#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yop s VAL 2 N 0.00 4.79 -0.43 3.17 1.01 -1.26 -4.98 120.40 122.70 1yop s VAL 2 Ca 0.00 -0.31 0.00 0.00 0.00 0.00 0.00 61.98 61.68 1yop s VAL 2 Cb 0.00 -3.42 0.20 0.00 0.00 0.00 0.00 36.38 33.16 1yop s VAL 2 CO 0.00 0.09 0.91 -0.44 0.00 0.00 0.00 175.10 175.65 1yop s SER 3 N 1.65 -0.89 0.75 3.32 0.01 -1.26 -5.15 113.70 112.13 1yop s SER 3 Ca 0.05 -1.05 0.00 0.00 1.31 0.00 0.00 55.95 56.26 1yop s SER 3 Cb -0.17 1.16 0.00 0.00 0.21 0.00 0.00 66.02 67.22 1yop s SER 3 CO 0.07 -0.03 0.00 0.35 0.41 0.00 0.00 173.24 174.04 1yop n THR 4 N 2.80 0.00 -0.06 1.44 -2.24 -1.26 -4.77 114.28 110.19 1yop n THR 4 Ca 0.15 0.00 -0.08 0.00 -2.27 0.00 0.00 64.05 61.84 1yop n THR 4 Cb 0.60 -0.06 -0.05 0.00 -2.10 0.00 0.00 70.33 68.72 1yop n THR 4 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1yop n TYR 5 N -1.96 0.00 -3.92 4.78 4.02 -0.58 -4.99 117.16 114.51 1yop n TYR 5 Ca 0.00 0.00 -0.10 0.00 -0.01 0.00 0.00 57.90 57.79 1yop n TYR 5 Cb 0.08 -0.42 -0.01 0.00 -0.02 0.00 0.00 39.34 38.97 1yop n TYR 5 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 1yop s ASP 6 N -5.21 0.20 -0.05 7.72 1.01 -1.26 -5.07 116.67 114.00 1yop s ASP 6 Ca -0.15 -1.13 0.02 0.00 0.71 0.00 0.00 52.55 52.01 1yop s ASP 6 Cb 0.04 0.74 0.01 0.00 1.01 0.00 0.00 42.92 44.73 1yop s ASP 6 CO 0.24 -1.45 -0.11 -1.83 0.21 0.00 0.00 175.17 172.23 1yop s GLU 7 N -3.00 1.42 0.11 8.23 -1.05 -1.26 -0.95 118.70 122.20 1yop s GLU 7 Ca 0.20 -0.35 0.05 0.00 -0.15 0.00 0.00 54.97 54.73 1yop s GLU 7 Cb -0.03 -1.22 -0.04 0.00 -0.44 0.00 0.00 34.13 32.40 1yop s GLU 7 CO 0.13 0.03 -0.14 0.42 0.95 0.00 0.00 175.26 176.66 1yop s ILE 8 N 0.59 1.25 0.04 1.83 -1.09 -0.75 -4.97 121.20 118.11 1yop s ILE 8 Ca -0.12 -1.66 0.01 0.00 -2.23 0.00 0.00 60.65 56.66 1yop s ILE 8 Cb -0.14 -1.45 -0.04 0.00 -1.58 0.00 0.00 42.46 39.25 1yop s ILE 8 CO 0.02 -0.41 0.11 -1.61 -1.23 0.00 0.00 174.94 171.82 1yop s GLU 9 N -2.57 3.08 0.46 2.79 2.02 -1.26 0.06 118.70 123.27 1yop s GLU 9 Ca 0.07 -0.55 0.13 0.00 0.02 0.00 0.00 54.97 54.63 1yop s GLU 9 Cb -0.05 -2.85 1.06 0.00 0.10 0.00 0.00 34.13 32.39 1yop s GLU 9 CO 0.02 0.61 2.06 -0.84 0.02 0.00 0.00 175.26 177.14 1yop h ILE 10 N 2.72 1.00 -0.04 -1.63 3.07 -1.50 -1.17 117.51 119.95 1yop h ILE 10 Ca -0.47 -0.11 -0.00 0.00 1.55 0.00 0.00 64.86 65.83 1yop h ILE 10 Cb 1.17 0.66 -0.00 0.00 -0.27 0.00 0.00 36.82 38.38 1yop h ILE 10 CO 0.67 0.06 0.00 -0.33 -1.05 0.00 0.00 178.15 177.50 1yop h GLU 11 N 0.31 0.05 -1.07 0.16 5.08 -1.95 -2.04 114.58 115.13 1yop h GLU 11 Ca 0.14 -0.00 -0.61 0.00 -1.00 0.00 0.00 59.36 57.88 