#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 0.66 0.07 2.02 -4.36 -0.51 0.30 121.20 119.39 1iyf s ILE 2 Ca 0.00 -0.30 0.06 0.00 -0.26 0.00 0.00 60.65 60.15 1iyf s ILE 2 Cb 0.00 -0.91 -0.03 0.00 1.25 0.00 0.00 42.46 42.77 1iyf s ILE 2 CO 0.00 0.10 -0.16 -0.69 0.24 0.00 0.00 174.94 174.43 1iyf s VAL 3 N 1.83 1.26 -0.13 8.37 1.01 0.45 -1.91 120.40 131.27 1iyf s VAL 3 Ca 0.02 -1.31 -0.21 0.00 0.00 0.00 0.00 61.98 60.48 1iyf s VAL 3 Cb -0.14 -1.18 -0.03 0.00 0.00 0.00 0.00 36.38 35.03 1iyf s VAL 3 CO -0.07 -0.15 0.62 -0.36 0.00 0.00 0.00 175.10 175.14 1iyf s PHE 4 N -1.18 3.48 -0.27 5.22 0.40 -0.31 0.35 117.98 125.67 1iyf s PHE 4 Ca 0.01 1.03 -0.08 0.00 -0.60 0.00 0.00 56.93 57.29 1iyf s PHE 4 Cb -0.10 -2.75 -0.02 0.00 0.51 0.00 0.00 43.02 40.67 1iyf s PHE 4 CO 0.03 -0.01 0.10 0.54 0.70 0.00 0.00 175.22 176.58 1iyf s VAL 5 N 1.24 4.36 -0.02 -0.44 0.11 0.11 0.21 120.40 125.96 1iyf s VAL 5 Ca 0.31 -0.31 -0.02 0.00 -2.93 0.00 0.00 61.98 59.03 1iyf s VAL 5 Cb -0.16 -3.12 -0.04 0.00 -1.53 0.00 0.00 36.38 31.53 1iyf s VAL 5 CO 0.13 0.22 0.12 -0.13 -3.33 0.00 0.00 175.10 172.11 1iyf s ARG 6 N 1.60 3.22 0.24 1.54 1.81 -0.78 -0.10 118.95 126.48 1iyf s ARG 6 Ca 0.05 -0.39 0.08 0.00 -1.72 0.00 0.00 55.73 53.75 1iyf s ARG 6 Cb -0.16 -2.97 -0.04 0.00 -0.45 0.00 0.00 34.95 31.33 1iyf s ARG 6 CO 0.04 0.67 0.11 -0.06 -0.68 0.00 0.00 175.30 175.38 1iyf s PHE 7 N -1.21 2.96 -0.31 -0.53 0.08 -1.18 0.10 117.98 117.90 1iyf s PHE 7 Ca 0.23 -0.14 -0.24 0.00 0.12 0.00 0.00 56.93 56.91 1iyf s PHE 7 Cb -0.12 -1.35 -0.25 0.00 -0.57 0.00 0.00 43.02 40.73 1iyf s PHE 7 CO 0.14 0.55 1.68 -1.71 -0.10 0.00 0.00 175.22 175.78 1iyf n ASN 8 N -0.89 1.62 -3.59 1.36 5.15 -1.22 -4.55 115.26 113.14 1iyf n ASN 8 Ca -0.08 -2.50 -0.04 0.00 -0.60 0.00 0.00 54.58 51.36 1iyf n ASN 8 Cb 0.58 -0.74 -0.02 0.00 -0.53 0.00 0.00 39.78 39.07 1iyf n ASN 8 CO 0.00 0.00 0.00 -0.55 1.40 0.00 0.00 177.26 178.11 1iyf s SER 9 N 5.95 -0.19 -1.10 1.20 0.15 -1.26 -5.04 113.70 113.42 1iyf s SER 9 Ca 0.57 -0.06 -0.20 0.00 0.70 0.00 0.00 55.95 56.95 1iyf s SER 9 Cb 0.13 0.25 -0.07 0.00 -1.71 0.00 0.00 66.02 64.62 1iyf s SER 9 CO 0.22 -0.42 1.94 -1.20 1.20 0.00 0.00 173.24 174.98 1iyf n SER 10 N -0.24 3.29 -3.67 5.45 7.64 -1.26 -4.78 113.62 120.06 1iyf n SER 10 Ca -0.04 -2.75 -0.12 0.00 1.01 0.00 0.00 58.87 56.97 1iyf n SER 10 Cb 0.60 -1.51 -0.08 0.00 -1.01 0.00 0.00 64.21 62.21 