 0.00 34.13 28.73 2dca s GLU 109 CO 0.16 -0.71 0.66 -1.01 -0.49 0.00 0.00 175.26 173.87 2dca s HIS 110 N 2.99 3.21 -1.44 1.61 3.76 -1.26 -1.88 115.29 122.27 2dca s HIS 110 Ca 0.32 -1.27 -0.03 0.00 -0.15 0.00 0.00 55.06 53.94 2dca s HIS 110 Cb -0.14 -3.92 0.01 0.00 1.11 0.00 0.00 32.58 29.64 2dca s HIS 110 CO 0.13 -1.16 0.23 0.72 -0.85 0.00 0.00 174.74 173.81 2dca n HIS 111 N 5.58 -1.48 -3.82 1.40 8.25 -1.26 -4.86 115.22 119.02 2dca n HIS 111 Ca -0.06 0.20 -0.10 0.00 -0.26 0.00 0.00 57.72 57.51 2dca n HIS 111 Cb 0.43 -3.61 -0.06 0.00 1.12 0.00 0.00 29.99 27.87 2dca n HIS 111 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 2dca s VAL 112 N -2.94 0.07 0.11 1.59 -7.23 -1.26 -4.86 120.40 105.89 2dca s VAL 112 Ca 0.13 -1.04 -0.07 0.00 -1.81 0.00 0.00 61.98 59.20 2dca s VAL 112 Cb -0.06 -1.55 -0.06 0.00 0.56 0.00 0.00 36.38 35.27 2dca s VAL 112 CO 0.17 -0.32 0.39 0.20 -0.31 0.00 0.00 175.10 175.22 2dca s ASN 113 N -2.89 6.55 0.03 4.85 0.01 -1.26 -4.80 114.94 117.44 2dca s ASN 113 Ca 0.10 0.68 -0.08 0.00 -0.71 0.00 0.00 52.86 52.85 2dca s ASN 113 Cb 0.02 -2.13 0.03 0.00 0.41 0.00 0.00 41.25 39.58 2dca s ASN 113 CO -0.05 0.10 0.38 0.61 -1.51 0.00 0.00 177.10 176.63 2dca n GLY 114 N 0.45 0.83 0.20 0.66 0.00 -1.26 -5.02 105.19 101.04 2dca n GLY 114 Ca -0.05 -0.96 0.09 0.00 0.00 0.00 0.00 46.02 45.10 2dca n GLY 114 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2dca h SER 115 N 0.66 0.00 -4.07 1.61 4.64 -2.01 -3.46 113.55 110.93 2dca h SER 115 Ca -0.08 0.00 -0.49 0.00 -0.47 0.00 0.00 61.79 60.74 2dca h SER 115 Cb 0.40 0.00 0.06 0.00 -0.31 0.00 0.00 62.40 62.55 2dca h SER 115 CO 0.11 0.23 0.30 -0.13 -0.87 0.00 0.00 176.83 176.48 2dca s ARG 116 N -3.27 3.19 0.64 4.77 0.52 -1.26 -5.04 118.95 118.50 2dca s ARG 116 Ca 0.04 0.36 -0.17 0.00 -0.52 0.00 0.00 55.73 55.45 2dca s ARG 116 Cb 0.08 -2.17 -0.01 0.00 0.52 0.00 0.00 34.95 33.37 2dca s ARG 116 CO 0.68 -0.68 1.16 -2.14 0.02 0.00 0.00 175.30 174.33 2dca s PRO 117 N -5.11 2.77 0.39 3.54 0.02 -1.26 -4.47 135.00 130.89 2dca s PRO 117 Ca 0.54 1.61 -0.25 0.00 0.02 0.00 0.00 61.00 62.92 2dca s PRO 117 Cb -0.11 -1.93 -0.09 0.00 0.02 0.00 0.00 34.50 32.40 2dca s PRO 117 CO 0.49 -1.31 1.16 -1.25 -0.33 0.00 0.00 177.00 175.76 2dca s PRO 118 N -3.75 4.11 0.58 5.54 0.04 -1.26 -0.78 135.00 139.47 2dca s PRO 118 Ca 0.72 1.83 -0.19 0.00 0.04 0.00 0.00 61.00 63.39 2dca s PRO 118 Cb -0.25 -2.71 -0.04 0.00 0.04 0.00 0.00 34.50 31.54 2dca s PRO 118 CO 0.38 -0.27 1.20 0.00 0.04 0.00 0.00 177.00 178.35 2dca s THR 120 N -1.60 1.50 0.42 0.00 -4.23 -1.26 -4.99 115.64 105.48 2dca s THR 120 Ca 0.76 -1.18 0.34 0.00 -1.18 0.00 0.00 61.69 60.43 2dca s THR 120 Cb -0.30 -1.76 0.52 0.00 1.34 0.00 0.00 72.50 72.30 2dca s THR 120 CO 0.33 -0.09 1.37 0.61 -0.54 0.00 0.00 174.62 176.30 2dca n GLY 121 N 4.69 -0.79 3.60 3.99 0.00 -1.26 -4.16 105.19 111.26 2dca n GLY 121 Ca -0.12 0.64 -0.43 0.00 0.00 0.00 0.00 46.02 46.11 2dca n GLY 121 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2dca s GLU 122 N -4.88 3.62 -0.17 1.61 2.02 -1.26 -4.61 118.70 115.03 2dca s GLU 122 Ca -0.06 0.83 -0.11 0.00 0.02 0.00 0.00 54.97 55.65 2dca s GLU 122 Cb 0.26 -3.99 0.06 0.00 0.10 0.00 0.00 34.13 30.56 2dca s GLU 122 CO 0.74 -1.51 0.43 0.20 0.02 0.00 0.00 175.26 175.14 2dca s GLY 123 N 3.47 -0.34 0.24 -1.39 0.00 -1.22 -4.92 107.32 103.15 2dca s GLY 123 Ca 0.57 1.48 -0.08 0.00 0.00 0.00 0.00 44.72 46.69 2dca s GLY 123 CO 0.32 1.55 0.54 0.99 0.00 0.00 0.00 173.10 176.51 2dca s ASP 124 N 1.12 6.58 -0.00 1.64 1.01 -1.26 -4.79 116.67 120.97 2dca s ASP 124 Ca -0.07 0.86 -0.30 0.00 0.71 0.00 0.00 52.55 53.75 2dca s ASP 124 Cb -0.07 -2.20 -0.05 0.00 1.01 0.00 0.00 42.92 41.61 2dca s ASP 124 CO -0.10 -0.10 1.33 -0.89 0.21 0.00 0.00 175.17 175.62 2dca s THR 125 N -1.88 3.85 0.91 -1.27 2.01 -1.26 -4.90 115.64 113.11 2dca s THR 125 Ca 0.46 1.24 -0.11 0.00 0.31 0.00 0.00 61.69 63.59 2dca s THR 125 Cb -0.11 -3.80 0.14 0.00 0.01 0.00 0.00 72.50 68.74 2dca s THR 125 CO 0.24 0.01 1.10 -2.84 -0.69 0.00 0.00 174.62 172.43 2dca s PRO 126 N 2.13 1.11 0.61 4.92 0.02 -1.26 -4.98 135.00 137.55 2dca s PRO 126 Ca 0.61 1.06 -0.17 0.00 0.02 0.00 0.00 61.00 62.52 2dca s PRO 126 Cb -0.30 -1.77 -0.02 0.00 0.02 0.00 0.00 34.50 32.42 2dca s PRO 126 CO 0.26 -2.41 1.14 0.15 -0.33 0.00 0.00 177.00 175.81 2dca s LYS 127 N -4.80 2.97 -0.62 5.54 1.02 -1.26 -4.66 119.74 117.93 2dca s LYS 127 Ca 0.64 1.57 -0.22 0.00 0.02 0.00 0.00 55.97 57.98 2dca s LYS 127 Cb -0.20 -1.96 0.07 0.00 -0.52 0.00 0.00 37.83 35.22 2dca s LYS 127 CO 0.58 -1.15 0.91 0.00 -0.92 0.00 0.00 175.35 174.78 2dca s SER 129 N 3.41 