#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 3.79 -1.19 1.12 0.11 -1.26 -4.98 120.40 117.99 1yop s VAL 2 Ca 0.00 1.29 -0.09 0.00 -2.93 0.00 0.00 61.98 60.25 1yop s VAL 2 Cb 0.00 -3.62 0.22 0.00 -1.53 0.00 0.00 36.38 31.44 1yop s VAL 2 CO 0.00 -0.07 1.55 -1.20 -3.33 0.00 0.00 175.10 172.05 1yop n SER 3 N -0.32 5.49 -3.79 3.54 7.64 -1.26 -4.94 113.62 119.97 1yop n SER 3 Ca 0.06 -3.13 -0.10 0.00 1.01 0.00 0.00 58.87 56.72 1yop n SER 3 Cb 0.51 -1.44 -0.05 0.00 -1.01 0.00 0.00 64.21 62.21 1yop n SER 3 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1yop s THR 4 N -0.25 0.06 0.00 0.44 -4.23 -1.26 -4.52 115.64 105.88 1yop s THR 4 Ca 0.37 -0.96 0.00 0.00 -1.18 0.00 0.00 61.69 59.93 1yop s THR 4 Cb 0.02 -1.55 0.00 0.00 1.34 0.00 0.00 72.50 72.31 1yop s THR 4 CO 0.01 -0.26 0.00 -1.22 -0.54 0.00 0.00 174.62 172.61 1yop n TYR 5 N -0.25 0.00 -4.05 3.99 4.02 -1.18 -5.03 117.16 114.66 1yop n TYR 5 Ca -0.11 0.00 -0.08 0.00 -0.01 0.00 0.00 57.90 57.70 1yop n TYR 5 Cb 0.63 0.00 -0.09 0.00 -0.02 0.00 0.00 39.34 39.86 1yop n TYR 5 CO 0.00 0.00 0.00 0.16 -1.01 0.00 0.00 176.86 176.01 1yop s ASP 6 N -2.83 0.31 -0.37 7.72 -4.77 -1.26 -5.09 116.67 110.37 1yop s ASP 6 Ca 0.00 -0.98 -0.09 0.00 -3.30 0.00 0.00 52.55 48.18 1yop s ASP 6 Cb 0.00 0.28 0.04 0.00 -1.09 0.00 0.00 42.92 42.16 1yop s ASP 6 CO 0.00 -0.70 0.19 -0.70 0.70 0.00 0.00 175.17 174.66 1yop s GLU 7 N -3.95 2.70 0.18 2.11 2.12 -1.26 -3.37 118.70 117.23 1yop s GLU 7 Ca 0.13 -1.20 -0.06 0.00 0.36 0.00 0.00 54.97 54.19 1yop s GLU 7 Cb 0.07 -3.66 -0.06 0.00 0.26 0.00 0.00 34.13 30.74 1yop s GLU 7 CO -0.06 -0.75 0.44 0.42 -0.54 0.00 0.00 175.26 174.78 1yop s ILE 8 N 1.48 5.08 0.08 -3.70 1.09 -0.87 -4.95 121.20 119.41 1yop s ILE 8 Ca 0.01 0.19 -0.07 0.00 -1.10 0.00 0.00 60.65 59.68 1yop s ILE 8 Cb -0.20 -3.62 -0.05 0.00 -1.06 0.00 0.00 42.46 37.52 1yop s ILE 8 CO 0.04 -0.01 0.36 -0.70 -0.10 0.00 0.00 174.94 174.53 1yop s GLU 9 N -2.74 3.66 0.43 2.79 2.12 -1.26 -2.15 118.70 121.54 1yop s GLU 9 Ca 0.43 0.01 0.09 0.00 0.36 0.00 0.00 54.97 55.86 1yop s GLU 9 Cb -0.12 -2.96 0.93 0.00 0.26 0.00 0.00 34.13 32.24 1yop s GLU 9 CO 0.23 0.55 2.06 0.97 -0.54 0.00 0.00 175.26 178.54 1yop h ILE 10 N 2.59 1.09 -0.52 -3.70 2.10 -1.73 -1.86 117.51 115.49 1yop h ILE 10 Ca -0.48 -0.21 0.00 0.00 1.08 0.00 0.00 64.86 65.26 1yop h ILE 10 Cb 