1yop h GLU 11 Cb 0.18 -0.01 -0.27 0.00 0.50 0.00 0.00 28.75 29.14 1yop h GLU 11 CO -0.03 0.06 0.79 -3.47 -1.00 0.00 0.00 179.01 175.36 1yop n ASP 12 N -4.51 7.16 -4.06 1.42 -0.08 -0.44 -4.92 116.55 111.12 1yop n ASP 12 Ca -0.02 -3.67 -0.18 0.00 -1.51 0.00 0.00 54.79 49.41 1yop n ASP 12 Cb 0.11 -0.97 -0.14 0.00 2.34 0.00 0.00 41.12 42.46 1yop n ASP 12 CO 0.00 0.00 0.00 -0.04 0.12 0.00 0.00 177.20 177.28 1yop s MET 13 N -3.50 0.72 0.03 -0.67 -1.94 -0.77 -4.87 119.30 108.30 1yop s MET 13 Ca 0.59 -0.51 -0.30 0.00 -1.71 0.00 0.00 55.69 53.76 1yop s MET 13 Cb 0.47 -0.68 -0.08 0.00 2.01 0.00 0.00 34.83 36.55 1yop s MET 13 CO 0.00 0.17 1.85 0.99 -0.01 0.00 0.00 175.02 178.03 1yop s THR 14 N -0.59 3.09 -0.16 2.05 2.01 -1.03 -4.90 115.64 116.11 1yop s THR 14 Ca 0.00 0.22 -0.22 0.00 0.31 0.00 0.00 61.69 62.00 1yop s THR 14 Cb -0.06 -3.14 -0.03 0.00 0.01 0.00 0.00 72.50 69.28 1yop s THR 14 CO 0.00 -0.02 0.68 0.72 -0.69 0.00 0.00 174.62 175.31 1yop s PHE 15 N 3.99 3.44 -0.72 4.92 -0.12 -1.26 -1.51 117.98 126.71 1yop s PHE 15 Ca 0.83 1.07 -0.02 0.00 -0.05 0.00 0.00 56.93 58.75 1yop s PHE 15 Cb -0.41 -2.83 0.18 0.00 -0.63 0.00 0.00 43.02 39.34 1yop s PHE 15 CO 0.37 -0.10 0.56 -1.21 -0.05 0.00 0.00 175.22 174.79 1yop s GLU 16 N 1.62 2.81 0.58 1.99 2.02 0.14 -4.91 118.70 122.95 1yop s GLU 16 Ca 0.33 -2.84 0.37 0.00 0.02 0.00 0.00 54.97 52.84 1yop s GLU 16 Cb -0.16 -3.79 1.66 0.00 0.10 0.00 0.00 34.13 31.93 1yop s GLU 16 CO 0.13 -1.21 2.09 -1.00 0.02 0.00 0.00 175.26 175.28 1yop h PRO 17 N 6.58 0.00 -0.88 0.39 0.13 -1.96 -0.51 132.00 135.76 1yop h PRO 17 Ca 0.05 0.00 0.16 0.00 -0.87 0.00 0.00 66.00 65.35 1yop h PRO 17 Cb 0.89 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 31.96 1yop h PRO 17 CO 0.76 0.00 0.57 1.05 -0.23 0.00 0.00 178.00 180.15 1yop h GLU 18 N 0.00 0.54 0.00 0.86 4.11 -1.92 -3.08 114.58 115.09 1yop h GLU 18 Ca -0.00 -0.03 -0.05 0.00 0.07 0.00 0.00 59.36 59.35 1yop h GLU 18 Cb 0.37 -0.12 -0.10 0.00 0.50 0.00 0.00 28.75 29.40 1yop h GLU 18 CO 0.00 0.36 -0.61 -1.71 0.07 0.00 0.00 179.01 177.12 1yop n ASN 19 N -4.54 0.41 -3.53 3.06 2.85 -1.16 -5.04 115.26 107.31 1yop n ASN 19 Ca 0.18 -2.10 -0.21 0.00 -0.11 0.00 0.00 54.58 52.34 1yop n ASN 19 Cb 0.55 -0.24 0.02 0.00 1.24 0.00 0.00 39.78 41.35 1yop n ASN 19 CO 0.00 0.00 0.00 1.67 -2.11 0.00 0.00 177.26 176.82 1yop n GLN 20 N 0.03 -1.35 -4.04 1.20 7.27 -0.53 -4.96 117.38 115.00 1yop n GLN 20 Ca 0.03 0.83 -0.11 0.00 0.07 0.00 0.00 57.00 57.81 1yop n GLN 20 Cb 0.81 -4.11 -0.05 0.00 2.41 0.00 0.00 30.24 29.29 1yop n GLN 20 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1yop s