4.75 -0.97 0.00 0.15 -1.26 -4.99 113.70 114.79 2dca s SER 129 Ca 0.23 -0.36 -0.04 0.00 0.70 0.00 0.00 55.95 56.47 2dca s SER 129 Cb -0.17 -1.83 0.12 0.00 -1.71 0.00 0.00 66.02 62.43 2dca s SER 129 CO 0.12 -0.05 2.47 0.29 1.20 0.00 0.00 173.24 177.27 2dca n LYS 130 N 4.86 3.82 -3.91 5.44 5.02 -1.26 -4.86 118.16 127.26 2dca n LYS 130 Ca -0.17 -3.15 -0.09 0.00 -2.02 0.00 0.00 58.31 52.87 2dca n LYS 130 Cb 0.51 -2.43 -0.09 0.00 -0.02 0.00 0.00 35.03 32.99 2dca n LYS 130 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2dca s THR 131 N -1.92 0.13 0.36 -0.18 -4.23 -1.26 -4.72 115.64 103.82 2dca s THR 131 Ca 0.55 -1.09 0.04 0.00 -1.18 0.00 0.00 61.69 60.01 2dca s THR 131 Cb 0.27 -0.96 -0.01 0.00 1.34 0.00 0.00 72.50 73.13 2dca s THR 131 CO -0.16 -0.60 0.53 0.00 -0.54 0.00 0.00 174.62 173.85 2dca s GLU 133 N -4.28 1.76 0.33 0.00 -1.05 0.21 -4.90 118.70 110.78 2dca s GLU 133 Ca 0.44 1.76 -0.29 0.00 -0.15 0.00 0.00 54.97 56.74 2dca s GLU 133 Cb -0.10 -1.79 -0.11 0.00 -0.44 0.00 0.00 34.13 31.70 2dca s GLU 133 CO 0.33 -2.12 1.47 -1.25 0.95 0.00 0.00 175.26 174.65 2dca s PRO 134 N -4.08 4.17 0.00 -4.83 0.04 -1.26 -2.45 135.00 126.59 2dca s PRO 134 Ca 0.74 2.48 0.00 0.00 0.04 0.00 0.00 61.00 64.25 2dca s PRO 134 Cb -0.29 -3.02 0.00 0.00 0.04 0.00 0.00 34.50 31.23 2dca s PRO 134 CO 0.49 -0.48 0.00 0.41 0.04 0.00 0.00 177.00 177.46 2dca n GLY 135 N 1.13 3.35 3.81 0.56 0.00 -1.26 -5.05 105.19 107.73 2dca n GLY 135 Ca 0.03 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.69 2dca n GLY 135 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2dca s TYR 136 N -2.49 3.68 0.04 1.61 5.04 -1.03 -5.08 117.35 119.12 2dca s TYR 136 Ca 0.00 1.46 0.02 0.00 -2.44 0.00 0.00 57.07 56.11 2dca s TYR 136 Cb 0.00 -2.67 -0.02 0.00 0.35 0.00 0.00 41.96 39.61 2dca s TYR 136 CO 0.00 0.34 -0.07 -1.12 -1.34 0.00 0.00 175.55 173.36 2dca s SER 137 N -1.59 0.79 0.27 4.32 0.01 -1.26 -4.76 113.70 111.47 2dca s SER 137 Ca 0.43 -0.51 0.00 0.00 1.31 0.00 0.00 55.95 57.18 2dca s SER 137 Cb -0.18 0.03 0.00 0.00 0.21 0.00 0.00 66.02 66.09 2dca s SER 137 CO 0.22 -0.19 0.00 -0.81 0.41 0.00 0.00 173.24 172.87 2dca n PRO 138 N 1.58 0.76 -1.10 12.44 -0.04 -1.26 -5.01 135.00 142.36 2dca n PRO 138 Ca -0.22 0.00 -0.30 0.00 -0.04 0.00 0.00 63.50 62.94 2dca n PRO 138 Cb 0.55 0.00 0.15 0.00 -0.04 0.00 0.00 33.50 34.16 2dca n PRO 138 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2dca s SER 139 N -1.00 3.12 0.16 3.54 1.04 -1.26 -4.73 113.70 114.57 2dca s SER 139 Ca 0.00 1.52 -0.21 0.00 0.48 0.00 0.00 55.95 57.73 2dca s SER 139 Cb 0.00 -2.19 0.05 0.00 0.10 0.00 0.00 66.02 63.99 2dca s SER 139 CO 0.00 -2.86 1.63 0.22 0.98 0.00 0.00 173.24 173.20 2dca h TYR 140 N -1.70 -0.62 -0.83 5.02 3.20 -1.91 -0.22 116.97 119.91 2dca h TYR 140 Ca -0.51 0.04 0.02 0.00 3.14 0.00 0.00 58.73 61.42 2dca h TYR 140 Cb 1.29 0.32 -0.04 0.00 1.54 0.00 0.00 36.73 39.84 2dca h TYR 140 CO 0.40 -0.31 0.54 -0.22 -1.64 0.00 0.00 178.16 176.93 2dca h LYS 141 N -0.21 1.05 0.00 1.82 3.64 -1.92 -2.31 116.57 118.64 2dca h LYS 141 Ca 0.16 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 2dca h LYS 141 Cb 0.46 -0.24 0.00 0.00 -0.41 0.00 0.00 32.23 32.04 2dca h LYS 141 CO -0.43 0.70 0.00 0.93 -2.27 0.00 0.00 179.45 178.38 2dca h GLU 142 N 1.08 0.00 -0.19 1.90 5.08 -1.72 -3.10 114.58 117.63 2dca h GLU 142 Ca 0.31 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.67 2dca h GLU 142 Cb -0.07 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.18 2dca h GLU 142 CO -0.09 0.00 0.00 -3.47 -1.00 0.00 0.00 179.01 174.45 2dca n ASP 143 N -2.66 2.16 -4.74 1.42 2.03 -0.16 -4.90 116.55 109.70 2dca n ASP 143 Ca 0.03 -1.78 -0.41 0.00 0.52 0.00 0.00 54.79 53.15 2dca n ASP 143 Cb 0.35 -0.12 -0.03 0.00 -0.72 0.00 0.00 41.12 40.59 2dca n ASP 143 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 2dca s LYS 144 N -1.76 4.43 -0.19 -0.67 -0.14 -1.17 -4.04 119.74 116.20 2dca s LYS 144 Ca 0.34 1.97 -0.02 0.00 -1.36 0.00 0.00 55.97 56.90 2dca s LYS 144 Cb 0.19 -3.22 -0.01 0.00 -1.68 0.00 0.00 37.83 33.11 2dca s LYS 144 CO 0.28 -0.18 -0.08 -1.01 -0.76 0.00 0.00 175.35 173.60 2dca s HIS 145 N 0.06 2.91 0.03 3.18 3.76 0.11 -4.81 115.29 120.53 2dca s HIS 145 Ca 0.55 -0.83 -0.00 0.00 -0.15 0.00 0.00 55.06 54.62 2dca s HIS 145 Cb -0.35 -2.01 -0.04 0.00 1.11 0.00 0.00 32.58 31.30 2dca s HIS 145 CO 0.37 -0.42 0.15 -0.06 -0.85 0.00 0.00 174.74 173.93 2dca s PHE 146 N 1.04 3.41 0.13 1.40 0.40 -1.26 -0.40 117.98 122.70 2dca s PHE 146 Ca 0.00 0.24 -0.02 0.00 -0.60 0.00 0.00 56.93 56.55 2dca s PHE 146 Cb -0.15 -1.75 -0.05 0.00 0.51 0.00 0.00 43.02 41.58 2dca