1.18 0.65 -0.03 0.00 -1.09 0.00 0.00 36.82 37.54 1yop h ILE 10 CO 0.69 0.10 0.34 -0.33 -1.08 0.00 0.00 178.15 177.86 1yop h GLU 11 N 0.43 0.69 -1.13 2.19 5.08 -1.94 -2.03 114.58 117.87 1yop h GLU 11 Ca 0.11 -0.05 -0.52 0.00 -1.00 0.00 0.00 59.36 57.91 1yop h GLU 11 Cb -0.02 -0.15 -0.24 0.00 0.50 0.00 0.00 28.75 28.84 1yop h GLU 11 CO -0.02 0.47 0.67 -3.47 -1.00 0.00 0.00 179.01 175.66 1yop n ASP 12 N -4.45 6.27 -4.25 1.42 2.03 -0.70 -4.92 116.55 111.96 1yop n ASP 12 Ca 0.05 -3.48 -0.26 0.00 0.52 0.00 0.00 54.79 51.61 1yop n ASP 12 Cb 0.06 -0.94 -0.14 0.00 -0.72 0.00 0.00 41.12 39.37 1yop n ASP 12 CO 0.00 0.00 0.00 -0.32 -1.92 0.00 0.00 177.20 174.96 1yop s MET 13 N -3.03 1.46 0.29 -0.67 1.75 -0.76 -4.86 119.30 113.48 1yop s MET 13 Ca 0.52 -0.92 -0.29 0.00 -1.25 0.00 0.00 55.69 53.74 1yop s MET 13 Cb 0.41 -1.56 -0.10 0.00 2.84 0.00 0.00 34.83 36.42 1yop s MET 13 CO 0.02 0.40 1.42 0.99 -0.65 0.00 0.00 175.02 177.20 1yop s THR 14 N -0.75 2.57 -0.16 10.11 2.01 0.10 -4.89 115.64 124.62 1yop s THR 14 Ca 0.08 0.51 -0.06 0.00 0.31 0.00 0.00 61.69 62.53 1yop s THR 14 Cb -0.09 -3.32 -0.04 0.00 0.01 0.00 0.00 72.50 69.06 1yop s THR 14 CO 0.01 0.10 0.02 0.72 -0.69 0.00 0.00 174.62 174.78 1yop s PHE 15 N -0.42 3.17 -0.51 4.92 -0.12 -1.26 -1.08 117.98 122.68 1yop s PHE 15 Ca 0.56 -0.04 0.03 0.00 -0.05 0.00 0.00 56.93 57.43 1yop s PHE 15 Cb -0.42 -2.00 0.13 0.00 -0.63 0.00 0.00 43.02 40.09 1yop s PHE 15 CO 0.48 0.13 0.26 -1.21 -0.05 0.00 0.00 175.22 174.82 1yop s GLU 16 N 0.22 2.00 0.26 1.99 2.02 0.15 -4.94 118.70 120.40 1yop s GLU 16 Ca 0.01 -2.48 0.24 0.00 0.02 0.00 0.00 54.97 52.76 1yop s GLU 16 Cb -0.13 -3.37 0.98 0.00 0.10 0.00 0.00 34.13 31.70 1yop s GLU 16 CO 0.01 -1.09 1.72 -0.35 0.02 0.00 0.00 175.26 175.57 1yop n PRO 17 N 3.37 0.21 -0.26 0.39 -0.04 -1.26 -1.27 135.00 136.12 1yop n PRO 17 Ca 0.05 0.41 0.20 0.00 -0.04 0.00 0.00 63.50 64.12 1yop n PRO 17 Cb 0.35 -1.88 0.51 0.00 -0.04 0.00 0.00 33.50 32.44 1yop n PRO 17 CO 0.00 0.00 0.00 1.05 -0.04 0.00 0.00 175.50 176.51 1yop h GLU 18 N 0.00 0.40 0.00 0.54 4.11 -1.93 -2.50 114.58 115.20 1yop h GLU 18 Ca 0.00 -0.02 -0.11 0.00 0.07 0.00 0.00 59.36 59.30 1yop h GLU 18 Cb 0.40 -0.09 -0.18 0.00 0.50 0.00 0.00 28.75 29.38 1yop h GLU 18 CO 0.00 0.26 -0.57 0.09 0.07 0.00 0.00 179.01 178.86 1yop n ASN 19 N -4.53 0.09 -3.25 3.06 3.02 -1.22 -4.36 115.26 108.06 1yop n ASN 19 Ca 0.21 -1.85 -0.06 0.00 -0.03 0.00 0.00 54.58 52.84 1yop n ASN 19 Cb 0.74 -0.06 0.00 0.00 -0.61 0.00 0.00 39.78 39.85 1yop n ASN 19 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1yop n GLN 20 N 0.19 -1.38 -3.93 3.52 6.02 -0.99 -4.93 117.38 115.87 1yop n GLN 20 Ca -0.06 1.30 -0.09 0.00 -0.01 0.00 0.00 57.00 58.14 1yop n GLN 20 Cb 0.84 -4.89 -0.05 0.00 1.02 0.00 0.00 30.24 27.16 1yop n GLN 20 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1yop s MET 21 N -3.52 1.40 0.06 -1.09 0.23 -0.40 -3.10 119.30 112.88 1yop s MET 21 Ca 0.01 -1.14 0.06 0.00 -1.03 0.00 0.00 55.69 53.58 1yop s MET 21 Cb -0.00 0.46 -0.03 0.00 -1.53 0.00 0.00 34.83 33.73 1yop s MET 21 CO 0.79 -0.57 -0.16 -0.06 -2.03 0.00 0.00 175.02 172.99 1yop s PHE 22 N -3.97 1.40 0.21 3.16 0.40 -0.52 0.32 117.98 118.98 1yop s PHE 22 Ca 0.18 -0.40 -0.00 0.00 -0.60 0.00 0.00 56.93 56.11 1yop s PHE 22 Cb 0.00 -0.81 -0.04 0.00 0.51 0.00 0.00 43.02 42.68 1yop s PHE 22 CO 0.04 0.08 0.11 0.95 0.70 0.00 0.00 175.22 177.10 1yop s THR 23 N -1.01 0.13 -0.28 0.64 -4.23 -0.24 -1.61 115.64 109.05 1yop s THR 23 Ca 0.02 -1.99 -0.22 0.00 -1.18 0.00 0.00 61.69 58.32 1yop s THR 23 Cb -0.09 -2.48 0.10 0.00 1.34 0.00 0.00 72.50 71.36 1yop s THR 23 CO 0.02 -0.05 0.84 -0.47 -0.54 0.00 0.00 174.62 174.43 1yop s TYR 24 N -4.06 -0.72 -0.67 3.99 6.14 -1.18 -0.72 117.35 120.14 1yop s TYR 24 Ca 0.37 1.64 -0.26 0.00 0.64 0.00 0.00 57.07 59.46 1yop s TYR 24 Cb 0.07 0.37 -0.04 0.00 0.42 0.00 0.00 41.96 42.78 1yop s TYR 24 CO 0.11 -0.35 2.02 -1.25 0.64 0.00 0.00 175.55 176.73 1yop s PRO 25 N 0.67 2.43 0.39 4.97 0.04 -1.26 0.37 135.00 142.60 1yop s PRO 25 Ca -0.02 0.55 -0.28 0.00 0.04 0.00 0.00 61.00 61.30 1yop s PRO 25 Cb -0.05 -4.60 -0.11 0.00 0.04 0.00 0.00 34.50 29.78 1yop s PRO 25 CO -0.07 -3.11 1.46 0.00 0.04 0.00 0.00 177.00 175.33 1yop h PRO 27 N 2.81 0.00 -0.23 0.00 0.11 -1.92 0.09 132.00 132.86 1yop h PRO 27 Ca -0.50 0.00 -0.18 0.00 0.11 0.00 0.00 66.00 65.43 1yop h PRO 27 Cb 1.25 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.36 1yop h PRO 27 CO 0.63 0.00 -0.57 0.00 -0.21 0.00 0.00 178.00 177.85 1yop n GLY 29 N 0.35 3.15 3.55 0.00 0.00 0.02 -5.07 105.19 107.19 1yop n GLY 29 Ca -0.04 -0.43 -0.30 0.00 0.00 0.00 0.00 46.02 45.25 1yop n GLY 29 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1yop