MET 21 N -4.87 1.63 -0.04 3.69 0.23 -0.31 -3.39 119.30 116.24 1yop s MET 21 Ca 0.22 -1.44 0.03 0.00 -1.03 0.00 0.00 55.69 53.47 1yop s MET 21 Cb -0.08 0.44 0.00 0.00 -1.53 0.00 0.00 34.83 33.67 1yop s MET 21 CO 0.84 -0.67 -0.11 -0.06 -2.03 0.00 0.00 175.02 172.99 1yop s PHE 22 N -3.71 1.20 -0.03 3.16 0.40 -0.36 0.29 117.98 118.93 1yop s PHE 22 Ca 0.26 -0.34 0.03 0.00 -0.60 0.00 0.00 56.93 56.28 1yop s PHE 22 Cb 0.00 -0.86 -0.00 0.00 0.51 0.00 0.00 43.02 42.68 1yop s PHE 22 CO 0.13 -0.15 -0.11 0.95 0.70 0.00 0.00 175.22 176.73 1yop s THR 23 N 0.28 0.96 -0.01 0.64 -4.23 -0.57 -0.15 115.64 112.57 1yop s THR 23 Ca -0.06 -0.47 0.00 0.00 -1.18 0.00 0.00 61.69 59.99 1yop s THR 23 Cb -0.11 -0.84 0.01 0.00 1.34 0.00 0.00 72.50 72.90 1yop s THR 23 CO 0.01 0.29 -0.00 -0.47 -0.54 0.00 0.00 174.62 173.91 1yop s TYR 24 N 0.09 0.08 -0.54 3.99 6.14 -0.75 -2.47 117.35 123.88 1yop s TYR 24 Ca -0.02 0.01 -0.27 0.00 0.64 0.00 0.00 57.07 57.43 1yop s TYR 24 Cb -0.09 -0.11 -0.01 0.00 0.42 0.00 0.00 41.96 42.18 1yop s TYR 24 CO 0.01 -0.03 1.67 -1.25 0.64 0.00 0.00 175.55 176.59 1yop s PRO 25 N 0.25 3.02 0.34 4.97 0.04 -1.26 0.27 135.00 142.63 1yop s PRO 25 Ca -0.02 0.69 -0.29 0.00 0.04 0.00 0.00 61.00 61.42 1yop s PRO 25 Cb -0.04 -4.25 -0.11 0.00 0.04 0.00 0.00 34.50 30.15 1yop s PRO 25 CO -0.01 -2.27 1.39 0.00 0.04 0.00 0.00 177.00 176.16 1yop h PRO 27 N 3.48 0.00 -0.18 0.00 0.11 -1.94 0.07 132.00 133.55 1yop h PRO 27 Ca -0.49 0.00 0.05 0.00 0.11 0.00 0.00 66.00 65.67 1yop h PRO 27 Cb 1.23 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 1yop h PRO 27 CO 0.67 0.00 0.14 0.00 -0.21 0.00 0.00 178.00 178.60 1yop n GLY 29 N -1.52 1.01 1.24 0.00 0.00 0.01 -5.04 105.19 100.88 1yop n GLY 29 Ca 0.01 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.93 1yop n GLY 29 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1yop n ASP 30 N 0.00 2.17 -4.25 1.61 9.92 -1.19 -4.97 116.55 119.83 1yop n ASP 30 Ca 0.00 -1.77 -0.32 0.00 -0.53 0.00 0.00 54.79 52.17 1yop n ASP 30 Cb 0.00 0.18 -0.17 0.00 -0.64 0.00 0.00 41.12 40.49 1yop n ASP 30 CO 0.00 0.00 0.00 -0.60 0.13 0.00 0.00 177.20 176.73 1yop s ARG 31 N -2.62 3.10 0.35 -1.24 3.52 -1.26 0.08 118.95 120.88 1yop s ARG 31 Ca 0.02 -0.85 -0.03 0.00 -0.13 0.00 0.00 55.73 54.74 1yop s ARG 31 Cb 0.00 -2.36 -0.04 0.00 -1.56 0.00 0.00 34.95 30.99 1yop s ARG 31 CO 0.01 0.19 0.60 0.12 -0.81 0.00 0.00 175.30 175.41 1yop s PHE 32 N 0.33 3.50 -0.02 5.12 5.36 0.14 -4.88 117.98 127.53 1yop s PHE 32 Ca -0.17 0.59 -0.00 0.00 -0.96 0.00 0.00 56.93 56.38 1yop s PHE 32 Cb -0.18 -2.08 0.03 0.00 -0.34 0.00 0.00 43.02 40.45 1yop s PHE 