s PHE 146 CO -0.01 0.59 0.32 0.20 0.70 0.00 0.00 175.22 177.02 2dca s GLY 147 N -2.12 2.11 0.00 4.36 0.00 -0.58 -2.21 107.32 108.88 2dca s GLY 147 Ca 0.29 -0.72 0.13 0.00 0.00 0.00 0.00 44.72 44.41 2dca s GLY 147 CO 0.21 -0.67 0.92 0.00 0.00 0.00 0.00 173.10 173.56 2dca s SER 149 N -1.06 -0.63 -0.06 0.00 1.04 -1.13 -4.94 113.70 106.93 2dca s SER 149 Ca 0.15 0.90 -0.02 0.00 0.48 0.00 0.00 55.95 57.46 2dca s SER 149 Cb 0.11 0.81 0.03 0.00 0.10 0.00 0.00 66.02 67.07 2dca s SER 149 CO 0.16 -0.43 0.06 -0.55 0.98 0.00 0.00 173.24 173.46 2dca s SER 150 N -0.60 1.35 0.23 7.02 0.15 -1.26 -2.21 113.70 118.38 2dca s SER 150 Ca -0.05 -0.03 -0.01 0.00 0.70 0.00 0.00 55.95 56.56 2dca s SER 150 Cb -0.02 -0.19 -0.03 0.00 -1.71 0.00 0.00 66.02 64.06 2dca s SER 150 CO 0.05 -0.26 0.20 -0.72 1.20 0.00 0.00 173.24 173.71 2dca s TYR 151 N 2.14 1.18 -0.11 3.44 -0.85 -0.36 -4.99 117.35 117.79 2dca s TYR 151 Ca 0.05 -1.37 0.02 0.00 -0.52 0.00 0.00 57.07 55.25 2dca s TYR 151 Cb -0.13 -0.50 -0.01 0.00 0.38 0.00 0.00 41.96 41.71 2dca s TYR 151 CO -0.04 -0.73 -0.18 -1.12 -1.52 0.00 0.00 175.55 171.96 2dca s SER 152 N -3.19 3.61 0.03 -0.18 0.01 -1.26 -1.80 113.70 110.92 2dca s SER 152 Ca 0.37 -0.42 -0.20 0.00 1.31 0.00 0.00 55.95 57.01 2dca s SER 152 Cb 0.05 -1.49 -0.06 0.00 0.21 0.00 0.00 66.02 64.73 2dca s SER 152 CO 0.15 0.17 0.60 -0.69 0.41 0.00 0.00 173.24 173.87 2dca s VAL 153 N 0.31 4.83 0.77 3.43 1.01 -0.17 -4.99 120.40 125.59 2dca s VAL 153 Ca -0.14 1.26 -0.14 0.00 0.00 0.00 0.00 61.98 62.96 2dca s VAL 153 Cb -0.17 -3.93 0.05 0.00 0.00 0.00 0.00 36.38 32.33 2dca s VAL 153 CO 0.07 0.46 1.16 0.00 0.00 0.00 0.00 175.10 176.79 2dca n ALA 154 N 2.37 0.06 -1.41 5.51 0.00 -1.26 -4.29 120.51 121.49 2dca n ALA 154 Ca -0.08 -0.26 -0.43 0.00 0.00 0.00 0.00 53.44 52.68 2dca n ALA 154 Cb 0.51 -2.23 -0.03 0.00 0.00 0.00 0.00 19.45 17.70 2dca n ALA 154 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 2dca n ASN 155 N -2.73 3.18 -3.58 0.00 2.85 -1.26 -4.64 115.26 109.09 2dca n ASN 155 Ca 0.14 -2.75 -0.21 0.00 -0.11 0.00 0.00 54.58 51.64 2dca n ASN 155 Cb 0.50 -1.36 -0.15 0.00 1.24 0.00 0.00 39.78 40.00 2dca n ASN 155 CO 0.00 0.00 0.00 0.21 -2.11 0.00 0.00 177.26 175.36 2dca s ASN 156 N 4.15 1.67 0.22 1.20 3.84 -1.26 -5.00 114.94 119.76 2dca s ASN 156 Ca 0.53 -0.28 -0.15 0.00 0.21 0.00 0.00 52.86 53.16 2dca s ASN 156 Cb 0.14 0.08 0.25 0.00 -0.55 0.00 0.00 41.25 41.17 2dca s ASN 156 CO 0.02 -0.32 1.59 -0.08 -2.79 0.00 0.00 177.10 175.53 2dca h GLU 157 N 8.37 -0.05 -0.63 0.43 4.81 -1.94 0.01 114.58 125.57 2dca h GLU 157 Ca -0.15 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.03 2dca h GLU 157 Cb 1.14 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 30.51 2dca h GLU 157 CO 0.26 -0.03 0.20 0.87 -0.73 0.00 0.00 179.01 179.57 2dca h LYS 158 N -0.05 0.99 -0.45 1.92 6.56 -1.97 -0.32 116.57 123.25 2dca h LYS 158 Ca 0.32 -0.21 -0.09 0.00 -1.06 0.00 0.00 60.65 59.61 2dca h LYS 158 Cb 0.56 -0.14 -0.02 0.00 -0.57 0.00 0.00 32.23 32.05 2dca h LYS 158 CO -0.76 0.87 -0.07 0.93 -2.06 0.00 0.00 179.45 178.36 2dca h GLU 159 N 0.91 0.78 -0.31 3.15 5.08 -1.65 0.85 114.58 123.40 2dca h GLU 159 Ca 0.21 -0.24 -0.06 0.00 -1.00 0.00 0.00 59.36 58.26 2dca h GLU 159 Cb 0.29 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 2dca h GLU 159 CO -0.01 0.83 -0.05 0.82 -1.00 0.00 0.00 179.01 179.60 2dca h ILE 160 N 0.72 1.27 -0.56 3.13 5.03 -0.77 -0.54 117.51 125.79 2dca h ILE 160 Ca 0.13 -1.07 -0.02 0.00 -0.12 0.00 0.00 64.86 63.78 2dca h ILE 160 Cb 0.53 1.35 -0.03 0.00 -3.03 0.00 0.00 36.82 35.64 2dca h ILE 160 CO 0.03 0.34 0.29 0.24 -0.68 0.00 0.00 178.15 178.37 2dca h MET 161 N 0.36 0.79 -0.72 2.37 2.86 -0.82 -1.83 114.93 117.94 2dca h MET 161 Ca 0.08 -0.11 -0.02 0.00 -2.06 0.00 0.00 59.70 57.60 2dca h MET 161 Cb 0.53 -0.15 -0.03 0.00 0.06 0.00 0.00 31.60 32.01 2dca h MET 161 CO 0.03 0.63 0.39 0.00 1.06 0.00 0.00 176.91 179.02 2dca h ALA 162 N 1.12 0.93 -0.08 6.32 0.00 -0.68 0.55 119.26 127.42 2dca h ALA 162 Ca 0.19 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2dca h ALA 162 Cb 0.09 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 2dca h ALA 162 CO -0.03 0.45 0.05 1.49 0.00 0.00 0.00 179.25 181.21 2dca h GLU 163 N 1.00 0.10 0.02 0.00 4.57 -0.78 -1.11 114.58 118.38 2dca h GLU 163 Ca 0.25 -0.01 -0.00 0.00 -1.18 0.00 0.00 59.36 58.43 2dca h GLU 163 Cb 0.04 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 28.61 2dca h GLU 163 CO -0.04 0.07 -0.01 0.82 -1.18 0.00 0.00 179.01 178.67 2dca h ILE 164 N 0.11 1.07 -0.83 2.32 2.04 -1.10 0.17 117.51 121.28 2dca h ILE 164 Ca 0.03 -0.27 0.14 