s ASP 30 N 0.00 0.78 -0.12 1.61 2.15 -1.26 -4.61 116.67 115.22 1yop s ASP 30 Ca 0.00 0.75 0.03 0.00 0.43 0.00 0.00 52.55 53.75 1yop s ASP 30 Cb 0.00 -1.07 -0.00 0.00 -0.30 0.00 0.00 42.92 41.55 1yop s ASP 30 CO 0.00 -4.22 -0.21 -0.13 -0.17 0.00 0.00 175.17 170.44 1yop s ARG 31 N -5.28 3.13 0.89 4.34 0.52 -1.26 0.08 118.95 121.37 1yop s ARG 31 Ca 0.70 -0.82 -0.10 0.00 -0.52 0.00 0.00 55.73 54.98 1yop s ARG 31 Cb -0.12 -2.42 0.13 0.00 0.52 0.00 0.00 34.95 33.06 1yop s ARG 31 CO 0.57 0.14 1.13 -0.06 0.02 0.00 0.00 175.30 177.10 1yop s PHE 32 N 0.46 1.83 -0.22 -0.53 0.40 0.16 -4.77 117.98 115.31 1yop s PHE 32 Ca -0.14 1.74 -0.12 0.00 -0.60 0.00 0.00 56.93 57.80 1yop s PHE 32 Cb -0.17 -3.28 0.07 0.00 0.51 0.00 0.00 43.02 40.15 1yop s PHE 32 CO 0.06 -2.60 0.54 1.14 0.70 0.00 0.00 175.22 175.05 1yop s GLN 33 N -4.71 0.54 -0.26 0.44 -2.07 -1.26 -3.10 119.66 109.24 1yop s GLN 33 Ca 0.66 0.98 -0.11 0.00 -1.82 0.00 0.00 55.36 55.07 1yop s GLN 33 Cb -0.22 0.05 0.10 0.00 -1.09 0.00 0.00 33.01 31.86 1yop s GLN 33 CO 0.58 -0.15 0.58 -1.50 -1.32 0.00 0.00 175.29 173.48 1yop s ILE 34 N 1.49 -0.51 0.55 3.63 2.07 -0.63 -5.00 121.20 122.80 1yop s ILE 34 Ca -0.10 0.05 -0.14 0.00 -1.41 0.00 0.00 60.65 59.05 1yop s ILE 34 Cb -0.07 -0.88 -0.06 0.00 0.13 0.00 0.00 42.46 41.58 1yop s ILE 34 CO -0.16 0.02 1.00 -0.31 -1.91 0.00 0.00 174.94 173.58 1yop s TYR 35 N 2.28 3.52 0.24 3.50 1.51 -1.26 -1.43 117.35 125.71 1yop s TYR 35 Ca -0.07 1.39 -0.06 0.00 -1.01 0.00 0.00 57.07 57.33 1yop s TYR 35 Cb -0.10 -2.76 0.29 0.00 -0.11 0.00 0.00 41.96 39.29 1yop s TYR 35 CO -0.17 -0.48 1.89 -0.07 -1.11 0.00 0.00 175.55 175.61 1yop h LEU 36 N 0.47 1.00 -1.30 -1.29 3.38 -1.90 -1.79 115.31 113.88 1yop h LEU 36 Ca -0.46 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.48 1yop h LEU 36 Cb 1.19 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.69 1yop h LEU 36 CO 0.62 0.69 0.17 -0.78 0.09 0.00 0.00 178.44 179.23 1yop h ASP 37 N 1.17 0.59 0.79 -0.43 3.58 -1.93 0.44 116.42 120.62 1yop h ASP 37 Ca 0.37 -0.07 -0.04 0.00 0.42 0.00 0.00 57.03 57.71 1yop h ASP 37 Cb -0.00 -0.15 0.01 0.00 1.72 0.00 0.00 39.33 40.90 1yop h ASP 37 CO -0.12 0.54 -0.38 0.44 -2.88 0.00 0.00 179.24 176.85 1yop h ASP 38 N 0.65 -0.90 -0.72 2.28 3.32 -1.71 -1.59 116.42 117.74 1yop h ASP 38 Ca 0.16 