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 6.72 -0.73 -0.03 1.43 5.04 -1.26 -5.11 115.29 121.34 1iyf s HIS 11 Ca 0.59 1.67 0.03 0.00 -1.54 0.00 0.00 55.06 55.82 1iyf s HIS 11 Cb 0.07 0.31 0.00 0.00 0.04 0.00 0.00 32.58 33.01 1iyf s HIS 11 CO 0.09 -0.36 -0.12 0.20 -2.34 0.00 0.00 174.74 172.21 1iyf s GLY 12 N 0.71 0.68 -0.30 1.59 0.00 -1.26 -3.10 107.32 105.64 1iyf s GLY 12 Ca -0.03 -0.45 0.03 0.00 0.00 0.00 0.00 44.72 44.27 1iyf s GLY 12 CO -0.05 -0.15 -0.04 -0.12 0.00 0.00 0.00 173.10 172.75 1iyf s PHE 13 N 0.19 3.47 -0.10 1.90 5.36 0.86 -4.94 117.98 124.72 1iyf s PHE 13 Ca -0.04 -2.58 -0.29 0.00 -0.96 0.00 0.00 56.93 53.05 1iyf s PHE 13 Cb -0.10 -2.36 -0.04 0.00 -0.34 0.00 0.00 43.02 40.18 1iyf s PHE 13 CO 0.01 -0.91 1.57 -1.25 -1.46 0.00 0.00 175.22 173.18 1iyf s PRO 14 N 1.03 4.15 0.09 10.12 0.04 -1.26 0.06 135.00 149.22 1iyf s PRO 14 Ca -0.01 2.01 0.09 0.00 0.04 0.00 0.00 61.00 63.13 1iyf s PRO 14 Cb -0.20 -3.94 -0.04 0.00 0.04 0.00 0.00 34.50 30.36 1iyf s PRO 14 CO -0.06 -0.87 -0.21 0.14 0.04 0.00 0.00 177.00 176.04 1iyf s VAL 15 N 4.06 2.63 -1.24 -0.36 -7.23 0.16 -4.92 120.40 113.50 1iyf s VAL 15 Ca 0.69 -1.44 -0.09 0.00 -1.81 0.00 0.00 61.98 59.32 1iyf s VAL 15 Cb -0.30 -2.15 0.19 0.00 0.56 0.00 0.00 36.38 34.68 1iyf s VAL 15 CO 0.26 0.20 1.74 1.21 -0.31 0.00 0.00 175.10 178.20 1iyf n GLU 16 N 1.16 3.71 0.00 4.82 2.13 -1.26 0.17 120.64 131.36 1iyf n GLU 16 Ca -0.16 -3.74 0.00 0.00 0.66 0.00 0.00 57.16 53.91 1iyf n GLU 16 Cb 0.52 -2.87 0.00 0.00 0.27 0.00 0.00 31.44 29.36 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 3.21 0.00 -1.91 6.31 3.14 0.89 -4.62 118.33 125.36 1iyf n VAL 17 Ca 0.37 0.00 -0.42 0.00 -2.96 0.00 0.00 64.34 61.33 1iyf n VAL 17 Cb 0.37 0.00 -0.03 0.00 -1.06 0.00 0.00 33.84 33.12 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 6.50 0.17 6.55 1.47 -1.26 -1.49 116.67 128.61 1iyf s ASP 18 Ca 0.00 2.26 0.16 0.00 1.18 0.00 0.00 52.55 56.15 1iyf s ASP 18 Cb 0.00 -2.53 -0.04 0.00 -0.34 0.00 0.00 42.92 40.01 1iyf s ASP 18 CO 0.00 -1.06 1.12 0.28 0.68 0.00 0.00 175.17 176.18 1iyf h SER 19 N 10.31 0.00 0.93 2.11 0.02 -1.93 -3.36 113.55 121.63 1iyf h SER 19 Ca -0.41 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.54 1iyf h SER 19 Cb 1.19 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.73 1iyf h SER 19 CO 0.96 0.51 -1.04 -0.90 -1.14 0.00 0.00 176.83 175.21 1iyf n ASP 20 N -3.03 0.80 -3.01 3.07 