0.00 1.00 0.00 0.00 64.86 65.76 2dca h ILE 164 Cb -0.01 1.25 -0.09 0.00 -0.74 0.00 0.00 36.82 37.24 2dca h ILE 164 CO -0.01 0.07 0.42 0.22 0.00 0.00 0.00 178.15 178.85 2dca h TYR 165 N -0.14 0.74 0.07 1.37 5.03 -0.74 0.53 116.97 123.83 2dca h TYR 165 Ca -0.00 0.03 -0.27 0.00 2.58 0.00 0.00 58.73 61.07 2dca h TYR 165 Cb 0.13 -0.20 -0.02 0.00 1.55 0.00 0.00 36.73 38.19 2dca h TYR 165 CO -0.04 0.18 -1.43 -0.22 -1.32 0.00 0.00 178.16 175.32 2dca h LYS 166 N 0.61 0.15 -0.01 1.82 3.64 -1.08 -3.42 116.57 118.27 2dca h LYS 166 Ca 0.45 -0.25 0.00 0.00 -1.27 0.00 0.00 60.65 59.58 2dca h LYS 166 Cb 0.63 0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.54 2dca h LYS 166 CO -0.36 1.12 -0.28 0.09 -2.27 0.00 0.00 179.45 177.75 2dca n ASN 167 N -4.04 1.46 0.00 4.20 5.03 0.57 -5.10 115.26 117.39 2dca n ASN 167 Ca -0.29 -1.23 0.00 0.00 0.87 0.00 0.00 54.58 53.93 2dca n ASN 167 Cb 0.84 0.46 0.00 0.00 -1.02 0.00 0.00 39.78 40.06 2dca n ASN 167 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2dca n GLY 168 N 1.04 0.55 3.57 7.41 0.00 0.17 -4.81 105.19 113.12 2dca n GLY 168 Ca 0.06 -2.16 -0.40 0.00 0.00 0.00 0.00 46.02 43.52 2dca n GLY 168 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2dca n PRO 169 N -0.15 0.96 -4.56 1.61 -0.02 -1.26 -4.08 135.00 127.50 2dca n PRO 169 Ca 0.00 0.36 -0.26 0.00 -2.02 0.00 0.00 63.50 61.58 2dca n PRO 169 Cb 0.00 -1.96 -0.11 0.00 -0.02 0.00 0.00 33.50 31.41 2dca n PRO 169 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 2dca s VAL 170 N -1.46 1.70 -0.04 -1.45 -7.23 -0.80 -4.85 120.40 106.27 2dca s VAL 170 Ca 0.68 -2.00 -0.03 0.00 -1.81 0.00 0.00 61.98 58.83 2dca s VAL 170 Cb -0.49 -2.92 -0.04 0.00 0.56 0.00 0.00 36.38 33.49 2dca s VAL 170 CO 0.53 0.00 0.11 -0.70 -0.31 0.00 0.00 175.10 174.73 2dca s GLU 171 N -3.78 3.23 0.32 4.82 2.12 -0.68 -1.17 118.70 123.56 2dca s GLU 171 Ca 0.35 -0.35 0.04 0.00 0.36 0.00 0.00 54.97 55.37 2dca s GLU 171 Cb 0.09 -2.98 -0.02 0.00 0.26 0.00 0.00 34.13 31.48 2dca s GLU 171 CO 0.17 0.69 0.32 0.20 -0.54 0.00 0.00 175.26 176.11 2dca s GLY 172 N -1.50 2.02 -0.02 -1.50 0.00 -0.31 -1.20 107.32 104.81 2dca s GLY 172 Ca 0.21 -1.89 -0.17 0.00 0.00 0.00 0.00 44.72 42.87 2dca s GLY 172 CO 0.11 -1.33 0.36 0.00 0.00 0.00 0.00 173.10 172.24 2dca s ALA 173 N -3.39 -0.93 0.17 3.20 0.00 -1.25 -0.31 121.76 119.24 2dca s ALA 173 Ca 0.38 0.47 -0.12 0.00 0.00 0.00 0.00 51.96 52.69 2dca s ALA 173 Cb 0.02 0.07 0.00 0.00 0.00 0.00 0.00 23.12 23.21 2dca s ALA 173 CO 0.24 -0.28 0.35 -0.59 0.00 0.00 0.00 175.76 175.49 2dca s PHE 174 N -1.31 0.21 -0.12 0.00 -0.71 -0.62 -3.90 117.98 111.52 2dca s PHE 174 Ca -0.13 -0.57 -0.28 0.00 -1.04 0.00 0.00 56.93 54.91 2dca s PHE 174 Cb -0.04 0.09 -0.01 0.00 -1.21 0.00 0.00 43.02 41.84 2dca s PHE 174 CO 0.05 -0.76 0.94 -1.12 -1.34 0.00 0.00 175.22 172.99 2dca s SER 175 N -2.93 7.14 -0.18 1.98 0.01 -0.00 -0.91 113.70 118.81 2dca s SER 175 Ca 0.13 1.40 -0.14 0.00 1.31 0.00 0.00 55.95 58.65 2dca s SER 175 Cb 0.02 -2.52 -0.04 0.00 0.21 0.00 0.00 66.02 63.69 2dca s SER 175 CO -0.02 -0.42 0.32 -0.69 0.41 0.00 0.00 173.24 172.84 2dca s VAL 176 N 2.01 5.28 0.19 3.43 1.01 0.15 -4.89 120.40 127.57 2dca s VAL 176 Ca 0.45 0.57 0.09 0.00 0.00 0.00 0.00 61.98 63.08 2dca s VAL 176 Cb -0.18 -3.65 -0.04 0.00 0.00 0.00 0.00 36.38 32.51 2dca s VAL 176 CO 0.16 0.34 -0.06 -0.31 0.00 0.00 0.00 175.10 175.23 2dca s TYR 177 N 0.80 2.70 0.51 5.22 1.51 -1.26 0.56 117.35 127.39 2dca s TYR 177 Ca 0.17 -0.20 0.29 0.00 -1.01 0.00 0.00 57.07 56.32 2dca s TYR 177 Cb -0.14 -1.30 1.41 0.00 -0.11 0.00 0.00 41.96 41.82 2dca s TYR 177 CO 0.05 0.53 1.87 0.66 -1.11 0.00 0.00 175.55 177.55 2dca h SER 178 N 2.71 0.09 0.66 2.29 4.64 -1.39 -0.39 113.55 122.16 2dca h SER 178 Ca -0.46 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 2dca h SER 178 Cb 1.21 -0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 2dca h SER 178 CO 0.56 0.03 0.00 -2.24 -0.87 0.00 0.00 176.83 174.31 2dca h ASP 179 N 0.08 0.00 0.39 4.97 -0.00 -1.86 -2.22 116.42 117.79 2dca h ASP 179 Ca 0.46 0.00 -0.15 0.00 -0.00 0.00 0.00 57.03 57.34 2dca h ASP 179 Cb 1.67 0.00 -0.01 0.00 -0.00 0.00 0.00 39.33 40.99 2dca h ASP 179 CO -0.05 0.00 -0.61 0.15 -0.00 0.00 0.00 179.24 178.73 2dca h PHE 180 N 0.00 0.28 -0.65 4.15 3.04 -1.36 -3.20 116.94 119.19 2dca h PHE 180 Ca 0.00 -0.11 0.17 0.00 3.98 0.00 0.00 57.97 62.01 2dca h PHE 180 Cb 0.33 -0.05 -0.03 0.00 2.56 0.00 0.00 35.95 38.76 2dca h PHE 180 CO 0.00 0.77 0.46 -0.07 -2.02 0.00 0.00 178.31 177.44 2dca h LEU 181 N 0.16 0.10 -2.42 0.59 3.38 -1.51 -1.41 115.31 114.21 2dca h LEU 181 Ca -0.01 