32 CO 0.08 0.06 0.04 1.14 -1.46 0.00 0.00 175.22 175.08 1yop s GLN 33 N -4.04 -0.04 -0.10 10.12 -2.07 -1.26 -1.81 119.66 120.46 1yop s GLN 33 Ca 0.43 0.21 -0.03 0.00 -1.82 0.00 0.00 55.36 54.15 1yop s GLN 33 Cb -0.10 -0.27 0.04 0.00 -1.09 0.00 0.00 33.01 31.60 1yop s GLN 33 CO 0.35 -0.18 0.06 -1.50 -1.32 0.00 0.00 175.29 172.70 1yop s ILE 34 N 1.16 0.00 0.31 3.63 2.07 0.78 -4.99 121.20 124.16 1yop s ILE 34 Ca -0.08 0.11 -0.28 0.00 -1.41 0.00 0.00 60.65 58.99 1yop s ILE 34 Cb -0.13 -0.41 -0.09 0.00 0.13 0.00 0.00 42.46 41.95 1yop s ILE 34 CO -0.03 -0.01 1.09 -0.31 -1.91 0.00 0.00 174.94 173.77 1yop s TYR 35 N 2.11 3.49 0.30 3.50 2.02 -1.26 -1.23 117.35 126.28 1yop s TYR 35 Ca 0.03 1.69 -0.02 0.00 -0.37 0.00 0.00 57.07 58.41 1yop s TYR 35 Cb -0.14 -3.24 0.46 0.00 -0.40 0.00 0.00 41.96 38.63 1yop s TYR 35 CO -0.06 -0.58 1.96 -0.07 -1.57 0.00 0.00 175.55 175.23 1yop h LEU 36 N 3.45 0.95 -0.93 -1.29 -0.00 -1.91 -2.06 115.31 113.51 1yop h LEU 36 Ca -0.47 -0.02 -0.01 0.00 -0.00 0.00 0.00 57.88 57.38 1yop h LEU 36 Cb 1.21 -0.23 -0.05 0.00 -0.00 0.00 0.00 40.66 41.60 1yop h LEU 36 CO 0.66 0.67 0.56 -2.24 -0.00 0.00 0.00 178.44 178.09 1yop h ASP 37 N 1.11 1.12 -0.77 -0.43 3.04 -1.92 -2.36 116.42 116.21 1yop h ASP 37 Ca 0.32 -0.07 -0.04 0.00 -3.24 0.00 0.00 57.03 54.00 1yop h ASP 37 Cb -0.07 -0.28 -0.03 0.00 -1.04 0.00 0.00 39.33 37.90 1yop h ASP 37 CO -0.08 0.86 0.31 -0.78 -2.04 0.00 0.00 179.24 177.51 1yop h ASP 38 N 1.29 1.06 0.10 4.15 3.58 -1.77 -2.21 116.42 122.62 1yop h ASP 38 Ca 0.33 -0.16 -0.02 0.00 0.42 0.00 0.00 57.03 57.60 1yop h ASP 38 Cb -0.06 -0.28 -0.00 0.00 1.72 0.00 0.00 39.33 40.72 1yop h ASP 38 CO -0.06 0.94 -0.09 0.24 -2.88 0.00 0.00 179.24 177.39 1yop h MET 39 N 1.13 0.00 -0.72 0.28 2.86 -1.10 -2.22 114.93 115.15 1yop h MET 39 Ca 0.26 0.00 0.07 0.00 -2.06 0.00 0.00 59.70 57.97 1yop h MET 39 Cb 0.21 0.00 -0.05 0.00 0.06 0.00 0.00 31.60 31.83 1yop h MET 39 CO -0.02 0.09 0.47 0.35 1.06 0.00 0.00 176.91 178.87 1yop h PHE 40 N 0.00 0.72 -0.25 -0.22 3.57 -1.10 -0.95 116.94 118.72 1yop h PHE 40 Ca -0.00 0.02 -0.09 0.00 3.53 0.00 0.00 57.97 61.43 1yop h PHE 40 Cb 0.17 -0.24 -0.01 0.00 2.79 0.00 0.00 35.95 38.66 1yop h PHE 40 CO 0.00 0.37 -0.23 0.93 -2.23 0.00 0.00 178.31 177.15 1yop h GLU 41 N 0.70 0.47 0.00 1.11 5.08 -1.48 -3.47 114.58 116.99 1yop h GLU 41 Ca 0.32 -0.17 0.00 0.00 -1.00 0.00 0.00 59.36 58.51 1yop h GLU 41 Cb 0.33 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.55 1yop h GLU 41 CO -0.11 0.67 0.00 0.41 -1.00 0.00 0.00 179.01 178.98 1yop n GLY 42 N -0.43 0.31 3.32 -3.84 0.00 -0.36 -5.12 105.19 99.08 1yop