#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1iyf s ILE 2 N 0.00 0.56 0.05 2.02 -0.00 -0.39 0.23 121.20 123.66 1iyf s ILE 2 Ca 0.00 -0.33 0.05 0.00 -0.00 0.00 0.00 60.65 60.37 1iyf s ILE 2 Cb 0.00 -0.90 -0.02 0.00 -0.00 0.00 0.00 42.46 41.54 1iyf s ILE 2 CO 0.00 0.00 -0.14 -0.69 -0.00 0.00 0.00 174.94 174.11 1iyf s VAL 3 N 1.87 1.10 -0.16 8.37 1.01 0.97 -1.96 120.40 131.60 1iyf s VAL 3 Ca 0.01 -1.09 -0.24 0.00 0.00 0.00 0.00 61.98 60.66 1iyf s VAL 3 Cb -0.15 -1.02 -0.02 0.00 0.00 0.00 0.00 36.38 35.19 1iyf s VAL 3 CO -0.07 -0.07 0.77 -0.36 0.00 0.00 0.00 175.10 175.37 1iyf s PHE 4 N -0.99 3.44 -0.26 5.22 0.40 -0.56 0.12 117.98 125.35 1iyf s PHE 4 Ca 0.00 1.19 -0.16 0.00 -0.60 0.00 0.00 56.93 57.36 1iyf s PHE 4 Cb -0.09 -2.94 -0.03 0.00 0.51 0.00 0.00 43.02 40.47 1iyf s PHE 4 CO 0.02 -0.17 0.44 0.54 0.70 0.00 0.00 175.22 176.74 1iyf s VAL 5 N 1.88 5.13 0.05 -0.44 0.11 0.43 -1.49 120.40 126.07 1iyf s VAL 5 Ca 0.36 0.72 0.00 0.00 -2.93 0.00 0.00 61.98 60.13 1iyf s VAL 5 Cb -0.17 -3.76 -0.04 0.00 -1.53 0.00 0.00 36.38 30.89 1iyf s VAL 5 CO 0.13 0.13 0.16 -0.13 -3.33 0.00 0.00 175.10 172.06 1iyf s ARG 6 N 2.12 3.26 0.22 1.54 1.81 -0.87 -0.11 118.95 126.92 1iyf s ARG 6 Ca 0.18 -0.49 0.10 0.00 -1.72 0.00 0.00 55.73 53.79 1iyf s ARG 6 Cb -0.16 -2.95 -0.04 0.00 -0.45 0.00 0.00 34.95 31.35 1iyf s ARG 6 CO 0.09 0.61 -0.10 0.12 -0.68 0.00 0.00 175.30 175.34 1iyf s PHE 7 N -1.43 2.57 -0.29 -0.53 5.36 -1.19 -0.33 117.98 122.14 1iyf s PHE 7 Ca 0.31 -0.25 -0.26 0.00 -0.96 0.00 0.00 56.93 55.77 1iyf s PHE 7 Cb -0.13 -1.20 -0.28 0.00 -0.34 0.00 0.00 43.02 41.07 1iyf s PHE 7 CO 0.24 0.57 1.70 -1.71 -1.46 0.00 0.00 175.22 174.56 1iyf n ASN 8 N -0.28 1.57 -3.58 6.13 4.05 -1.24 -4.56 115.26 117.35 1iyf n ASN 8 Ca -0.09 -2.54 -0.05 0.00 0.45 0.00 0.00 54.58 52.35 1iyf n ASN 8 Cb 0.57 -0.73 -0.02 0.00 1.23 0.00 0.00 39.78 40.84 1iyf n ASN 8 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 177.26 173.66 1iyf s SER 9 N 6.15 -0.23 -1.08 1.20 0.15 -1.26 -5.04 113.70 113.59 1iyf s SER 9 Ca 0.62 -0.06 -0.20 0.00 0.70 0.00 0.00 55.95 57.01 1iyf s SER 9 Cb 0.14 0.29 -0.07 0.00 -1.71 0.00 0.00 66.02 64.67 1iyf s SER 9 CO 0.25 -0.48 1.98 -1.20 1.20 0.00 0.00 173.24 174.99 1iyf n SER 10 N -0.24 3.23 -3.65 5.45 7.64 -1.26 -4.76 113.62 120.03 1iyf n SER 10 Ca -0.05 -2.75 -0.12 0.00 1.01 0.00 0.00 58.87 56.96 1iyf n SER 10 Cb 0.60 -1.43 -0.08 0.00 -1.01 0.00 0.00 64.21 62.30 1iyf n SER 10 CO 0.00 0.00 0.00 -2.28 -3.01 0.00 0.00 