0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2dca h LEU 181 Cb 1.11 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.85 2dca h LEU 181 CO 0.09 0.05 0.00 0.18 0.09 0.00 0.00 178.44 178.85 2dca n LEU 182 N -4.39 3.55 -4.65 1.67 4.77 -1.21 -4.89 117.00 111.85 2dca n LEU 182 Ca 0.12 -1.78 -0.44 0.00 -0.03 0.00 0.00 56.01 53.89 2dca n LEU 182 Cb 0.64 -0.45 -0.01 0.00 -2.33 0.00 0.00 43.42 41.27 2dca n LEU 182 CO 0.36 0.84 0.78 0.00 -1.33 0.00 0.00 177.39 178.04 2dca n TYR 183 N 1.31 1.86 0.00 -1.77 9.36 -0.53 -4.90 117.16 122.49 2dca n TYR 183 Ca 0.22 0.60 0.00 0.00 3.32 0.00 0.00 57.90 62.04 2dca n TYR 183 Cb 0.58 -2.35 0.00 0.00 -0.63 0.00 0.00 39.34 36.94 2dca n TYR 183 CO 0.00 0.00 0.00 1.63 0.22 0.00 0.00 176.86 178.71 2dca n LYS 184 N 0.80 0.00 -3.84 2.98 4.01 -1.26 -3.40 118.16 117.45 2dca n LYS 184 Ca 0.08 0.00 -0.05 0.00 -0.51 0.00 0.00 58.31 57.82 2dca n LYS 184 Cb 0.34 -0.66 0.01 0.00 -0.51 0.00 0.00 35.03 34.21 2dca n LYS 184 CO 0.00 0.00 0.00 -1.54 -1.11 0.00 0.00 177.40 174.75 2dca s SER 185 N -3.65 -0.03 0.03 4.39 1.04 -1.26 -3.22 113.70 111.00 2dca s SER 185 Ca 0.00 -0.80 0.00 0.00 0.48 0.00 0.00 55.95 55.63 2dca s SER 185 Cb 0.00 0.63 0.00 0.00 0.10 0.00 0.00 66.02 66.75 2dca s SER 185 CO 0.00 -1.24 0.00 0.61 0.98 0.00 0.00 173.24 173.59 2dca n GLY 186 N -0.61 -2.12 3.55 7.32 0.00 -1.26 -4.75 105.19 107.33 2dca n GLY 186 Ca -0.05 -1.44 -0.41 0.00 0.00 0.00 0.00 46.02 44.11 2dca n GLY 186 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2dca s VAL 187 N -0.28 5.08 0.16 1.61 1.01 -1.26 -4.12 120.40 122.60 2dca s VAL 187 Ca 0.00 0.21 -0.31 0.00 0.00 0.00 0.00 61.98 61.88 2dca s VAL 187 Cb 0.00 -3.90 -0.09 0.00 0.00 0.00 0.00 36.38 32.39 2dca s VAL 187 CO 0.00 -0.16 1.39 -0.47 0.00 0.00 0.00 175.10 175.86 2dca s TYR 188 N 2.22 3.20 -0.04 5.22 6.14 0.58 -4.79 117.35 129.89 2dca s TYR 188 Ca 0.16 1.00 -0.01 0.00 0.64 0.00 0.00 57.07 58.86 2dca s TYR 188 Cb -0.16 -3.71 0.03 0.00 0.42 0.00 0.00 41.96 38.54 2dca s TYR 188 CO 0.12 -2.40 0.03 -0.65 0.64 0.00 0.00 175.55 173.29 2dca s GLN 189 N 0.58 0.16 -0.03 4.97 -0.21 -1.26 -2.06 119.66 121.81 2dca s GLN 189 Ca 0.62 0.20 -0.30 0.00 0.02 0.00 0.00 55.36 55.90 2dca s GLN 189 Cb -0.38 -0.52 -0.05 0.00 1.00 0.00 0.00 33.01 33.06 2dca s GLN 189 CO 0.34 -0.23 1.50 -1.58 -2.12 0.00 0.00 175.29 173.21 2dca s HIS 190 N 1.54 2.49 0.00 0.91 5.65 -1.26 -4.87 115.29 119.75 2dca s HIS 190 Ca -0.03 0.56 0.00 0.00 0.25 0.00 0.00 55.06 55.84 2dca s HIS 190 Cb -0.13 -3.77 0.00 0.00 -1.18 0.00 0.00 32.58 27.50 2dca s HIS 190 CO -0.03 -3.02 0.00 1.33 -0.65 0.00 0.00 174.74 172.37 2dca n VAL 191 N 5.04 0.00 -3.86 0.89 0.24 -1.26 -5.12 118.33 114.25 2dca n VAL 191 Ca 0.15 0.00 -0.07 0.00 -2.04 0.00 0.00 64.34 62.38 2dca n VAL 191 Cb 0.43 -0.01 -0.02 0.00 -1.47 0.00 0.00 33.84 32.77 2dca n VAL 191 CO 0.00 0.00 0.00 -0.55 -2.14 0.00 0.00 176.83 174.14 2dca s SER 192 N -1.63 -0.25 0.00 -1.34 0.15 -1.26 -5.15 113.70 104.23 2dca s SER 192 Ca 0.00 -0.63 0.00 0.00 0.70 0.00 0.00 55.95 56.02 2dca s SER 192 Cb 0.00 0.73 0.00 0.00 -1.71 0.00 0.00 66.02 65.04 2dca s SER 192 CO 0.00 -1.34 0.00 0.61 1.20 0.00 0.00 173.24 173.71 2dca n GLY 193 N -0.46 2.47 3.77 9.45 0.00 -1.26 -3.23 105.19 115.93 2dca n GLY 193 Ca -0.04 -1.68 -0.36 0.00 0.00 0.00 0.00 46.02 43.95 2dca n GLY 193 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2dca s GLU 194 N -4.36 3.48 0.18 1.61 -1.05 -1.26 -4.38 118.70 112.91 2dca s GLU 194 Ca 0.00 1.67 -0.30 0.00 -0.15 0.00 0.00 54.97 56.19 2dca s GLU 194 Cb 0.00 -2.14 -0.08 0.00 -0.44 0.00 0.00 34.13 31.47 2dca s GLU 194 CO 0.00 -0.76 1.30 -1.50 0.95 0.00 0.00 175.26 175.25 2dca s ILE 195 N -1.69 3.32 -0.12 1.83 -1.16 -1.26 -1.27 121.20 120.84 2dca s ILE 195 Ca 0.70 1.06 0.19 0.00 -0.51 0.00 0.00 60.65 62.09 2dca s ILE 195 Cb -0.26 -3.68 -0.24 0.00 0.61 0.00 0.00 42.46 38.90 2dca s ILE 195 CO 0.30 0.14 0.45 0.23 -2.81 0.00 0.00 174.94 173.25 2dca n MET 196 N 2.87 0.66 0.00 3.50 2.81 0.19 -4.91 117.12 122.24 2dca n MET 196 Ca 0.07 0.01 0.00 0.00 -1.81 0.00 0.00 57.70 55.97 2dca n MET 196 Cb 0.43 -1.62 0.00 0.00 -0.71 0.00 0.00 33.22 31.32 2dca n MET 196 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2dca n GLY 197 N 1.48 0.94 3.84 3.03 0.00 -1.18 -4.99 105.19 108.31 2dca n GLY 197 Ca -0.16 -2.04 -0.32 0.00 0.00 0.00 0.00 46.02 43.50 2dca n GLY 197 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2dca s GLY 198 N 0.00 1.98 -0.13 -0.02 0.00 -1.26 -0.67 107.32 107.21 2dca s GLY 198 Ca 0.00 0.17 -0.05 0.00 0.00 0.00 0.00 44.72 44.84 2dca s GLY 198 CO 0.00 0.46 0.27 -1.58 0.00 0.00 0.00 173.10 172.25 