0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.24 1yop h ASP 38 Cb 0.14 0.23 -0.04 0.00 0.22 0.00 0.00 39.33 39.89 1yop h ASP 38 CO -0.01 -0.53 0.47 0.00 -1.72 0.00 0.00 179.24 177.44 1yop h MET 39 N -1.28 0.96 -0.47 3.56 -0.00 -1.44 -2.48 114.93 113.78 1yop h MET 39 Ca -0.11 -0.06 0.01 0.00 -0.00 0.00 0.00 59.70 59.54 1yop h MET 39 Cb 0.81 -0.21 -0.02 0.00 -0.00 0.00 0.00 31.60 32.17 1yop h MET 39 CO 0.18 0.64 0.31 0.35 -0.00 0.00 0.00 176.91 178.39 1yop h PHE 40 N 0.99 0.59 -0.81 -0.10 3.57 -0.88 -2.55 116.94 117.74 1yop h PHE 40 Ca 0.26 0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.82 1yop h PHE 40 Cb -0.10 -0.20 -0.05 0.00 2.79 0.00 0.00 35.95 38.39 1yop h PHE 40 CO 0.00 0.36 0.51 1.49 -2.23 0.00 0.00 178.31 178.44 1yop h GLU 41 N 0.63 0.93 0.00 1.11 4.81 -0.83 -3.45 114.58 117.78 1yop h GLU 41 Ca 0.18 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.35 1yop h GLU 41 Cb -0.06 -0.21 0.00 0.00 0.63 0.00 0.00 28.75 29.11 1yop h GLU 41 CO -0.05 0.62 0.00 0.41 -0.73 0.00 0.00 179.01 179.26 1yop n GLY 42 N -1.32 -0.96 3.44 1.92 0.00 -0.98 -5.13 105.19 102.16 1yop n GLY 42 Ca 0.10 0.24 -0.26 0.00 0.00 0.00 0.00 46.02 46.11 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 1.59 0.00 1.61 2.56 -1.08 -4.98 118.70 118.40 1yop s GLU 43 Ca 0.00 -1.63 0.00 0.00 0.00 0.00 0.00 54.97 53.34 1yop s GLU 43 Cb 0.00 -1.81 0.00 0.00 2.00 0.00 0.00 34.13 34.32 1yop s GLU 43 CO 0.00 0.37 0.00 0.36 -0.56 0.00 0.00 175.26 175.43 1yop n LYS 44 N -0.10 0.00 -3.21 4.30 2.85 -1.26 -4.85 118.16 115.88 1yop n LYS 44 Ca -0.09 0.00 -0.46 0.00 -1.05 0.00 0.00 58.31 56.71 1yop n LYS 44 Cb 0.58 0.00 -0.02 0.00 -0.65 0.00 0.00 35.03 34.94 1yop n LYS 44 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 177.40 177.43 1yop s VAL 45 N -1.68 5.38 0.27 0.58 1.01 -1.26 -2.39 120.40 122.31 1yop s VAL 45 Ca 0.00 -2.29 -0.29 0.00 0.00 0.00 0.00 61.98 59.40 1yop s VAL 45 Cb 0.00 -4.57 -0.09 0.00 0.00 0.00 0.00 36.38 31.71 1yop s VAL 45 CO 0.00 -1.18 0.94 0.00 0.00 0.00 0.00 175.10 174.85 1yop s ALA 46 N 0.80 3.30 -0.17 5.51 0.00 -1.11 -4.85 121.76 125.23 1yop s ALA 46 Ca 0.23 0.58 -0.03 0.00 0.00 0.00 0.00 51.96 52.74 1yop s ALA 46 Cb -0.08 -3.19 -0.02 0.00 0.00 0.00 0.00 23.12 19.82 1yop s ALA 46 CO -0.09 0.20 -0.04 0.14 0.00 0.00 0.00 175.76 175.97 1yop s VAL 47 N -1.33 3.71 0.20 0.00 -7.23 -1.26 -3.04 120.40 111.44 1yop s VAL 47 Ca 0.44 -0.41 -0.30 0.00 -1.81 0.00 0.00 61.98 59.90 1yop s VAL 47 Cb -0.23 -2.64 -0.08 0.00 0.56 0.00 0.00 36.38 33.99 1yop s VAL 47 CO 0.29 0.47 1.21 0.00 -0.31 0.00 0.00 175.10 176.76 1yop n PRO 49 N 2.32 1.75 0.07 0.00 -0.04 -1.26 -1.82 135.00 136.03 1yop n PRO 49 Ca 0.04 -0.63 0.00 0.00 -0.04 0.00 0.00 63.50 62.87 1yop n PRO 49 Cb 0.44 -1.61 0.00 0.00 -0.04 0.00 0.00 33.50 32.29 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 0.11 0.48 0.00 3.54 2.88 -1.26 -4.89 113.62 114.49 1yop n SER 50 Ca 0.06 0.22 0.11 0.00 -1.33 0.00 0.00 58.87 57.93 1yop n SER 50 Cb 0.42 -0.03 -0.15 0.00 -0.75 0.00 0.00 64.21 63.70 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 -2.30 -4.64 -4.75 0.00 2.88 -0.75 -5.00 113.62 99.06 1yop n SER 52 Ca -0.03 -0.31 -0.38 0.00 -1.33 0.00 0.00 58.87 56.82 1yop n SER 52 Cb 0.56 -3.26 -0.06 0.00 -0.75 0.00 0.00 64.21 60.70 1yop n SER 52 CO 0.00 0.00 0.00 -0.22 -1.23 0.00 0.00 175.04 173.59 1yop s LEU 53 N -4.77 4.34 -0.07 2.46 0.20 -1.26 -4.76 118.68 114.82 1yop s LEU 53 Ca 0.33 0.93 -0.22 0.00 0.69 0.00 0.00 54.13 55.87 1yop s LEU 53 Cb -0.15 -2.74 -0.04 0.00 -0.43 0.00 0.00 46.19 42.83 1yop s LEU 53 CO 0.41 0.08 0.64 -0.04 -0.29 0.00 0.00 176.35 177.15 1yop s MET 54 N 0.14 4.41 0.02 1.98 -1.94 -1.26 -3.30 119.30 119.35 1yop s MET 54 Ca 0.27 0.77 0.03 0.00 -1.71 0.00 0.00 55.69 55.05 1yop s MET 54 Cb -0.16 -3.43 -0.02 0.00 2.01 0.00 0.00 34.83 33.23 1yop s MET 54 CO 0.13 0.11 -0.10 0.96 -0.01 0.00 0.00 175.02 176.12 1yop s ILE 55 N 0.66 0.74 -0.43 2.53 -4.36 -1.17 -3.12 121.20 116.05 1yop s ILE 55 Ca 0.34 -0.74 -0.14 0.00 -0.26 0.00 0.00 60.65 59.86 1yop s ILE 55 Cb -0.17 -0.68 0.05 0.00 1.25 0.00 0.00 42.46 42.90 1yop s ILE 55 CO 0.16 -0.03 0.31 -1.81 0.24 0.00 0.00 174.94 173.81 1yop s ASP 56 N -0.86 5.99 -0.27 4.36 1.01 -1.22 -2.75 116.67 122.94 1yop s ASP 56 Ca -0.01 -1.15 -0.07 0.00 0.71 0.00 0.00 52.55 52.03 1yop s ASP 56 Cb -0.06 -2.12 -0.01 0.00 1.01 0.00 0.00 42.92 41.74 1yop s ASP 56 CO 0.00 -0.52 0.06 0.54 0.21 0.00 0.00 175.17 175.47 1yop s VAL 57 N 1.61 4.02 0.13 -1.27 0.11 -1.01 -2.04 120.40 121.95 1yop s VAL 57 Ca 0.04 -0.50 -0.30 0.00 -2.93 0.00 0.00 61.98 58.29 1yop s VAL 57 Cb -0.21 -2.98 -0.06 0.00 -1.53 0.00 0.00 36.38 31.59 1yop s VAL 57 CO 0.07 0.20 0.96 0.54 -3.33 0.00 0.00 