175.04 169.75 1iyf s HIS 11 N 5.48 -0.82 -0.04 1.43 5.04 -1.26 -5.13 115.29 119.99 1iyf s HIS 11 Ca 0.56 1.86 0.03 0.00 -1.54 0.00 0.00 55.06 55.97 1iyf s HIS 11 Cb 0.11 0.36 0.00 0.00 0.04 0.00 0.00 32.58 33.09 1iyf s HIS 11 CO 0.06 -0.40 -0.12 0.20 -2.34 0.00 0.00 174.74 172.14 1iyf s GLY 12 N 0.78 0.69 -0.22 1.59 0.00 -1.26 -3.18 107.32 105.71 1iyf s GLY 12 Ca -0.03 -0.44 -0.02 0.00 0.00 0.00 0.00 44.72 44.23 1iyf s GLY 12 CO -0.06 -0.11 -0.08 -0.12 0.00 0.00 0.00 173.10 172.74 1iyf s PHE 13 N 0.26 2.96 -0.02 1.90 2.19 0.84 -4.94 117.98 121.16 1iyf s PHE 13 Ca -0.06 -1.27 -0.30 0.00 0.33 0.00 0.00 56.93 55.63 1iyf s PHE 13 Cb -0.11 -2.06 -0.07 0.00 -1.31 0.00 0.00 43.02 39.48 1iyf s PHE 13 CO 0.01 -0.66 1.71 -1.25 1.83 0.00 0.00 175.22 176.86 1iyf s PRO 14 N 1.39 4.18 -0.05 10.12 0.04 -1.26 0.16 135.00 149.59 1iyf s PRO 14 Ca 0.04 2.29 0.05 0.00 0.04 0.00 0.00 61.00 63.41 1iyf s PRO 14 Cb -0.15 -3.95 -0.02 0.00 0.04 0.00 0.00 34.50 30.42 1iyf s PRO 14 CO -0.06 -0.84 -0.17 0.54 0.04 0.00 0.00 177.00 176.51 1iyf s VAL 15 N 3.85 2.81 -1.20 -0.36 0.11 0.33 -4.84 120.40 121.10 1iyf s VAL 15 Ca 0.76 -0.82 -0.07 0.00 -2.93 0.00 0.00 61.98 58.92 1iyf s VAL 15 Cb -0.36 -2.08 0.22 0.00 -1.53 0.00 0.00 36.38 32.64 1iyf s VAL 15 CO 0.32 0.59 1.74 1.21 -3.33 0.00 0.00 175.10 175.62 1iyf n GLU 16 N 2.39 4.01 0.00 1.54 2.13 -1.26 0.32 120.64 129.78 1iyf n GLU 16 Ca -0.17 -3.94 0.00 0.00 0.66 0.00 0.00 57.16 53.71 1iyf n GLU 16 Cb 0.52 -2.75 0.00 0.00 0.27 0.00 0.00 31.44 29.48 1iyf n GLU 16 CO 0.00 0.00 0.00 1.55 -0.41 0.00 0.00 177.13 178.27 1iyf n VAL 17 N 2.46 0.00 -1.94 6.31 3.14 0.62 -4.59 118.33 124.32 1iyf n VAL 17 Ca 0.35 0.00 -0.42 0.00 -2.96 0.00 0.00 64.34 61.31 1iyf n VAL 17 Cb 0.35 0.00 -0.03 0.00 -1.06 0.00 0.00 33.84 33.10 1iyf n VAL 17 CO 0.00 0.00 0.00 1.51 -6.46 0.00 0.00 176.83 171.88 1iyf s ASP 18 N 0.00 6.61 0.13 6.55 1.47 -1.26 -1.39 116.67 128.78 1iyf s ASP 18 Ca 0.00 2.31 0.17 0.00 1.18 0.00 0.00 52.55 56.21 1iyf s ASP 18 Cb 0.00 -2.53 -0.07 0.00 -0.34 0.00 0.00 42.92 39.98 1iyf s ASP 18 CO 0.00 -0.96 1.01 0.28 0.68 0.00 0.00 175.17 176.17 1iyf h SER 19 N 9.80 0.00 0.73 2.11 0.02 -1.93 -3.37 113.55 120.91 1iyf h SER 19 Ca -0.41 0.00 -0.11 0.00 -0.84 0.00 0.00 61.79 60.43 1iyf h SER 19 Cb 1.19 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.71 1iyf h SER 19 CO 0.95 0.49 -1.35 -0.90 -1.14 0.00 0.00 176.83 174.88 1iyf n ASP 20 N -2.95 0.77 -3.16 3.07 5.75 -1.26 -4.15 116.55 114.62 1iyf n