2dca s HIS 199 N -2.72 -0.43 -0.04 1.90 5.04 -0.09 -4.83 115.29 114.12 2dca s HIS 199 Ca 0.59 0.98 -0.17 0.00 -1.54 0.00 0.00 55.06 54.92 2dca s HIS 199 Cb -0.12 0.01 -0.05 0.00 0.04 0.00 0.00 32.58 32.46 2dca s HIS 199 CO 0.38 -0.34 0.48 0.00 -2.34 0.00 0.00 174.74 172.92 2dca s ALA 200 N 2.16 3.57 0.14 1.58 0.00 -1.26 -1.60 121.76 126.35 2dca s ALA 200 Ca -0.01 -0.14 0.03 0.00 0.00 0.00 0.00 51.96 51.84 2dca s ALA 200 Cb -0.12 -2.57 -0.01 0.00 0.00 0.00 0.00 23.12 20.42 2dca s ALA 200 CO -0.09 0.24 0.12 0.44 0.00 0.00 0.00 175.76 176.47 2dca n ILE 201 N 2.64 0.00 -4.11 0.00 -6.64 0.57 -4.57 119.36 107.26 2dca n ILE 201 Ca -0.10 -1.04 -0.33 0.00 -1.77 0.00 0.00 62.75 59.51 2dca n ILE 201 Cb 0.52 0.52 -0.16 0.00 -1.44 0.00 0.00 39.64 39.08 2dca n ILE 201 CO 0.00 0.00 0.00 -0.60 -1.77 0.00 0.00 176.55 174.18 2dca s ARG 202 N -2.58 2.88 -0.29 6.28 3.52 -1.13 -1.16 118.95 126.47 2dca s ARG 202 Ca 0.17 -0.91 -0.15 0.00 -0.13 0.00 0.00 55.73 54.72 2dca s ARG 202 Cb 0.01 -2.63 -0.03 0.00 -1.56 0.00 0.00 34.95 30.74 2dca s ARG 202 CO 0.12 -0.27 0.36 0.42 -0.81 0.00 0.00 175.30 175.12 2dca s ILE 203 N 1.27 5.18 -0.12 4.11 1.01 -0.32 -0.64 121.20 131.68 2dca s ILE 203 Ca 0.03 0.38 0.10 0.00 0.00 0.00 0.00 60.65 61.16 2dca s ILE 203 Cb -0.14 -3.73 0.18 0.00 0.01 0.00 0.00 42.46 38.78 2dca s ILE 203 CO -0.11 0.08 1.11 0.00 0.00 0.00 0.00 174.94 176.01 2dca n LEU 204 N 5.34 2.33 0.00 2.97 -0.00 -0.46 -1.90 117.00 125.28 2dca n LEU 204 Ca -0.09 -2.54 0.00 0.00 -0.00 0.00 0.00 56.01 53.38 2dca n LEU 204 Cb 0.50 -0.23 0.00 0.00 -0.00 0.00 0.00 43.42 43.69 2dca n LEU 204 CO 0.38 0.62 0.00 0.61 -0.00 0.00 0.00 177.39 179.00 2dca n GLY 205 N -0.85 -1.30 3.82 1.47 0.00 -1.22 -1.39 105.19 105.73 2dca n GLY 205 Ca 0.09 -1.13 -0.07 0.00 0.00 0.00 0.00 46.02 44.91 2dca n GLY 205 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 2dca s TRP 206 N -3.00 -0.21 0.00 1.61 -2.14 0.16 -0.26 118.94 115.10 2dca s TRP 206 Ca 0.00 -0.22 0.00 0.00 2.66 0.00 0.00 56.10 58.54 2dca s TRP 206 Cb 0.00 0.69 0.00 0.00 -3.10 0.00 0.00 33.47 31.06 2dca s TRP 206 CO 0.00 -1.17 0.00 0.41 -2.66 0.00 0.00 176.95 173.53 2dca n GLY 207 N -0.45 1.09 2.74 3.67 0.00 -0.81 -1.07 105.19 110.36 2dca n GLY 207 Ca -0.05 -0.77 -0.20 0.00 0.00 0.00 0.00 46.02 45.00 2dca n GLY 207 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2dca s VAL 208 N -2.31 0.10 -0.22 1.61 1.01 -1.26 -0.91 120.40 118.42 2dca s VAL 208 Ca 0.00 0.25 0.01 0.00 0.00 0.00 0.00 61.98 62.24 2dca s VAL 208 Cb 0.00 -0.29 0.03 0.00 0.00 0.00 0.00 36.38 36.13 2dca s VAL 208 CO 0.00 0.19 -0.14 -0.70 0.00 0.00 0.00 175.10 174.45 2dca s GLU 209 N 1.82 2.70 -1.41 2.72 2.12 -0.23 -4.70 118.70 121.72 2dca s GLU 209 Ca 0.01 -1.04 -0.06 0.00 0.36 0.00 0.00 54.97 54.24 2dca s GLU 209 Cb -0.12 -2.77 0.04 0.00 0.26 0.00 0.00 34.13 31.53 2dca s GLU 209 CO -0.03 -0.37 0.84 0.09 -0.54 0.00 0.00 175.26 175.24 2dca n ASN 210 N 4.57 -2.94 0.00 -1.70 4.13 -1.26 -0.95 115.26 117.11 2dca n ASN 210 Ca -0.18 -0.79 0.00 0.00 1.68 0.00 0.00 54.58 55.29 2dca n ASN 210 Cb 0.47 -4.03 0.00 0.00 -1.54 0.00 0.00 39.78 34.68 2dca n ASN 210 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2dca n GLY 211 N -1.65 1.63 3.49 7.41 0.00 -1.26 -4.99 105.19 109.82 2dca n GLY 211 Ca -0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.46 2dca n GLY 211 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2dca s THR 212 N -3.38 5.26 0.34 2.61 2.01 -0.12 -5.06 115.64 117.29 2dca s THR 212 Ca 0.00 -0.48 -0.28 0.00 0.31 0.00 0.00 61.69 61.24 2dca s THR 212 Cb 0.00 -3.86 -0.10 0.00 0.01 0.00 0.00 72.50 68.55 2dca s THR 212 CO 0.00 -0.21 1.29 -2.16 -0.69 0.00 0.00 174.62 172.85 2dca s PRO 213 N 1.72 4.32 0.18 4.92 0.04 -1.26 -1.07 135.00 143.86 2dca s PRO 213 Ca 0.06 2.18 -0.07 0.00 0.04 0.00 0.00 61.00 63.20 2dca s PRO 213 Cb -0.18 -3.03 -0.02 0.00 0.04 0.00 0.00 34.50 31.31 2dca s PRO 213 CO 0.10 -0.20 0.27 1.52 0.04 0.00 0.00 177.00 178.73 2dca s TYR 214 N -1.16 0.59 -0.09 0.56 -0.85 -0.09 -1.28 117.35 115.03 2dca s TYR 214 Ca 0.50 -0.93 -0.02 0.00 -0.52 0.00 0.00 57.07 56.10 2dca s TYR 214 Cb -0.39 -0.15 -0.03 0.00 0.38 0.00 0.00 41.96 41.76 2dca s TYR 214 CO 0.51 -0.74 0.01 -1.58 -1.52 0.00 0.00 175.55 172.23 2dca s TRP 215 N -4.02 3.17 -0.30 -3.49 0.52 0.16 -1.92 118.94 113.05 2dca s TRP 215 Ca 0.23 0.20 -0.19 0.00 0.02 0.00 0.00 56.10 56.36 2dca s TRP 215 Cb 0.04 -1.80 -0.01 0.00 -1.15 0.00 0.00 33.47 30.55 2dca s TRP 215 CO 0.04 0.47 0.58 -1.17 0.02 0.00 0.00 176.95 176.90 2dca s LEU 216 N -0.86 4.15 -0.00 2.99 2.96 0.64 -2.47 118.68 126.08 2dca s LEU 216 Ca 0.13 