5.75 -1.26 -4.23 116.55 114.64 1iyf n ASP 20 Ca -0.04 0.30 -0.27 0.00 -0.01 0.00 0.00 54.79 54.76 1iyf n ASP 20 Cb 0.78 0.52 0.01 0.00 -1.03 0.00 0.00 41.12 41.40 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 -2.63 0.00 0.00 2.12 5.66 -1.26 -4.31 114.28 113.87 1iyf n THR 21 Ca -0.00 -0.36 0.00 0.00 -3.05 0.00 0.00 64.05 60.64 1iyf n THR 21 Cb 0.55 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.33 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 1.97 0.00 -0.37 1.09 2.88 -1.26 -0.96 113.62 116.97 1iyf n SER 22 Ca 0.04 0.00 0.33 0.00 -1.33 0.00 0.00 58.87 57.91 1iyf n SER 22 Cb 0.35 0.00 0.60 0.00 -0.75 0.00 0.00 64.21 64.42 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 -0.14 2.46 2.10 -1.86 1.33 117.51 121.46 1iyf h ILE 23 Ca 0.00 -0.02 -0.04 0.00 1.08 0.00 0.00 64.86 65.88 1iyf h ILE 23 Cb 0.00 -0.00 -0.00 0.00 -1.09 0.00 0.00 36.82 35.72 1iyf h ILE 23 CO 0.00 0.01 -0.07 -0.26 -1.08 0.00 0.00 178.15 176.75 1iyf h PHE 24 N 0.06 0.35 0.32 2.19 -1.00 -1.96 -1.60 116.94 115.30 1iyf h PHE 24 Ca 0.84 -0.09 -0.02 0.00 2.81 0.00 0.00 57.97 61.51 1iyf h PHE 24 Cb 2.35 -0.08 0.00 0.00 3.61 0.00 0.00 35.95 41.83 1iyf h PHE 24 CO -0.01 0.63 -0.15 1.96 -1.61 0.00 0.00 178.31 179.13 1iyf h GLN 25 N -0.03 -0.41 0.38 1.51 1.08 0.12 -2.10 115.11 115.66 1iyf h GLN 25 Ca 0.03 0.03 -0.01 0.00 -1.45 0.00 0.00 58.65 57.25 1iyf h GLN 25 Cb 0.54 0.09 -0.02 0.00 -0.05 0.00 0.00 27.48 28.05 1iyf h GLN 25 CO 0.02 -0.11 -0.32 1.37 -0.95 0.00 0.00 178.83 178.84 1iyf h LEU 26 N -0.73 -0.85 -1.31 1.46 8.10 0.21 -1.78 115.31 120.41 1iyf h LEU 26 Ca -0.04 0.07 0.19 0.00 0.11 0.00 0.00 57.88 58.20 1iyf h LEU 26 Cb 0.49 0.28 -0.08 0.00 -0.44 0.00 0.00 40.66 40.91 1iyf h LEU 26 CO 0.07 -0.47 0.60 0.07 -4.11 0.00 0.00 178.44 174.60 1iyf h LYS 27 N -0.71 0.56 0.69 0.17 5.09 -1.38 -1.74 116.57 119.25 1iyf h LYS 27 Ca -0.03 -0.03 -0.03 0.00 0.09 0.00 0.00 60.65 60.64 1iyf h LYS 27 Cb 0.62 -0.13 0.01 0.00 0.10 0.00 0.00 32.23 32.83 1iyf h LYS 27 CO -0.02 0.37 -0.33 0.93 -2.09 0.00 0.00 179.45 178.31 1iyf h GLU 28 N 0.58 -0.89 0.08 0.07 5.08 -0.73 -1.69 114.58 117.09 1iyf h GLU 28 Ca 0.50 0.06 0.02 0.00 -1.00 0.00 0.00 59.36 58.94 1iyf h GLU 28 Cb 0.99 0.20 -0.04 0.00 0.50 0.00 0.00 28.75 30.40 1iyf h GLU 28 CO -0.24 -0.59 -0.35 0.28 -1.00 0.00 0.00 179.01 177.10 1iyf h VAL 29 N -1.23 0.26 0.00 3.13 2.07 -1.04 0.24 116.25 119.68 1iyf h VAL 29 