ASP 20 Ca -0.06 0.32 -0.29 0.00 -0.01 0.00 0.00 54.79 54.76 1iyf n ASP 20 Cb 0.78 0.42 0.02 0.00 -1.03 0.00 0.00 41.12 41.30 1iyf n ASP 20 CO 0.00 0.00 0.00 1.07 -0.11 0.00 0.00 177.20 178.16 1iyf n THR 21 N -2.77 0.00 0.00 2.12 5.66 -1.26 -4.51 114.28 113.53 1iyf n THR 21 Ca -0.07 -0.38 0.00 0.00 -3.05 0.00 0.00 64.05 60.55 1iyf n THR 21 Cb 0.73 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.51 1iyf n THR 21 CO 0.00 0.00 0.00 -0.24 -3.05 0.00 0.00 175.07 171.78 1iyf n SER 22 N 2.18 0.00 -0.33 1.09 2.88 -1.26 -0.81 113.62 117.37 1iyf n SER 22 Ca 0.03 0.00 0.31 0.00 -1.33 0.00 0.00 58.87 57.88 1iyf n SER 22 Cb 0.38 0.00 0.57 0.00 -0.75 0.00 0.00 64.21 64.41 1iyf n SER 22 CO 0.00 0.00 0.00 -0.29 -1.23 0.00 0.00 175.04 173.52 1iyf h ILE 23 N 0.00 0.06 -0.11 2.46 -0.00 -1.90 1.09 117.51 119.11 1iyf h ILE 23 Ca 0.00 -0.02 -0.02 0.00 -0.00 0.00 0.00 64.86 64.82 1iyf h ILE 23 Cb 0.00 -0.01 -0.00 0.00 -0.00 0.00 0.00 36.82 36.81 1iyf h ILE 23 CO 0.00 0.01 -0.01 -0.26 -0.00 0.00 0.00 178.15 177.89 1iyf h PHE 24 N 0.07 0.22 0.38 2.19 -1.00 -1.96 -1.74 116.94 115.10 1iyf h PHE 24 Ca 0.83 -0.04 -0.02 0.00 2.81 0.00 0.00 57.97 61.54 1iyf h PHE 24 Cb 2.14 -0.05 0.00 0.00 3.61 0.00 0.00 35.95 41.65 1iyf h PHE 24 CO -0.01 0.48 -0.18 1.96 -1.61 0.00 0.00 178.31 178.95 1iyf h GLN 25 N -0.11 -0.50 0.61 1.51 1.08 0.75 -2.04 115.11 116.42 1iyf h GLN 25 Ca 0.03 0.03 -0.02 0.00 -1.45 0.00 0.00 58.65 57.24 1iyf h GLN 25 Cb 0.40 0.11 -0.01 0.00 -0.05 0.00 0.00 27.48 27.93 1iyf h GLN 25 CO 0.01 -0.21 -0.44 1.37 -0.95 0.00 0.00 178.83 178.61 1iyf h LEU 26 N -0.76 -1.14 -1.36 1.46 8.10 0.20 -1.50 115.31 120.32 1iyf h LEU 26 Ca -0.05 0.08 0.21 0.00 0.11 0.00 0.00 57.88 58.23 1iyf h LEU 26 Cb 0.52 0.35 -0.08 0.00 -0.44 0.00 0.00 40.66 41.01 1iyf h LEU 26 CO 0.09 -0.65 0.62 0.07 -4.11 0.00 0.00 178.44 174.46 1iyf h LYS 27 N -1.01 0.48 0.57 0.17 5.09 -1.41 -1.65 116.57 118.82 1iyf h LYS 27 Ca -0.07 -0.03 -0.03 0.00 0.09 0.00 0.00 60.65 60.61 1iyf h LYS 27 Cb 0.84 -0.11 0.01 0.00 0.10 0.00 0.00 32.23 33.07 1iyf h LYS 27 CO 0.03 0.32 -0.27 1.49 -2.09 0.00 0.00 179.45 178.93 1iyf h GLU 28 N 0.50 -0.74 -0.24 0.07 4.81 -0.86 -1.65 114.58 116.46 1iyf h GLU 28 Ca 0.52 0.05 0.06 0.00 -0.13 0.00 0.00 59.36 59.87 1iyf h GLU 28 Cb 1.18 0.17 -0.07 0.00 0.63 0.00 0.00 28.75 30.66 1iyf h GLU 28 CO -0.25 -0.49 -0.21 0.28 -0.73 0.00 0.00 179.01 177.60 1iyf h VAL 29 N -1.20 0.44 0.00 0.32 2.07 -0.97 0.19 116.25 117.10 1iyf h VAL 29 Ca -0.08 