n GLY 42 Ca -0.00 -0.63 -0.42 0.00 0.00 0.00 0.00 46.02 44.98 1yop n GLY 42 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1yop s GLU 43 N 0.00 2.76 -0.10 1.61 2.56 -1.23 -4.87 118.70 119.43 1yop s GLU 43 Ca 0.00 -1.36 0.05 0.00 0.00 0.00 0.00 54.97 53.66 1yop s GLU 43 Cb 0.00 -3.88 -0.09 0.00 2.00 0.00 0.00 34.13 32.16 1yop s GLU 43 CO 0.00 -0.93 -0.02 0.36 -0.56 0.00 0.00 175.26 174.11 1yop n LYS 44 N 5.02 1.71 -3.82 4.30 0.00 -1.26 -4.86 118.16 119.25 1yop n LYS 44 Ca -0.11 0.02 -0.33 0.00 -0.00 0.00 0.00 58.31 57.89 1yop n LYS 44 Cb 0.44 -1.22 -0.11 0.00 -0.00 0.00 0.00 35.03 34.13 1yop n LYS 44 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.40 177.48 1yop s VAL 45 N -2.21 3.28 0.61 0.58 1.01 -1.26 -0.13 120.40 122.28 1yop s VAL 45 Ca -0.08 -3.39 -0.09 0.00 0.00 0.00 0.00 61.98 58.42 1yop s VAL 45 Cb 0.03 -3.16 -0.01 0.00 0.00 0.00 0.00 36.38 33.24 1yop s VAL 45 CO 0.32 -0.89 0.97 0.00 0.00 0.00 0.00 175.10 175.50 1yop s ALA 46 N -0.50 3.14 -0.15 5.51 0.00 -1.14 -4.84 121.76 123.79 1yop s ALA 46 Ca 0.19 -0.40 0.02 0.00 0.00 0.00 0.00 51.96 51.77 1yop s ALA 46 Cb -0.19 -2.85 0.02 0.00 0.00 0.00 0.00 23.12 20.10 1yop s ALA 46 CO -0.05 -0.80 -0.19 0.54 0.00 0.00 0.00 175.76 175.26 1yop s VAL 47 N -3.11 1.91 0.28 0.00 0.11 -1.26 -2.93 120.40 115.39 1yop s VAL 47 Ca 0.54 -0.87 -0.30 0.00 -2.93 0.00 0.00 61.98 58.42 1yop s VAL 47 Cb -0.11 -1.72 -0.11 0.00 -1.53 0.00 0.00 36.38 32.92 1yop s VAL 47 CO 0.49 0.52 1.51 0.00 -3.33 0.00 0.00 175.10 174.29 1yop n PRO 49 N 2.14 1.64 0.07 0.00 -0.04 -1.26 -1.62 135.00 135.93 1yop n PRO 49 Ca 0.07 -0.52 0.00 0.00 -0.04 0.00 0.00 63.50 63.01 1yop n PRO 49 Cb 0.39 -1.62 0.00 0.00 -0.04 0.00 0.00 33.50 32.23 1yop n PRO 49 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1yop n SER 50 N 0.10 0.37 -0.00 3.54 2.88 -1.26 -4.88 113.62 114.37 1yop n SER 50 Ca 0.05 0.22 0.09 0.00 -1.33 0.00 0.00 58.87 57.90 1yop n SER 50 Cb 0.40 0.01 -0.11 0.00 -0.75 0.00 0.00 64.21 63.76 1yop n SER 50 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1yop n SER 52 N -1.53 -5.98 -4.76 0.00 3.41 -0.64 -4.98 113.62 99.15 1yop n SER 52 Ca 0.03 -0.30 -0.39 0.00 -0.26 0.00 0.00 58.87 57.95 1yop n SER 52 Cb 0.32 -4.78 -0.06 0.00 -0.26 0.00 0.00 64.21 59.44 1yop n SER 52 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 1yop s LEU 53 N -6.46 4.41 0.07 1.04 0.20 -1.26 -4.71 118.68 111.97 1yop s LEU 53 Ca 0.32 1.13 -0.25 0.00 0.69 0.00 0.00 54.13 56.02 1yop s LEU 53 Cb -0.14 -2.90 -0.06 0.00 -0.43 0.00 0.00 46.19 42.66 1yop s LEU 53 CO 0.39 0.09 0.77 -0.04 -0.29 0.00 0.00 176.35 177.27 1yop s MET 54 