Ca -0.09 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.43 1iyf h VAL 29 Cb 0.71 0.26 0.00 0.00 -1.52 0.00 0.00 31.29 30.74 1iyf h VAL 29 CO 0.16 0.00 0.00 0.55 0.02 0.00 0.00 177.57 178.30 1iyf n VAL 30 N -5.43 0.00 -0.29 2.57 3.14 -0.68 -2.14 118.33 115.49 1iyf n VAL 30 Ca -0.06 1.30 0.32 0.00 -2.96 0.00 0.00 64.34 62.94 1iyf n VAL 30 Cb 0.35 -2.28 0.71 0.00 -1.06 0.00 0.00 33.84 31.56 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 -1.97 2.93 0.15 1.55 0.00 -1.38 2.23 119.26 122.77 1iyf h ALA 31 Ca 0.00 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 1iyf h ALA 31 Cb 0.00 0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.87 1iyf h ALA 31 CO 0.00 -1.26 -0.07 -0.22 0.00 0.00 0.00 179.25 177.69 1iyf h LYS 32 N 0.06 -0.20 -0.00 0.00 3.64 -0.84 -2.43 116.57 116.80 1iyf h LYS 32 Ca 0.54 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.93 1iyf h LYS 32 Cb 2.04 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 33.90 1iyf h LYS 32 CO -0.05 0.14 -0.20 0.54 -2.27 0.00 0.00 179.45 177.61 1iyf n ARG 33 N -5.02 0.45 0.00 1.90 1.74 -0.13 -3.62 116.66 111.97 1iyf n ARG 33 Ca -0.09 -0.18 0.14 0.00 -0.77 0.00 0.00 57.85 56.96 1iyf n ARG 33 Cb 0.23 -1.50 0.70 0.00 -1.02 0.00 0.00 32.46 30.87 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 -1.12 0.30 -2.67 5.56 -0.06 0.74 -4.87 117.38 115.24 1iyf n GLN 34 Ca 0.11 0.01 -0.09 0.00 -2.00 0.00 0.00 57.00 55.03 1iyf n GLN 34 Cb 0.31 -1.50 0.02 0.00 -4.06 0.00 0.00 30.24 25.01 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 1.28 0.28 1.17 1.69 0.00 -1.22 -4.99 105.19 103.40 1iyf n GLY 35 Ca 0.12 -0.40 -0.06 0.00 0.00 0.00 0.00 46.02 45.68 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 -3.63 0.00 0.00 1.61 0.24 -0.93 -5.10 118.33 110.52 1iyf n VAL 36 Ca -0.03 -0.70 0.00 0.00 -2.04 0.00 0.00 64.34 61.57 1iyf n VAL 36 Cb 0.54 0.40 0.00 0.00 -1.47 0.00 0.00 33.84 33.31 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 -0.21 2.89 -0.03 7.34 -0.04 -1.26 -4.25 135.00 139.45 1iyf n PRO 37 Ca 0.01 0.00 -0.03 0.00 -0.04 0.00 0.00 63.50 63.44 1iyf n PRO 37 Cb 0.21 0.00 -0.01 0.00 -0.04 0.00 0.00 33.50 33.66 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 0.98 -1.84 0.55 0.00 -1.26 -2.99 120.51 112.95 1iyf n ALA 38 Ca 0.00 -0.38 -0.25 0.00 0.00 0.00 0.00 53.44 52.81 1iyf n ALA 38 Cb 0.00 0.03 0.04 0.00 0.00 0.00 0.00 19.45 19.53 