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.44 1iyf h VAL 29 Cb 0.59 0.44 0.00 0.00 -1.52 0.00 0.00 31.29 30.80 1iyf h VAL 29 CO 0.13 0.00 0.00 0.55 0.02 0.00 0.00 177.57 178.27 1iyf n VAL 30 N -5.36 0.00 0.10 2.57 3.14 -0.65 -2.18 118.33 115.95 1iyf n VAL 30 Ca -0.01 1.23 0.20 0.00 -2.96 0.00 0.00 64.34 62.80 1iyf n VAL 30 Cb 0.27 -2.20 0.75 0.00 -1.06 0.00 0.00 33.84 31.61 1iyf n VAL 30 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1iyf h ALA 31 N -2.00 2.11 0.08 1.55 0.00 -1.34 2.49 119.26 122.15 1iyf h ALA 31 Ca 0.00 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 1iyf h ALA 31 Cb 0.00 0.03 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1iyf h ALA 31 CO 0.00 -0.64 -0.04 -0.22 0.00 0.00 0.00 179.25 178.35 1iyf h LYS 32 N 0.00 -0.10 -0.00 0.00 3.64 -0.63 -2.50 116.57 116.97 1iyf h LYS 32 Ca 0.19 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.58 1iyf h LYS 32 Cb 1.05 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.89 1iyf h LYS 32 CO -0.00 0.42 -0.23 0.54 -2.27 0.00 0.00 179.45 177.90 1iyf n ARG 33 N -4.86 0.30 0.00 1.90 1.74 -0.54 -3.62 116.66 111.58 1iyf n ARG 33 Ca -0.08 -0.12 0.15 0.00 -0.77 0.00 0.00 57.85 57.02 1iyf n ARG 33 Cb 0.29 -1.50 0.71 0.00 -1.02 0.00 0.00 32.46 30.94 1iyf n ARG 33 CO 0.00 0.00 0.00 0.94 -1.52 0.00 0.00 177.63 177.05 1iyf n GLN 34 N -1.24 0.36 -3.08 5.56 -0.06 0.83 -4.89 117.38 114.86 1iyf n GLN 34 Ca 0.09 -0.02 -0.13 0.00 -2.00 0.00 0.00 57.00 54.94 1iyf n GLN 34 Cb 0.32 -1.50 0.04 0.00 -4.06 0.00 0.00 30.24 25.04 1iyf n GLN 34 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1iyf n GLY 35 N 1.33 0.10 0.78 1.69 0.00 -1.23 -4.98 105.19 102.89 1iyf n GLY 35 Ca 0.13 -0.16 -0.04 0.00 0.00 0.00 0.00 46.02 45.94 1iyf n GLY 35 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 1iyf n VAL 36 N -3.92 0.00 0.00 1.61 0.24 -0.94 -5.05 118.33 110.27 1iyf n VAL 36 Ca -0.00 -0.51 0.00 0.00 -2.04 0.00 0.00 64.34 61.79 1iyf n VAL 36 Cb 0.54 0.28 0.00 0.00 -1.47 0.00 0.00 33.84 33.18 1iyf n VAL 36 CO 0.00 0.00 0.00 -0.81 -2.14 0.00 0.00 176.83 173.88 1iyf n PRO 37 N -0.14 2.60 -0.00 7.34 -0.04 -1.26 -4.39 135.00 139.10 1iyf n PRO 37 Ca 0.01 0.00 -0.00 0.00 -0.04 0.00 0.00 63.50 63.47 1iyf n PRO 37 Cb 0.14 0.00 -0.00 0.00 -0.04 0.00 0.00 33.50 33.60 1iyf n PRO 37 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1iyf n ALA 38 N -3.00 0.90 -1.75 0.55 0.00 -1.26 -3.49 120.51 112.46 1iyf n ALA 38 Ca 0.00 -0.18 0.02 0.00 0.00 0.00 0.00 53.44 53.27 