N -0.12 4.51 -0.01 1.98 -1.94 -1.26 -2.97 119.30 119.49 1yop s MET 54 Ca 0.31 1.09 0.00 0.00 -1.71 0.00 0.00 55.69 55.38 1yop s MET 54 Cb -0.18 -3.34 0.01 0.00 2.01 0.00 0.00 34.83 33.33 1yop s MET 54 CO 0.17 0.35 -0.01 0.96 -0.01 0.00 0.00 175.02 176.48 1yop s ILE 55 N -0.30 0.11 -0.99 2.53 -4.36 -1.15 -1.53 121.20 115.51 1yop s ILE 55 Ca 0.38 -0.01 -0.19 0.00 -0.26 0.00 0.00 60.65 60.56 1yop s ILE 55 Cb -0.21 -0.13 0.12 0.00 1.25 0.00 0.00 42.46 43.49 1yop s ILE 55 CO 0.24 0.05 1.25 -1.81 0.24 0.00 0.00 174.94 174.91 1yop s ASP 56 N 0.23 6.65 -0.40 4.36 1.01 -0.12 -2.87 116.67 125.52 1yop s ASP 56 Ca -0.02 -2.02 -0.23 0.00 0.71 0.00 0.00 52.55 50.99 1yop s ASP 56 Cb -0.04 -2.44 0.02 0.00 1.01 0.00 0.00 42.92 41.47 1yop s ASP 56 CO -0.01 -1.13 0.76 0.54 0.21 0.00 0.00 175.17 175.54 1yop s VAL 57 N 3.12 4.72 -0.11 -1.27 0.11 0.81 -1.81 120.40 125.98 1yop s VAL 57 Ca 0.37 0.63 -0.23 0.00 -2.93 0.00 0.00 61.98 59.82 1yop s VAL 57 Cb -0.03 -4.24 -0.03 0.00 -1.53 0.00 0.00 36.38 30.55 1yop s VAL 57 CO -0.08 -0.54 0.71 0.54 -3.33 0.00 0.00 175.10 172.39 1yop s VAL 58 N 3.13 5.02 0.46 2.04 0.11 0.11 -4.54 120.40 126.71 1yop s VAL 58 Ca 0.30 1.43 0.03 0.00 -2.93 0.00 0.00 61.98 60.80 1yop s VAL 58 Cb -0.13 -4.04 -0.02 0.00 -1.53 0.00 0.00 36.38 30.66 1yop s VAL 58 CO 0.19 0.19 0.06 0.72 -3.33 0.00 0.00 175.10 172.93 1yop s PHE 59 N 1.23 1.85 0.02 1.54 -0.71 -1.26 -1.15 117.98 119.50 1yop s PHE 59 Ca 0.36 -1.10 0.03 0.00 -1.04 0.00 0.00 56.93 55.18 1yop s PHE 59 Cb -0.17 -1.40 -0.02 0.00 -1.21 0.00 0.00 43.02 40.22 1yop s PHE 59 CO 0.16 -0.01 -0.10 0.34 -1.34 0.00 0.00 175.22 174.26 1yop s ASP 60 N -3.74 1.16 0.07 1.98 2.15 -1.26 -5.01 116.67 112.03 1yop s ASP 60 Ca 0.16 -0.35 -0.15 0.00 0.43 0.00 0.00 52.55 52.64 1yop s ASP 60 Cb 0.02 -0.07 -0.20 0.00 -0.30 0.00 0.00 42.92 42.37 1yop s ASP 60 CO 0.09 0.00 1.22 0.50 -0.17 0.00 0.00 175.17 176.82 1yop h LYS 61 N 5.25 0.69 -0.21 4.34 3.64 -2.00 -3.06 116.57 125.23 1yop h LYS 61 Ca -0.34 -0.66 0.02 0.00 -1.27 0.00 0.00 60.65 58.40 1yop h LYS 61 Cb 1.19 0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 33.15 1yop h LYS 61 CO 0.46 1.26 0.06 1.49 -2.27 0.00 0.00 179.45 180.44 1yop h GLU 62 N 0.37 0.14 -0.24 1.90 4.81 -1.99 -1.74 114.58 117.83 1yop h GLU 62 Ca -0.09 -0.01 0.05 0.00 -0.13 0.00 0.00 59.36 59.18 1yop h GLU 62 Cb 1.52 -0.03 -0.05 0.00 0.63 0.00 0.00 28.75 30.82 1yop h GLU 62 CO 0.17 0.10 -0.07 -0.44 -0.73 0.00 0.00 179.01 178.04 1yop h ASP 63 N 0.15 -0.25 -0.98 1.04 3.32 -2.00 -1.83 116.42 115.88 1yop h ASP 63 Ca 0.09 0.08 0.07 0.00 0.02 0.00 0.00 57.03 57.29 1yop h ASP 63 