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 -3.25 5.38 0.00 0.00 2.03 -1.26 -3.95 116.55 115.50 1iyf n ASP 39 Ca -0.05 -3.76 0.00 0.00 0.52 0.00 0.00 54.79 51.50 1iyf n ASP 39 Cb 0.17 -0.50 0.00 0.00 -0.72 0.00 0.00 41.12 40.08 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 -0.78 0.00 0.00 -0.67 -0.06 -1.26 -4.81 117.38 109.79 1iyf n GLN 40 Ca 0.47 0.19 0.00 0.00 -2.00 0.00 0.00 57.00 55.66 1iyf n GLN 40 Cb 0.90 -0.74 0.00 0.00 -4.06 0.00 0.00 30.24 26.34 1iyf n GLN 40 CO 0.00 0.00 0.00 1.28 -0.20 0.00 0.00 177.06 178.14 1iyf n LEU 41 N -0.43 0.00 -3.95 1.69 4.77 -1.26 -4.94 117.00 112.89 1iyf n LEU 41 Ca 0.00 0.00 -0.24 0.00 -0.03 0.00 0.00 56.01 55.74 1iyf n LEU 41 Cb 0.00 0.00 -0.17 0.00 -2.33 0.00 0.00 43.42 40.92 1iyf n LEU 41 CO 0.00 0.00 -0.44 -0.13 -1.33 0.00 0.00 177.39 175.49 1iyf s ARG 42 N 1.70 1.42 -0.07 3.23 0.52 0.50 -4.83 118.95 121.42 1iyf s ARG 42 Ca 0.00 -0.28 -0.11 0.00 -0.52 0.00 0.00 55.73 54.83 1iyf s ARG 42 Cb 0.00 -1.33 -0.05 0.00 0.52 0.00 0.00 34.95 34.10 1iyf s ARG 42 CO 0.00 -0.10 0.26 0.08 0.02 0.00 0.00 175.30 175.56 1iyf s VAL 43 N 1.10 5.29 0.07 3.52 1.01 -1.26 -0.66 120.40 129.47 1iyf s VAL 43 Ca -0.07 0.49 -0.00 0.00 0.00 0.00 0.00 61.98 62.40 1iyf s VAL 43 Cb -0.14 -3.54 -0.04 0.00 0.00 0.00 0.00 36.38 32.65 1iyf s VAL 43 CO -0.01 0.60 -0.04 -0.63 0.00 0.00 0.00 175.10 175.01 1iyf s ILE 44 N -1.02 0.38 0.08 2.22 1.09 0.20 -0.97 121.20 123.18 1iyf s ILE 44 Ca 0.19 -1.82 0.03 0.00 -1.10 0.00 0.00 60.65 57.94 1iyf s ILE 44 Cb -0.14 -1.54 -0.03 0.00 -1.06 0.00 0.00 42.46 39.69 1iyf s ILE 44 CO 0.08 -0.94 -0.08 0.12 -0.10 0.00 0.00 174.94 174.02 1iyf s PHE 45 N -3.73 0.88 -0.39 3.97 5.36 -0.53 0.16 117.98 123.69 1iyf s PHE 45 Ca 0.08 -0.67 -0.05 0.00 -0.96 0.00 0.00 56.93 55.33 1iyf s PHE 45 Cb 0.06 -0.50 0.05 0.00 -0.34 0.00 0.00 43.02 42.29 1iyf s PHE 45 CO -0.08 -0.07 0.13 0.00 -1.46 0.00 0.00 175.22 173.74 1iyf n ALA 46 N 0.73 -0.30 0.00 11.12 0.00 -1.22 0.35 120.51 131.19 1iyf n ALA 46 Ca -0.17 -0.04 0.00 0.00 0.00 0.00 0.00 53.44 53.22 1iyf n ALA 46 Cb 0.57 -0.55 0.00 0.00 0.00 0.00 0.00 19.45 19.47 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 -0.54 2.90 3.61 0.00 0.00 -1.26 -4.98 105.19 104.91 1iyf n GLY 47 Ca 0.03 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.64 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 -0.05 3.96 0.16 1.61 1.02 1.07 -5.02 119.74 122.50 1iyf s LYS 48 Ca 