175.10 173.54 1yop s VAL 58 N 1.54 4.43 0.20 2.04 0.11 -0.91 -4.79 120.40 123.01 1yop s VAL 58 Ca 0.04 2.08 -0.04 0.00 -2.93 0.00 0.00 61.98 61.13 1yop s VAL 58 Cb -0.16 -4.32 -0.03 0.00 -1.53 0.00 0.00 36.38 30.33 1yop s VAL 58 CO 0.02 0.35 0.21 0.72 -3.33 0.00 0.00 175.10 173.07 1yop s PHE 59 N -0.20 0.92 0.24 1.54 -0.71 -1.26 -1.85 117.98 116.66 1yop s PHE 59 Ca 0.46 -1.19 0.01 0.00 -1.04 0.00 0.00 56.93 55.16 1yop s PHE 59 Cb -0.24 -0.36 -0.04 0.00 -1.21 0.00 0.00 43.02 41.17 1yop s PHE 59 CO 0.30 -0.71 0.13 -0.51 -1.34 0.00 0.00 175.22 173.09 1yop s ASP 60 N -3.11 0.67 -0.25 1.98 1.11 -1.26 -5.05 116.67 110.76 1yop s ASP 60 Ca 0.33 -1.43 0.09 0.00 0.18 0.00 0.00 52.55 51.72 1yop s ASP 60 Cb 0.05 0.33 0.66 0.00 1.07 0.00 0.00 42.92 45.03 1yop s ASP 60 CO 0.10 -0.83 1.62 0.29 1.18 0.00 0.00 175.17 177.53 1yop n LYS 61 N -0.38 3.63 -0.10 8.23 5.02 -1.26 -4.26 118.16 129.04 1yop n LYS 61 Ca 0.02 -2.62 -0.24 0.00 -2.02 0.00 0.00 58.31 53.44 1yop n LYS 61 Cb 0.66 -2.10 -0.11 0.00 -0.02 0.00 0.00 35.03 33.45 1yop n LYS 61 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1yop n GLU 62 N 0.10 0.61 -0.02 1.97 1.02 -1.26 -4.11 120.64 118.95 1yop n GLU 62 Ca 0.32 0.39 -0.06 0.00 -0.02 0.00 0.00 57.16 57.78 1yop n GLU 62 Cb 1.19 -1.63 0.12 0.00 -0.02 0.00 0.00 31.44 31.10 1yop n GLU 62 CO 0.00 0.00 0.00 0.22 1.18 0.00 0.00 177.13 178.53 1yop h ASP 63 N -0.77 0.61 0.03 1.62 1.82 -2.00 -2.94 116.42 114.79 1yop h ASP 63 Ca -0.50 -0.24 0.03 0.00 -0.39 0.00 0.00 57.03 55.92 1yop h ASP 63 Cb 1.56 -0.17 -0.04 0.00 0.68 0.00 0.00 39.33 41.36 1yop h ASP 63 CO -0.24 0.90 -0.23 -0.07 -1.61 0.00 0.00 179.24 177.99 1yop h LEU 64 N 0.50 -0.66 -0.56 2.28 4.07 -1.77 0.77 115.31 119.96 1yop h LEU 64 Ca 0.06 0.09 0.01 0.00 0.08 0.00 0.00 57.88 58.12 1yop h LEU 64 Cb 0.81 0.27 -0.03 0.00 1.08 0.00 0.00 40.66 42.78 1yop h LEU 64 CO 0.07 -0.30 0.36 0.00 -1.08 0.00 0.00 178.44 177.49 1yop h ALA 65 N 0.47 0.71 -0.35 1.53 0.00 -1.71 0.65 119.26 120.56 1yop h ALA 65 Ca 0.05 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.90 1yop h ALA 65 Cb 0.44 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1yop h ALA 65 CO -0.18 0.11 0.09 1.49 0.00 0.00 0.00 179.25 180.76 1yop h GLU 66 N 0.72 0.56 -0.24 0.00 4.81 -1.28 -2.03 114.58 117.13 1yop h GLU 66 Ca 0.21 -0.13 -0.20 0.00 -0.13 0.00 0.00 59.36 