0.39 0.06 0.00 -0.22 0.00 0.00 54.13 54.50 2dca s LEU 216 Cb -0.11 -2.74 -0.02 0.00 0.50 0.00 0.00 46.19 43.82 2dca s LEU 216 CO 0.02 -0.43 -0.20 -0.69 -1.32 0.00 0.00 176.35 173.73 2dca s VAL 217 N 2.50 1.61 -0.26 1.68 1.01 0.08 -1.35 120.40 125.67 2dca s VAL 217 Ca 0.23 -0.94 -0.09 0.00 0.00 0.00 0.00 61.98 61.19 2dca s VAL 217 Cb -0.15 -1.35 -0.04 0.00 0.00 0.00 0.00 36.38 34.84 2dca s VAL 217 CO 0.11 0.39 0.11 -0.83 0.00 0.00 0.00 175.10 174.88 2dca s GLY 218 N -0.64 1.83 0.60 4.51 0.00 0.18 -0.68 107.32 113.12 2dca s GLY 218 Ca 0.08 -1.10 -0.01 0.00 0.00 0.00 0.00 44.72 43.69 2dca s GLY 218 CO -0.00 0.55 0.85 0.21 0.00 0.00 0.00 173.10 174.71 2dca s ASN 219 N 1.60 5.09 -0.38 1.64 3.84 -0.54 -2.85 114.94 123.34 2dca s ASN 219 Ca 0.06 0.05 0.06 0.00 0.21 0.00 0.00 52.86 53.24 2dca s ASN 219 Cb -0.15 -0.84 0.44 0.00 -0.55 0.00 0.00 41.25 40.15 2dca s ASN 219 CO 0.06 -1.31 1.21 -1.54 -2.79 0.00 0.00 177.10 172.73 2dca n SER 220 N -2.51 5.02 -1.15 -4.21 3.41 -1.26 -4.38 113.62 108.54 2dca n SER 220 Ca 0.09 -3.74 -0.05 0.00 -0.26 0.00 0.00 58.87 54.90 2dca n SER 220 Cb 0.60 -0.43 0.16 0.00 -0.26 0.00 0.00 64.21 64.28 2dca n SER 220 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 2dca n TRP 221 N -0.62 1.05 -0.54 7.33 8.01 -1.20 -1.29 117.44 130.18 2dca n TRP 221 Ca 0.43 -1.76 0.07 0.00 -1.31 0.00 0.00 57.50 54.94 2dca n TRP 221 Cb 0.82 -0.38 -0.02 0.00 -2.01 0.00 0.00 31.31 29.71 2dca n TRP 221 CO 0.00 0.00 0.00 -1.71 -1.01 0.00 0.00 177.69 174.97 2dca n ASN 222 N -1.02 -3.24 0.09 -0.99 2.85 -0.63 -4.30 115.26 108.02 2dca n ASN 222 Ca 0.30 0.28 0.13 0.00 -0.11 0.00 0.00 54.58 55.18 2dca n ASN 222 Cb 0.85 -1.69 0.34 0.00 1.24 0.00 0.00 39.78 40.53 2dca n ASN 222 CO 0.00 0.00 0.00 0.35 -2.11 0.00 0.00 177.26 175.50 2dca n THR 223 N -2.58 0.51 1.00 -0.44 -2.24 -1.26 -3.72 114.28 105.53 2dca n THR 223 Ca -0.00 -0.27 0.09 0.00 -2.27 0.00 0.00 64.05 61.59 2dca n THR 223 Cb 0.25 -0.44 0.28 0.00 -2.10 0.00 0.00 70.33 68.31 2dca n THR 223 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 2dca n ASP 224 N -2.19 1.91 -4.75 3.42 5.75 -1.26 -3.12 116.55 116.31 2dca n ASP 224 Ca 0.05 -1.85 -0.34 0.00 -0.01 0.00 0.00 54.79 52.64 2dca n ASP 224 Cb 0.43 -0.18 -0.08 0.00 -1.03 0.00 0.00 41.12 40.26 2dca n ASP 224 CO 0.00 0.00 0.00 0.86 -0.11 0.00 0.00 177.20 177.95 2dca s TRP 225 N -1.65 3.25 0.00 2.11 -0.00 -1.24 -4.95 118.94 116.46 2dca s TRP 225 Ca 0.30 0.23 0.00 0.00 -0.00 0.00 0.00 56.10 56.62 2dca s TRP 225 Cb 0.16 -1.77 0.00 0.00 -0.00 0.00 0.00 33.47 31.86 2dca s TRP 225 CO 0.23 0.53 0.00 0.41 -0.00 0.00 0.00 176.95 178.12 2dca n GLY 226 N 1.65 2.75 3.36 5.86 0.00 -1.22 -0.77 105.19 116.82 2dca n GLY 226 Ca -0.16 -0.40 -0.45 0.00 0.00 0.00 0.00 46.02 45.01 2dca n GLY 226 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2dca n ASP 227 N 0.76 5.45 -2.16 1.61 2.03 -0.37 -4.48 116.55 119.38 2dca n ASP 227 Ca 0.00 -3.03 -0.19 0.00 0.52 0.00 0.00 54.79 52.08 2dca n ASP 227 Cb 0.00 -1.44 -0.01 0.00 -0.72 0.00 0.00 41.12 38.94 2dca n ASP 227 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 2dca n ASN 228 N 3.65 -5.56 0.00 1.67 5.03 -1.25 -1.66 115.26 117.15 2dca n ASN 228 Ca 0.29 0.02 0.00 0.00 0.87 0.00 0.00 54.58 55.75 2dca n ASN 228 Cb 0.40 -4.61 0.00 0.00 -1.02 0.00 0.00 39.78 34.55 2dca n ASN 228 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2dca n GLY 229 N -0.99 2.43 3.95 7.41 0.00 0.05 -4.64 105.19 113.40 2dca n GLY 229 Ca -0.23 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.60 2dca n GLY 229 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2dca s PHE 230 N -2.58 2.84 0.15 1.61 0.40 -0.66 -1.47 117.98 118.27 2dca s PHE 230 Ca 0.00 -0.39 -0.18 0.00 -0.60 0.00 0.00 56.93 55.76 2dca s PHE 230 Cb 0.00 -2.20 0.04 0.00 0.51 0.00 0.00 43.02 41.37 2dca s PHE 230 CO 0.00 -0.21 0.48 -0.59 0.70 0.00 0.00 175.22 175.60 2dca s PHE 231 N -2.35 -0.29 -0.02 0.36 -0.71 0.14 -1.24 117.98 113.87 2dca s PHE 231 Ca 0.50 -0.01 0.06 0.00 -1.04 0.00 0.00 56.93 56.45 2dca s PHE 231 Cb -0.08 0.37 -0.02 0.00 -1.21 0.00 0.00 43.02 42.08 2dca s PHE 231 CO 0.31 -0.79 -0.21 0.15 -1.34 0.00 0.00 175.22 173.34 2dca s LYS 232 N -3.80 2.24 0.03 1.99 1.02 -1.26 -0.74 119.74 119.21 2dca s LYS 232 Ca 0.04 -0.86 0.02 0.00 0.02 0.00 0.00 55.97 55.19 2dca s LYS 232 Cb 0.00 -2.18 -0.02 0.00 -0.52 0.00 0.00 37.83 35.12 2dca s LYS 232 CO -0.11 0.58 -0.08 -1.50 -0.92 0.00 0.00 175.35 173.33 2dca s ILE 233 N -0.70 0.57 0.07 2.17 -1.16 -1.03 -0.30 121.20 120.82 2dca s ILE 233 Ca 0.11 -0.79 -0.37 0.00 -0.51 0.00 0.00 60.65 59.09 2dca s ILE 233 Cb -0.10 -0.57 -0.18 0.00 0.61 