0.00 0.37 -0.32 0.00 0.02 0.00 0.00 55.97 56.05 1iyf s LYS 48 Cb 0.00 -3.70 -0.10 0.00 -0.52 0.00 0.00 37.83 33.51 1iyf s LYS 48 CO 0.00 -0.52 1.55 -2.00 -0.92 0.00 0.00 175.35 173.46 1iyf s GLU 49 N 2.58 4.23 0.00 1.68 2.12 -1.26 -1.46 118.70 126.59 1iyf s GLU 49 Ca 0.25 2.33 0.00 0.00 0.36 0.00 0.00 54.97 57.92 1iyf s GLU 49 Cb -0.15 -3.16 0.00 0.00 0.26 0.00 0.00 34.13 31.08 1iyf s GLU 49 CO 0.11 -0.59 0.00 1.47 -0.54 0.00 0.00 175.26 175.71 1iyf n LEU 50 N 3.96 0.00 -4.22 2.70 -0.00 -0.15 -4.79 117.00 114.51 1iyf n LEU 50 Ca 0.14 0.00 -0.34 0.00 -0.00 0.00 0.00 56.01 55.80 1iyf n LEU 50 Cb 0.39 0.00 -0.15 0.00 -0.00 0.00 0.00 43.42 43.66 1iyf n LEU 50 CO 0.61 0.00 -0.44 -0.13 -0.00 0.00 0.00 177.39 177.43 1iyf s ARG 51 N 0.00 3.10 0.24 1.47 3.00 -1.26 -4.77 118.95 120.73 1iyf s ARG 51 Ca 0.00 -0.79 -0.09 0.00 0.00 0.00 0.00 55.73 54.85 1iyf s ARG 51 Cb 0.00 -2.86 0.37 0.00 0.00 0.00 0.00 34.95 32.46 1iyf s ARG 51 CO 0.00 -0.26 1.62 -2.95 0.00 0.00 0.00 175.30 173.72 1iyf h ASN 52 N 8.03 -0.50 0.00 0.23 7.08 -1.90 -1.27 115.58 127.26 1iyf h ASN 52 Ca -0.41 0.20 0.00 0.00 -3.08 0.00 0.00 56.30 53.02 1iyf h ASN 52 Cb 1.14 0.39 0.00 0.00 -2.08 0.00 0.00 38.32 37.77 1iyf h ASN 52 CO 0.61 -0.21 -0.44 0.47 -2.08 0.00 0.00 177.43 175.78 1iyf n ASP 53 N -5.41 2.05 -0.03 6.14 9.92 -1.26 -4.08 116.55 123.88 1iyf n ASP 53 Ca 0.12 -0.30 -0.02 0.00 -0.53 0.00 0.00 54.79 54.06 1iyf n ASP 53 Cb 0.43 1.01 -0.13 0.00 -0.64 0.00 0.00 41.12 41.78 1iyf n ASP 53 CO 0.00 0.00 0.00 1.87 0.13 0.00 0.00 177.20 179.20 1iyf n TRP 54 N -1.22 0.41 -0.04 1.24 -0.00 -1.21 -2.54 117.44 114.07 1iyf n TRP 54 Ca 0.00 0.14 -0.02 0.00 -0.00 0.00 0.00 57.50 57.62 1iyf n TRP 54 Cb 0.01 -0.94 -0.09 0.00 -0.00 0.00 0.00 31.31 30.29 1iyf n TRP 54 CO 0.00 0.00 0.00 2.41 -0.00 0.00 0.00 177.69 180.10 1iyf n THR 55 N -2.72 0.54 0.00 5.87 -1.04 -0.55 -4.28 114.28 112.10 1iyf n THR 55 Ca -0.18 -0.41 0.00 0.00 -2.04 0.00 0.00 64.05 61.42 1iyf n THR 55 Cb 0.92 -0.44 0.00 0.00 -1.82 0.00 0.00 70.33 68.99 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 -2.27 0.00 0.04 12.58 0.24 -0.80 -4.52 118.33 123.61 1iyf n VAL 56 Ca -0.13 0.00 -0.11 0.00 -2.04 0.00 0.00 64.34 62.05 1iyf n VAL 56 Cb 0.70 0.00 0.01 0.00 -1.47 0.00 0.00 33.84 33.08 1iyf n VAL 56 CO 0.00 0.00 0.00 0.06 -2.14 0.00 0.00 176.83 174.75 1iyf h GLN 57 N 0.00 0.47 0.00 7.34 3.07 -1.90 -1.75 115.11 122.35 1iyf h