Cb 0.07 0.16 -0.07 0.00 0.22 0.00 0.00 39.33 39.71 1yop h ASP 63 CO -0.11 -0.09 0.63 0.25 -1.72 0.00 0.00 179.24 178.20 1yop h LEU 64 N -0.02 0.99 -1.09 1.55 6.46 -1.38 0.15 115.31 121.97 1yop h LEU 64 Ca 0.12 0.02 -0.01 0.00 -0.12 0.00 0.00 57.88 57.88 1yop h LEU 64 Cb 0.19 -0.19 -0.04 0.00 -0.73 0.00 0.00 40.66 39.89 1yop h LEU 64 CO -0.25 0.62 0.43 0.00 -0.62 0.00 0.00 178.44 178.62 1yop h ALA 65 N 1.46 1.31 0.00 1.25 0.00 -0.53 -1.52 119.26 121.23 1yop h ALA 65 Ca 0.43 -0.11 -0.07 0.00 0.00 0.00 0.00 54.91 55.16 1yop h ALA 65 Cb 0.21 -0.31 0.01 0.00 0.00 0.00 0.00 17.79 17.70 1yop h ALA 65 CO -0.19 0.57 -0.27 0.93 0.00 0.00 0.00 179.25 180.29 1yop h GLU 66 N 1.07 0.18 -0.59 0.00 3.07 -0.61 -3.27 114.58 114.43 1yop h GLU 66 Ca 0.27 -0.20 0.12 0.00 -0.50 0.00 0.00 59.36 59.05 1yop h GLU 66 Cb 0.01 0.06 -0.03 0.00 -0.84 0.00 0.00 28.75 27.94 1yop h GLU 66 CO -0.05 0.94 0.40 1.88 -1.40 0.00 0.00 179.01 180.78 1yop h TYR 67 N -0.50 0.32 -0.88 4.33 -1.99 -0.63 0.27 116.97 117.90 1yop h TYR 67 Ca -0.03 0.01 0.03 0.00 2.00 0.00 0.00 58.73 60.73 1yop h TYR 67 Cb 1.03 -0.10 -0.05 0.00 2.00 0.00 0.00 36.73 39.61 1yop h TYR 67 CO 0.18 0.15 0.58 -0.92 -0.00 0.00 0.00 178.16 178.14 1yop h TYR 68 N 0.30 1.08 0.18 4.88 5.03 -1.33 0.30 116.97 127.41 1yop h TYR 68 Ca 0.28 0.03 -0.34 0.00 2.58 0.00 0.00 58.73 61.27 1yop h TYR 68 Cb 0.69 -0.36 0.01 0.00 1.55 0.00 0.00 36.73 38.61 1yop h TYR 68 CO -0.00 0.64 -1.69 1.49 -1.32 0.00 0.00 178.16 177.28 1yop h GLU 69 N 1.14 0.37 -0.84 1.82 4.81 -1.29 -1.74 114.58 118.85 1yop h GLU 69 Ca 0.34 -0.64 -0.03 0.00 -0.13 0.00 0.00 59.36 58.91 1yop h GLU 69 Cb -0.04 0.24 -0.04 0.00 0.63 0.00 0.00 28.75 29.54 1yop h GLU 69 CO -0.10 1.28 0.41 1.49 -0.73 0.00 0.00 179.01 181.35 1yop h GLU 70 N 0.10 1.20 0.18 1.92 4.81 -0.33 -3.11 114.58 119.36 1yop h GLU 70 Ca -0.32 -0.17 -0.34 0.00 -0.13 0.00 0.00 59.36 58.40 1yop h GLU 70 Cb 2.09 -0.22 0.01 0.00 0.63 0.00 0.00 28.75 31.26 1yop h GLU 70 CO 0.18 0.92 -1.71 0.00 -0.73 0.00 0.00 179.01 177.67 1yop h ALA 71 N 1.25 0.16 -4.93 2.92 0.00 -0.54 -3.50 119.26 114.62 1yop h ALA 71 Ca 0.29 -1.13 -0.16 0.00 0.00 0.00 0.00 54.91 53.91 1yop h ALA 71 Cb 0.11 0.42 0.13 0.00 0.00 0.00 0.00 17.79 18.44 1yop h ALA 71 CO -0.04 1.03 -0.54 0.41 0.00 0.00 0.00 179.25 180.11 1yop n GLY 72 N 1.82 -0.80 0.36 0.00 0.00 -0.65 -4.91 105.19 101.01 1yop n GLY 72 Ca -0.23 0.39 0.12 0.00 0.00 0.00 0.00 46.02 46.30 1yop n GLY 72 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1yop h ILE 73 N -0.61 0.90 -5.20 -0.61 6.09 -1.90 -3.48 117.51 112.71 1yop h ILE 73 Ca -0.39 -0.16 -0.00 0.00 -1.37 