1iyf n ALA 38 Cb 0.00 0.00 0.17 0.00 0.00 0.00 0.00 19.45 19.62 1iyf n ALA 38 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1iyf n ASP 39 N -2.53 2.09 0.00 0.00 2.03 -1.26 -4.05 116.55 112.83 1iyf n ASP 39 Ca -0.00 -3.70 0.00 0.00 0.52 0.00 0.00 54.79 51.61 1iyf n ASP 39 Cb 0.01 -0.48 0.00 0.00 -0.72 0.00 0.00 41.12 39.92 1iyf n ASP 39 CO 0.00 0.00 0.00 1.67 -1.92 0.00 0.00 177.20 176.95 1iyf n GLN 40 N -0.92 0.00 0.00 -0.67 -0.06 -1.26 -4.77 117.38 109.70 1iyf n GLN 40 Ca 0.21 0.41 0.00 0.00 -2.00 0.00 0.00 57.00 55.62 1iyf n GLN 40 Cb 0.77 -1.13 0.00 0.00 -4.06 0.00 0.00 30.24 25.81 1iyf n GLN 40 CO 0.00 0.00 0.00 -0.11 -0.20 0.00 0.00 177.06 176.75 1iyf n LEU 41 N -1.25 0.00 -4.28 1.69 7.94 -1.25 -4.99 117.00 114.86 1iyf n LEU 41 Ca 0.00 0.00 -0.15 0.00 -1.11 0.00 0.00 56.01 54.75 1iyf n LEU 41 Cb 0.00 0.00 -0.10 0.00 0.53 0.00 0.00 43.42 43.85 1iyf n LEU 41 CO 0.00 0.00 -0.38 -0.13 -1.11 0.00 0.00 177.39 175.77 1iyf s ARG 42 N 0.34 1.17 0.05 1.96 1.81 0.86 -4.94 118.95 120.20 1iyf s ARG 42 Ca 0.00 -1.54 0.05 0.00 -1.72 0.00 0.00 55.73 52.51 1iyf s ARG 42 Cb 0.00 -0.61 -0.02 0.00 -0.45 0.00 0.00 34.95 33.87 1iyf s ARG 42 CO 0.00 0.00 -0.14 0.08 -0.68 0.00 0.00 175.30 174.56 1iyf s VAL 43 N -3.37 1.07 0.06 3.52 1.01 -1.26 -0.11 120.40 121.32 1iyf s VAL 43 Ca 0.22 -1.11 -0.05 0.00 0.00 0.00 0.00 61.98 61.04 1iyf s VAL 43 Cb 0.04 -1.00 -0.02 0.00 0.00 0.00 0.00 36.38 35.40 1iyf s VAL 43 CO 0.04 -0.10 0.08 -0.63 0.00 0.00 0.00 175.10 174.48 1iyf s ILE 44 N -1.03 0.17 0.07 2.22 1.01 0.37 -1.97 121.20 122.05 1iyf s ILE 44 Ca -0.00 -1.44 0.03 0.00 0.00 0.00 0.00 60.65 59.24 1iyf s ILE 44 Cb -0.09 -1.33 -0.03 0.00 0.01 0.00 0.00 42.46 41.02 1iyf s ILE 44 CO 0.02 -0.79 -0.09 0.12 0.00 0.00 0.00 174.94 174.19 1iyf s PHE 45 N -3.65 0.88 -0.51 3.97 5.36 -0.44 0.18 117.98 123.78 1iyf s PHE 45 Ca 0.04 -0.61 -0.06 0.00 -0.96 0.00 0.00 56.93 55.33 1iyf s PHE 45 Cb 0.05 -0.51 0.06 0.00 -0.34 0.00 0.00 43.02 42.29 1iyf s PHE 45 CO -0.09 -0.06 0.16 0.00 -1.46 0.00 0.00 175.22 173.77 1iyf n ALA 46 N 0.92 -0.40 0.00 11.12 0.00 -1.22 0.35 120.51 131.28 1iyf n ALA 46 Ca -0.19 -0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.20 1iyf n ALA 46 Cb 0.57 -0.72 0.00 0.00 0.00 0.00 0.00 19.45 19.30 1iyf n ALA 46 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1iyf n GLY 47 N -0.58 2.96 3.65 0.00 0.00 -1.26 -4.98 105.19 104.98 1iyf n GLY 47 Ca 0.03 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.66 1iyf n GLY 