GLN 57 Ca 0.00 -0.39 0.00 0.00 0.09 0.00 0.00 58.65 58.35 1iyf h GLN 57 Cb 0.00 0.08 0.00 0.00 0.08 0.00 0.00 27.48 27.64 1iyf h GLN 57 CO 0.00 1.02 0.00 0.09 0.09 0.00 0.00 178.83 180.03 1iyf n ASN 58 N -3.85 0.00 0.00 0.06 4.13 -1.26 -3.58 115.26 110.75 1iyf n ASN 58 Ca -0.05 -0.45 0.00 0.00 1.68 0.00 0.00 54.58 55.76 1iyf n ASN 58 Cb 0.72 -0.04 0.00 0.00 -1.54 0.00 0.00 39.78 38.92 1iyf n ASN 58 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1iyf n ASP 60 N -1.51 -2.22 -4.50 0.00 -0.08 -0.98 -4.96 116.55 102.29 1iyf n ASP 60 Ca 0.00 -2.02 -0.28 0.00 -1.51 0.00 0.00 54.79 50.97 1iyf n ASP 60 Cb 0.00 1.19 -0.11 0.00 2.34 0.00 0.00 41.12 44.54 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 0.50 2.74 0.50 -2.67 2.01 -1.25 -4.97 118.68 115.54 1iyf s LEU 61 Ca 0.27 -0.60 0.02 0.00 0.01 0.00 0.00 54.13 53.84 1iyf s LEU 61 Cb 0.12 -1.53 -0.01 0.00 0.01 0.00 0.00 46.19 44.77 1iyf s LEU 61 CO -0.11 0.15 0.05 -1.81 1.01 0.00 0.00 176.35 175.65 1iyf s ASP 62 N -2.36 4.17 0.29 2.29 1.01 -1.26 -4.99 116.67 115.82 1iyf s ASP 62 Ca 0.20 -1.57 -0.01 0.00 0.71 0.00 0.00 52.55 51.88 1iyf s ASP 62 Cb -0.10 0.39 0.47 0.00 1.01 0.00 0.00 42.92 44.69 1iyf s ASP 62 CO 0.11 -0.83 1.91 1.56 0.21 0.00 0.00 175.17 178.13 1iyf h GLN 63 N 1.33 1.08 -3.42 8.23 7.50 -2.01 -3.26 115.11 124.55 1iyf h GLN 63 Ca -0.43 -0.06 -0.68 0.00 0.50 0.00 0.00 58.65 57.98 1iyf h GLN 63 Cb 1.31 -0.24 -0.37 0.00 0.05 0.00 0.00 27.48 28.22 1iyf h GLN 63 CO 0.73 0.71 -0.40 -1.14 -1.50 0.00 0.00 178.83 177.23 1iyf s GLN 64 N -5.96 2.54 0.38 1.46 0.74 -1.26 -1.42 119.66 116.14 1iyf s GLN 64 Ca -0.12 -2.78 0.07 0.00 0.05 0.00 0.00 55.36 52.58 1iyf s GLN 64 Cb 0.19 -3.64 -0.00 0.00 1.10 0.00 0.00 33.01 30.66 1iyf s GLN 64 CO 0.80 -1.19 0.49 -1.12 -0.55 0.00 0.00 175.29 173.72 1iyf s SER 65 N 0.06 5.69 -0.10 6.67 0.01 -0.80 -5.01 113.70 120.21 1iyf s SER 65 Ca 0.20 -0.37 -0.00 0.00 1.31 0.00 0.00 55.95 57.09 1iyf s SER 65 Cb -0.18 -0.90 0.02 0.00 0.21 0.00 0.00 66.02 65.17 1iyf s SER 65 CO -0.06 -0.58 -0.07 0.27 0.41 0.00 0.00 173.24 173.21 1iyf s ILE 66 N -2.29 0.95 -0.07 1.44 -5.25 -1.26 -1.16 121.20 113.56 1iyf s ILE 66 Ca 0.49 -0.26 0.04 0.00 -0.99 0.00 0.00 60.65 59.93 1iyf s ILE 66 Cb -0.09 -0.96 -0.02 0.00 2.95 0.00 0.00 42.46 44.34 1iyf s ILE 66 CO 0.31 0.35 -0.20 -0.69 -1.79 0.00 0.00 174.94 172.92 1iyf s VAL 67 N 1.54 2.56 -0.49 8.37 1.01 0.13 -3.41 120.40 