0.00 0.00 64.86 62.95 1yop h ILE 73 Cb 1.20 0.40 0.00 0.00 0.47 0.00 0.00 36.82 38.89 1yop h ILE 73 CO 0.33 0.08 -0.80 1.41 -3.07 0.00 0.00 178.15 176.10 1yop n HIS 74 N -4.47 -3.82 -2.01 2.19 8.25 -1.26 -4.86 115.22 109.23 1yop n HIS 74 Ca 0.10 1.63 -0.43 0.00 -0.26 0.00 0.00 57.72 58.77 1yop n HIS 74 Cb 0.37 -4.06 -0.03 0.00 1.12 0.00 0.00 29.99 27.39 1yop n HIS 74 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 1yop s PRO 75 N -2.04 3.36 0.28 -0.41 0.04 -1.26 -4.98 135.00 129.99 1yop s PRO 75 Ca 0.10 1.42 -0.29 0.00 0.04 0.00 0.00 61.00 62.27 1yop s PRO 75 Cb -0.03 -4.19 -0.10 0.00 0.04 0.00 0.00 34.50 30.23 1yop s PRO 75 CO 0.78 -1.83 1.26 -1.25 0.04 0.00 0.00 177.00 176.01 1yop s PRO 76 N 5.60 4.43 -1.06 0.56 0.04 -1.26 -3.70 135.00 139.61 1yop s PRO 76 Ca 0.79 2.07 -0.08 0.00 0.04 0.00 0.00 61.00 63.83 1yop s PRO 76 Cb -0.22 -3.14 -0.06 0.00 0.04 0.00 0.00 34.50 31.12 1yop s PRO 76 CO 0.34 -0.12 0.91 -1.91 0.04 0.00 0.00 177.00 176.25 1yop n GLU 77 N 1.50 -2.17 -0.73 4.56 4.07 -1.26 -4.82 120.64 121.78 1yop n GLU 77 Ca 0.02 0.82 -0.20 0.00 -0.06 0.00 0.00 57.16 57.74 1yop n GLU 77 Cb 0.43 -5.64 -0.03 0.00 -0.06 0.00 0.00 31.44 26.14 1yop n GLU 77 CO 0.00 0.00 0.00 -0.35 -0.06 0.00 0.00 177.13 176.72 1yop n PRO 78 N -3.35 1.97 -1.30 5.31 -0.04 -1.24 -3.70 135.00 132.64 1yop n PRO 78 Ca -0.07 -1.31 -0.02 0.00 -0.04 0.00 0.00 63.50 62.05 1yop n PRO 78 Cb 0.62 -2.33 -0.02 0.00 -0.04 0.00 0.00 33.50 31.72 1yop n PRO 78 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 1yop n ILE 79 N 3.88 0.03 -2.89 0.52 -5.35 -1.26 -5.06 119.36 109.22 1yop n ILE 79 Ca 0.42 -0.52 -0.44 0.00 -0.27 0.00 0.00 62.75 61.95 1yop n ILE 79 Cb 0.22 0.74 -0.03 0.00 -1.74 0.00 0.00 39.64 38.83 1yop n ILE 79 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1yop s ALA 80 N -0.08 3.27 0.41 -1.28 0.00 -1.24 -4.90 121.76 117.94 1yop s ALA 80 Ca 0.15 -2.49 0.00 0.00 0.00 0.00 0.00 51.96 49.62 1yop s ALA 80 Cb 0.19 -4.01 0.00 0.00 0.00 0.00 0.00 23.12 19.29 1yop s ALA 80 CO -0.08 -2.95 0.00 0.00 0.00 0.00 0.00 175.76 172.74 1yop n ALA 81 N 6.96 -2.40 -3.75 0.00 0.00 -1.26 -5.09 120.51 114.97 1yop n ALA 81 Ca 0.16 0.60 -0.03 0.00 0.00 0.00 0.00 53.44 54.17 1yop n ALA 81 Cb 0.48 -1.06 -0.01 0.00 0.00 0.00 0.00 19.45 18.86 1yop n ALA 81 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1yop s ALA 82 N -3.98 -1.67 0.00 0.00 0.00 -1.26 -5.19 121.76 109.66 1yop s ALA 82 Ca 0.00 0.14 0.00 0.00 0.00 0.00 0.00 51.96 52.10 1yop s ALA 82 Cb 0.00 0.63 0.00 0.00 0.00 0.00 0.00 23.12 23.75 1yop s ALA 82 CO 0.00 -1.04 0.00 0.00 0.00 0.00 0.00 175.76 174.72