47 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1iyf s LYS 48 N 0.00 4.17 0.07 1.61 1.02 1.09 -5.01 119.74 122.70 1iyf s LYS 48 Ca 0.00 0.43 -0.30 0.00 0.02 0.00 0.00 55.97 56.11 1iyf s LYS 48 Cb 0.00 -3.58 -0.09 0.00 -0.52 0.00 0.00 37.83 33.64 1iyf s LYS 48 CO 0.00 -0.19 1.89 -2.00 -0.92 0.00 0.00 175.35 174.12 1iyf s GLU 49 N 1.78 4.14 -0.16 1.68 2.12 -1.26 -1.33 118.70 125.68 1iyf s GLU 49 Ca 0.24 2.58 -0.10 0.00 0.36 0.00 0.00 54.97 58.05 1iyf s GLU 49 Cb -0.15 -3.90 -0.05 0.00 0.26 0.00 0.00 34.13 30.29 1iyf s GLU 49 CO 0.10 -0.90 0.57 1.47 -0.54 0.00 0.00 175.26 175.96 1iyf n LEU 50 N 6.67 0.16 -3.96 2.70 -0.00 -0.83 -4.68 117.00 117.06 1iyf n LEU 50 Ca 0.19 0.14 -0.29 0.00 -0.00 0.00 0.00 56.01 56.05 1iyf n LEU 50 Cb 0.40 -0.23 -0.17 0.00 -0.00 0.00 0.00 43.42 43.42 1iyf n LEU 50 CO 0.67 -0.19 -0.46 -0.13 -0.00 0.00 0.00 177.39 177.27 1iyf s ARG 51 N 1.69 1.92 0.31 1.47 1.81 -1.26 -4.90 118.95 120.00 1iyf s ARG 51 Ca 0.31 -0.48 0.05 0.00 -1.72 0.00 0.00 55.73 53.89 1iyf s ARG 51 Cb -0.36 -1.95 0.84 0.00 -0.45 0.00 0.00 34.95 33.02 1iyf s ARG 51 CO 0.16 -0.29 1.59 -2.95 -0.68 0.00 0.00 175.30 173.13 1iyf h ASN 52 N 8.09 -0.21 0.00 0.23 -1.07 -1.90 -0.71 115.58 120.01 1iyf h ASN 52 Ca -0.33 0.25 0.00 0.00 0.07 0.00 0.00 56.30 56.29 1iyf h ASN 52 Cb 1.13 0.39 0.00 0.00 -2.07 0.00 0.00 38.32 37.77 1iyf h ASN 52 CO 0.47 -0.31 -0.50 0.47 0.07 0.00 0.00 177.43 177.63 1iyf n ASP 53 N -5.38 2.08 -0.11 6.14 9.92 -1.26 -4.26 116.55 123.69 1iyf n ASP 53 Ca 0.25 -0.30 -0.11 0.00 -0.53 0.00 0.00 54.79 54.10 1iyf n ASP 53 Cb 0.83 1.03 -0.15 0.00 -0.64 0.00 0.00 41.12 42.18 1iyf n ASP 53 CO 0.00 0.00 0.00 0.79 0.13 0.00 0.00 177.20 178.12 1iyf n TRP 54 N -1.25 0.00 -0.03 1.24 8.01 -1.06 -3.50 117.44 120.85 1iyf n TRP 54 Ca 0.00 0.00 0.02 0.00 -1.31 0.00 0.00 57.50 56.21 1iyf n TRP 54 Cb 0.03 -1.00 -0.11 0.00 -2.01 0.00 0.00 31.31 28.22 1iyf n TRP 54 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 177.69 179.09 1iyf n THR 55 N -2.84 0.36 0.00 -0.99 -1.04 -0.34 -4.24 114.28 105.19 1iyf n THR 55 Ca -0.35 -0.41 0.00 0.00 -2.04 0.00 0.00 64.05 61.25 1iyf n THR 55 Cb 1.13 -0.16 0.00 0.00 -1.82 0.00 0.00 70.33 69.48 1iyf n THR 55 CO 0.00 0.00 0.00 1.33 -0.64 0.00 0.00 175.07 175.76 1iyf n VAL 56 N -2.18 0.00 0.01 12.58 0.24 -0.79 -4.45 118.33 123.73 1iyf n VAL 56 Ca -0.10 0.00 -0.05 0.00 -2.04 0.00 0.00 64.34 62.15 1iyf n VAL 56 Cb 0.59 0.00 0.15 0.00 -1.47 0.00 0.00 33.84 33.11 1iyf n VAL 56 CO 0.00 0.00 