130.11 1iyf s VAL 67 Ca 0.01 -0.89 -0.20 0.00 0.00 0.00 0.00 61.98 60.91 1iyf s VAL 67 Cb -0.13 -1.98 0.05 0.00 0.00 0.00 0.00 36.38 34.32 1iyf s VAL 67 CO -0.06 0.57 0.64 -1.00 0.00 0.00 0.00 175.10 175.25 1iyf s HIS 68 N -0.29 3.04 -0.11 5.22 3.76 0.41 -1.87 115.29 125.46 1iyf s HIS 68 Ca 0.01 -0.41 -0.07 0.00 -0.15 0.00 0.00 55.06 54.44 1iyf s HIS 68 Cb -0.13 -3.50 -0.04 0.00 1.11 0.00 0.00 32.58 30.02 1iyf s HIS 68 CO 0.03 -1.01 0.14 0.42 -0.85 0.00 0.00 174.74 173.47 1iyf s ILE 69 N 2.72 5.49 -0.40 0.60 1.09 0.28 0.62 121.20 131.60 1iyf s ILE 69 Ca 0.17 0.18 0.07 0.00 -1.10 0.00 0.00 60.65 59.97 1iyf s ILE 69 Cb -0.18 -3.40 0.23 0.00 -1.06 0.00 0.00 42.46 38.05 1iyf s ILE 69 CO 0.14 0.60 0.49 0.52 -0.10 0.00 0.00 174.94 176.59 1iyf n VAL 70 N 1.92 -0.80 -3.06 2.92 0.31 0.17 -3.46 118.33 116.33 1iyf n VAL 70 Ca -0.19 -3.73 -0.23 0.00 -0.01 0.00 0.00 64.34 60.17 1iyf n VAL 70 Cb 0.55 -1.72 -0.04 0.00 -0.91 0.00 0.00 33.84 31.72 1iyf n VAL 70 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1iyf n GLN 71 N 1.80 2.23 -4.94 5.55 -0.00 -1.22 0.19 117.38 120.99 1iyf n GLN 71 Ca 0.23 -4.21 -0.27 0.00 -0.00 0.00 0.00 57.00 52.74 1iyf n GLN 71 Cb 0.52 -2.00 -0.16 0.00 -0.00 0.00 0.00 30.24 28.60 1iyf n GLN 71 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.06 176.08 1iyf s ARG 72 N -2.97 1.98 0.66 2.61 1.04 -1.26 -4.11 118.95 116.90 1iyf s ARG 72 Ca 0.45 -0.68 -0.17 0.00 -1.04 0.00 0.00 55.73 54.29 1iyf s ARG 72 Cb 0.30 -1.71 0.00 0.00 -2.04 0.00 0.00 34.95 31.51 1iyf s ARG 72 CO -0.11 0.28 1.23 -1.25 -0.04 0.00 0.00 175.30 175.40 1iyf s PRO 73 N -0.00 2.52 -0.04 3.89 0.04 -1.26 -4.68 135.00 135.46 1iyf s PRO 73 Ca -0.04 1.85 0.06 0.00 0.04 0.00 0.00 61.00 62.90 1iyf s PRO 73 Cb -0.12 -1.87 -0.01 0.00 0.04 0.00 0.00 34.50 32.54 1iyf s PRO 73 CO 0.03 -1.56 -0.23 -0.46 0.04 0.00 0.00 177.00 174.82 1iyf s TRP 74 N -1.73 2.16 -0.58 0.56 -0.00 -1.26 -5.09 118.94 113.00 1iyf s TRP 74 Ca 0.77 -0.58 -0.26 0.00 -0.00 0.00 0.00 56.10 56.03 1iyf s TRP 74 Cb -0.31 -1.42 0.04 0.00 -0.00 0.00 0.00 33.47 31.78 1iyf s TRP 74 CO 0.40 -0.16 1.09 -0.98 -0.00 0.00 0.00 176.95 177.30 1iyf s ARG 75 N -0.21 3.40 0.00 5.86 1.70 -1.26 -5.28 118.95 123.17 1iyf s ARG 75 Ca -0.01 -0.04 0.02 0.00 -0.47 0.00 0.00 55.73 55.23 1iyf s ARG 75 Cb -0.12 -4.05 0.10 0.00 -0.57 0.00 0.00 34.95 30.31 1iyf s ARG 75 CO 0.02 -1.64 0.59 1.17 -1.08 0.00 0.00 175.30 174.36