0.00 0.00 42.46 42.22 2dca s ILE 233 CO 0.00 -0.17 1.25 -0.11 -2.81 0.00 0.00 174.94 173.11 2dca n LEU 234 N 2.01 1.17 -4.52 8.50 7.94 -0.87 -0.67 117.00 130.56 2dca n LEU 234 Ca -0.19 1.13 -0.31 0.00 -1.11 0.00 0.00 56.01 55.53 2dca n LEU 234 Cb 0.56 -1.12 -0.11 0.00 0.53 0.00 0.00 43.42 43.28 2dca n LEU 234 CO 0.22 -1.31 -0.45 -0.60 -1.11 0.00 0.00 177.39 174.14 2dca s ARG 235 N 0.29 2.18 0.00 1.96 3.52 -0.41 -4.51 118.95 121.99 2dca s ARG 235 Ca 0.85 -0.94 0.00 0.00 -0.13 0.00 0.00 55.73 55.52 2dca s ARG 235 Cb -1.03 -2.28 0.00 0.00 -1.56 0.00 0.00 34.95 30.07 2dca s ARG 235 CO 0.50 0.55 0.00 0.41 -0.81 0.00 0.00 175.30 175.94 2dca n GLY 236 N 1.33 0.84 0.12 8.12 0.00 -1.26 -4.71 105.19 109.63 2dca n GLY 236 Ca -0.15 0.00 0.08 0.00 0.00 0.00 0.00 46.02 45.94 2dca n GLY 236 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2dca n GLN 237 N -1.98 1.22 -4.19 1.61 6.02 -1.26 -4.97 117.38 113.84 2dca n GLN 237 Ca 0.00 -2.26 -0.36 0.00 -0.01 0.00 0.00 57.00 54.37 2dca n GLN 237 Cb 0.00 -1.32 -0.02 0.00 1.02 0.00 0.00 30.24 29.93 2dca n GLN 237 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 2dca n ASP 238 N -1.16 -3.56 -4.68 1.08 2.03 -1.26 -4.81 116.55 104.19 2dca n ASP 238 Ca 0.12 -0.98 -0.45 0.00 0.52 0.00 0.00 54.79 54.01 2dca n ASP 238 Cb 0.62 -2.92 -0.04 0.00 -0.72 0.00 0.00 41.12 38.06 2dca n ASP 238 CO 0.00 0.00 0.00 1.57 -1.92 0.00 0.00 177.20 176.85 2dca n HIS 239 N -4.43 2.46 -1.39 -0.67 -0.00 -1.26 -0.57 115.22 109.36 2dca n HIS 239 Ca 0.08 -0.08 -0.14 0.00 -0.00 0.00 0.00 57.72 57.57 2dca n HIS 239 Cb 0.49 -2.70 -0.06 0.00 -0.00 0.00 0.00 29.99 27.73 2dca n HIS 239 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2dca n GLY 241 N 0.02 0.64 0.32 0.00 0.00 0.27 -0.82 105.19 105.62 2dca n GLY 241 Ca -0.14 -0.92 0.17 0.00 0.00 0.00 0.00 46.02 45.14 2dca n GLY 241 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 2dca h ILE 242 N 0.00 0.40 -0.16 -0.61 -0.00 -1.33 -1.13 117.51 114.69 2dca h ILE 242 Ca -0.07 0.00 0.00 0.00 -0.00 0.00 0.00 64.86 64.79 2dca h ILE 242 Cb 0.24 0.92 0.00 0.00 -0.00 0.00 0.00 36.82 37.98 2dca h ILE 242 CO 0.10 0.00 0.00 -0.62 -0.00 0.00 0.00 178.15 177.63 2dca n GLU 243 N -3.67 1.82 0.01 2.19 1.02 -1.26 -4.53 120.64 116.23 2dca n GLU 243 Ca -0.01 -1.78 0.12 0.00 -0.02 0.00 0.00 57.16 55.48 2dca n GLU 243 Cb 0.19 -1.37 0.27 0.00 -0.02 0.00 0.00 31.44 30.52 2dca n GLU 243 CO 0.00 0.00 0.00 -1.13 1.18 0.00 0.00 177.13 177.18 2dca n SER 244 N 1.05 0.49 -2.72 1.62 3.41 -0.43 -4.03 113.62 113.01 2dca n SER 244 Ca 0.13 -0.11 -0.10 0.00 -0.26 0.00 0.00 58.87 58.53 2dca n SER 244 Cb 0.47 0.16 0.03 0.00 -0.26 0.00 0.00 64.21 64.61 2dca n SER 244 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 2dca n GLU 245 N -1.62 1.12 -2.87 4.33 2.13 -1.26 -4.88 120.64 117.60 2dca n GLU 245 Ca 0.05 -3.19 -0.41 0.00 0.66 0.00 0.00 57.16 54.27 2dca n GLU 245 Cb 0.36 -1.23 -0.04 0.00 0.27 0.00 0.00 31.44 30.79 2dca n GLU 245 CO 0.00 0.00 0.00 0.42 -0.41 0.00 0.00 177.13 177.14 2dca s ILE 246 N -2.88 4.94 0.06 6.31 1.01 -1.26 -3.95 121.20 125.43 2dca s ILE 246 Ca 0.28 1.75 0.01 0.00 0.00 0.00 0.00 60.65 62.69 2dca s ILE 246 Cb 0.45 -4.18 -0.03 0.00 0.01 0.00 0.00 42.46 38.71 2dca s ILE 246 CO 0.02 0.18 -0.06 0.68 0.00 0.00 0.00 174.94 175.76 2dca s VAL 247 N 1.09 0.49 0.00 2.92 -7.23 -0.34 -0.99 120.40 116.32 2dca s VAL 247 Ca 0.44 -1.40 0.00 0.00 -1.81 0.00 0.00 61.98 59.21 2dca s VAL 247 Cb -0.19 -1.00 0.00 0.00 0.56 0.00 0.00 36.38 35.75 2dca s VAL 247 CO 0.22 -0.62 0.00 0.00 -0.31 0.00 0.00 175.10 174.38 2dca n ALA 248 N 0.86 0.00 0.00 1.32 0.00 -0.75 -1.69 120.51 120.25 2dca n ALA 248 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.25 2dca n ALA 248 Cb 0.57 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.02 2dca n ALA 248 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2dca n GLY 249 N 0.00 0.35 3.39 0.00 0.00 -1.26 -1.23 105.19 106.44 2dca n GLY 249 Ca 0.00 -0.83 -0.32 0.00 0.00 0.00 0.00 46.02 44.88 2dca n GLY 249 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2dca s MET 250 N -2.00 2.25 0.56 1.61 -1.94 -0.94 -4.97 119.30 113.87 2dca s MET 250 Ca 0.00 -0.84 -0.18 0.00 -1.71 0.00 0.00 55.69 52.96 2dca s MET 250 Cb 0.00 -2.18 -0.05 0.00 2.01 0.00 0.00 34.83 34.61 2dca s MET 250 CO 0.00 0.58 1.07 -1.25 -0.01 0.00 0.00 175.02 175.41 2dca s PRO 251 N -0.72 3.42 0.17 2.03 0.04 -1.26 0.37 135.00 139.04 2dca s PRO 251 Ca 0.11 1.34 -0.31 0.00 0.04 0.00 0.00 61.00 62.18 2dca s PRO 251 Cb -0.10 -2.04 -0.09 0.00 0.04 0.00 0.00 34.50 32.31 2dca s PRO 251 CO 0.00 -0.75 1.44 0.00 0.04 0.00 0.00 177.00 177.73