0.00 1.56 -2.14 0.00 0.00 176.83 176.25 1iyf h GLN 57 N 0.00 0.51 0.00 7.34 1.08 -1.89 0.39 115.11 122.54 1iyf h GLN 57 Ca 0.00 -0.23 0.00 0.00 -1.45 0.00 0.00 58.65 56.97 1iyf h GLN 57 Cb 0.00 -0.01 0.00 0.00 -0.05 0.00 0.00 27.48 27.42 1iyf h GLN 57 CO 0.00 0.78 0.00 0.09 -0.95 0.00 0.00 178.83 178.75 1iyf n ASN 58 N -4.07 0.00 0.00 1.46 3.02 -1.26 -3.81 115.26 110.61 1iyf n ASN 58 Ca -0.01 -1.13 0.00 0.00 -0.03 0.00 0.00 54.58 53.41 1iyf n ASN 58 Cb 0.47 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.64 1iyf n ASN 58 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1iyf n ASP 60 N -1.45 -2.66 -4.49 0.00 -0.08 -0.76 -4.98 116.55 102.13 1iyf n ASP 60 Ca 0.00 -2.46 -0.30 0.00 -1.51 0.00 0.00 54.79 50.52 1iyf n ASP 60 Cb 0.00 1.44 -0.11 0.00 2.34 0.00 0.00 41.12 44.79 1iyf n ASP 60 CO 0.00 0.00 0.00 -0.76 0.12 0.00 0.00 177.20 176.56 1iyf s LEU 61 N 0.40 2.73 0.48 -2.67 2.01 -1.25 -4.95 118.68 115.43 1iyf s LEU 61 Ca 0.29 -0.49 0.05 0.00 0.01 0.00 0.00 54.13 53.98 1iyf s LEU 61 Cb 0.11 -1.58 -0.02 0.00 0.01 0.00 0.00 46.19 44.71 1iyf s LEU 61 CO -0.11 0.20 0.16 -0.62 1.01 0.00 0.00 176.35 176.98 1iyf s ASP 62 N -1.95 4.32 0.28 2.29 2.15 -1.26 -4.99 116.67 117.51 1iyf s ASP 62 Ca 0.17 -1.35 -0.01 0.00 0.43 0.00 0.00 52.55 51.79 1iyf s ASP 62 Cb -0.11 0.10 0.46 0.00 -0.30 0.00 0.00 42.92 43.07 1iyf s ASP 62 CO 0.09 -0.78 1.88 1.56 -0.17 0.00 0.00 175.17 177.75 1iyf h GLN 63 N 1.27 1.09 -3.38 4.34 4.20 -2.01 -3.22 115.11 117.40 1iyf h GLN 63 Ca -0.42 -0.07 -0.68 0.00 0.06 0.00 0.00 58.65 57.55 1iyf h GLN 63 Cb 1.29 -0.25 -0.37 0.00 0.30 0.00 0.00 27.48 28.45 1iyf h GLN 63 CO 0.69 0.72 -0.36 1.14 -0.67 0.00 0.00 178.83 180.35 1iyf s GLN 64 N -6.00 2.67 0.36 1.46 0.00 -1.25 -1.27 119.66 115.63 1iyf s GLN 64 Ca -0.12 -2.91 0.07 0.00 -0.00 0.00 0.00 55.36 52.40 1iyf s GLN 64 Cb 0.20 -3.68 -0.01 0.00 0.00 0.00 0.00 33.01 29.53 1iyf s GLN 64 CO 0.81 -1.21 0.47 -1.12 0.00 0.00 0.00 175.29 174.24 1iyf s SER 65 N -0.10 5.77 -0.11 12.60 0.01 -0.83 -4.99 113.70 126.05 1iyf s SER 65 Ca 0.21 -0.31 -0.00 0.00 1.31 0.00 0.00 55.95 57.17 1iyf s SER 65 Cb -0.15 -1.03 0.02 0.00 0.21 0.00 0.00 66.02 65.08 1iyf s SER 65 CO -0.08 -0.51 -0.09 0.27 0.41 0.00 0.00 173.24 173.24 1iyf s ILE 66 N -2.25 1.09 -0.07 1.44 -5.25 -1.26 -1.50 121.20 113.41 1iyf s ILE 66 Ca 0.47 -0.34 0.05 0.00 -0.99 0.00 0.00 60.65 59.84 1iyf s ILE 66 Cb -0.09 -1.09 -0.01 0.00 2.95 0.00 0.00 42.46 44.22 1iyf s ILE 66 CO 0.31 0.38 -0.22 -0.69 -1.79 0.00 0.00 174.94 172.92 1iyf s VAL 67 N 1.58 2.32 -0.48 8.37 1.01 -0.56 -3.42 120.40 129.22 1iyf s VAL 67 Ca 0.03 -0.97 -0.21 0.00 0.00 0.00 0.00 61.98 60.84 1iyf s VAL 67 Cb -0.13 -1.87 0.04 0.00 0.00 0.00 0.00 36.38 34.42 1iyf s VAL 67 CO -0.07 0.57 0.69 -1.00 0.00 0.00 0.00 175.10 175.28 1iyf s HIS 68 N -0.18 3.01 0.05 5.22 3.76 0.49 -2.05 115.29 125.59 1iyf s HIS 68 Ca -0.02 -0.24 0.02 0.00 -0.15 0.00 0.00 55.06 54.67 1iyf s HIS 68 Cb -0.14 -3.54 -0.04 0.00 1.11 0.00 0.00 32.58 29.97 1iyf s HIS 68 CO 0.03 -1.02 0.05 0.42 -0.85 0.00 0.00 174.74 173.38 1iyf s ILE 69 N 2.93 4.42 -0.48 0.60 1.09 0.56 0.14 121.20 130.45 1iyf s ILE 69 Ca 0.21 -0.71 0.08 0.00 -1.10 0.00 0.00 60.65 59.13 1iyf s ILE 69 Cb -0.16 -3.08 0.27 0.00 -1.06 0.00 0.00 42.46 38.43 1iyf s ILE 69 CO 0.16 0.21 0.65 0.52 -0.10 0.00 0.00 174.94 176.39 1iyf n VAL 70 N 0.78 0.66 -3.61 2.92 0.31 0.84 -3.53 118.33 116.71 1iyf n VAL 70 Ca -0.11 -4.60 -0.37 0.00 -0.01 0.00 0.00 64.34 59.25 1iyf n VAL 70 Cb 0.52 -1.75 -0.06 0.00 -0.91 0.00 0.00 33.84 31.64 1iyf n VAL 70 CO 0.00 0.00 0.00 -1.58 -1.32 0.00 0.00 176.83 173.93 1iyf s GLN 71 N -1.94 3.33 0.02 5.55 2.00 -1.14 -0.10 119.66 127.38 1iyf s GLN 71 Ca 0.38 -3.22 0.03 0.00 -2.00 0.00 0.00 55.36 50.55 1iyf s GLN 71 Cb 0.19 -4.01 -0.01 0.00 0.80 0.00 0.00 33.01 29.98 1iyf s GLN 71 CO -0.08 -1.26 -0.08 -0.98 -0.50 0.00 0.00 175.29 172.39 1iyf s ARG 72 N -1.24 0.59 0.76 1.67 1.70 -1.26 -4.62 118.95 116.55 1iyf s ARG 72 Ca 0.27 -0.51 -0.14 0.00 -0.47 0.00 0.00 55.73 54.88 1iyf s ARG 72 Cb -0.08 -0.51 0.06 0.00 -0.57 0.00 0.00 34.95 33.85 1iyf s ARG 72 CO -0.11 0.12 1.22 -1.25 -1.08 0.00 0.00 175.30 174.20 1iyf s PRO 73 N -0.83 1.90 -0.47 3.89 0.04 -1.26 -3.83 135.00 134.44 1iyf s PRO 73 Ca -0.02 1.80 -0.18 0.00 0.04 0.00 0.00 61.00 62.64 1iyf s PRO 73 Cb -0.06 -1.80 0.05 0.00 0.04 0.00 0.00 34.50 32.73 1iyf s PRO 73 CO 0.00 -2.03 0.51 1.67 0.04 0.00 0.00 177.00 177.20 1iyf s TRP 74 N -2.00 3.13 -0.27 0.56 -2.14 -1.26 -5.02 118.94 111.95 1iyf s TRP 74 Ca 0.75 -0.56 -0.06 0.00 2.66 0.00 0.00 56.10 58.88 1iyf s TRP 74 Cb -0.30 -3.24 -0.01 0.00 -3.10 0.00 0.00 33.47 26.82 1iyf s TRP 74 CO 0.48 -0.87 0.06 -0.98 -2.66 0.00 0.00 176.95 172.97 1iyf s ARG 75 N 2.25 3.33 0.00 3.25 1.04 -1.26 -5.22 118.95 122.33 1iyf s ARG 75 Ca 0.12 -0.69 0.00 0.00 -1.04 0.00 0.00 55.73 54.12 1iyf s ARG 75 Cb -0.20 -3.30 0.00 0.00 -2.04 0.00 0.00 34.95 29.42 1iyf s ARG 75 CO 0.11 -0.32 0.41 1.63 -0.04 0.00 0.00 175.30 177.10