59.11 1yop h GLU 66 Cb -0.05 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.26 1yop h GLU 66 CO -0.06 0.60 -0.64 -0.92 -0.73 0.00 0.00 179.01 177.26 1yop h TYR 67 N 0.42 1.09 -0.59 0.92 3.20 0.83 -1.48 116.97 121.36 1yop h TYR 67 Ca 0.11 -0.42 -0.03 0.00 3.14 0.00 0.00 58.73 61.53 1yop h TYR 67 Cb 0.29 -0.19 -0.03 0.00 1.54 0.00 0.00 36.73 38.34 1yop h TYR 67 CO 0.01 1.26 0.24 -0.92 -1.64 0.00 0.00 178.16 177.11 1yop h TYR 68 N 0.62 0.86 0.04 -3.82 3.20 0.35 0.43 116.97 118.65 1yop h TYR 68 Ca -0.01 -0.05 -0.22 0.00 3.14 0.00 0.00 58.73 61.59 1yop h TYR 68 Cb 1.25 -0.27 -0.01 0.00 1.54 0.00 0.00 36.73 39.25 1yop h TYR 68 CO 0.08 0.66 -1.01 0.93 -1.64 0.00 0.00 178.16 177.18 1yop h GLU 69 N 0.85 0.18 -0.86 1.82 5.08 -1.35 -3.31 114.58 116.98 1yop h GLU 69 Ca 0.20 -0.24 -0.59 0.00 -1.00 0.00 0.00 59.36 57.73 1yop h GLU 69 Cb 0.16 0.08 -0.39 0.00 0.50 0.00 0.00 28.75 29.10 1yop h GLU 69 CO -0.02 1.04 -0.32 -1.91 -1.00 0.00 0.00 179.01 176.80 1yop n GLU 70 N -3.55 3.35 -2.63 2.33 2.13 -0.56 -5.05 120.64 116.66 1yop n GLU 70 Ca -0.04 -3.93 -0.33 0.00 0.66 0.00 0.00 57.16 53.52 1yop n GLU 70 Cb 0.90 -2.28 -0.05 0.00 0.27 0.00 0.00 31.44 30.28 1yop n GLU 70 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1yop s ALA 71 N -3.67 3.01 -0.38 4.31 0.00 0.15 -4.86 121.76 120.32 1yop s ALA 71 Ca 0.55 0.36 0.02 0.00 0.00 0.00 0.00 51.96 52.89 1yop s ALA 71 Cb 0.44 -3.16 0.46 0.00 0.00 0.00 0.00 23.12 20.86 1yop s ALA 71 CO 0.01 -0.08 1.78 0.41 0.00 0.00 0.00 175.76 177.89 1yop n GLY 72 N -0.87 4.20 0.11 0.00 0.00 -0.96 -4.33 105.19 103.34 1yop n GLY 72 Ca 0.07 -1.07 -0.17 0.00 0.00 0.00 0.00 46.02 44.85 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 0.82 1.23 -3.55 -0.61 2.10 -1.72 -3.39 117.51 112.39 1yop h ILE 73 Ca 0.48 -2.85 -0.52 0.00 1.08 0.00 0.00 64.86 63.05 1yop h ILE 73 Cb 1.99 2.81 -0.03 0.00 -1.09 0.00 0.00 36.82 40.49 1yop h ILE 73 CO 0.94 0.83 0.04 -1.38 -1.08 0.00 0.00 178.15 177.50 1yop s HIS 74 N -2.62 3.54 -0.20 2.19 -3.43 -1.26 -5.02 115.29 108.49 1yop s HIS 74 Ca -0.08 1.23 -0.29 0.00 -0.80 0.00 0.00 55.06 55.12 1yop s HIS 74 Cb 0.07 -2.51 -0.02 0.00 -1.43 0.00 0.00 32.58 28.68 1yop s HIS 74 CO 0.86 0.28 1.52 -1.25 -2.00 0.00 0.00 174.74 174.15 1yop s PRO 75 N -2.33 3.94 1.25 -0.38 0.04 -1.26 -5.01 135.00 131.25 1yop s PRO 75 Ca 0.45 1.67 -0.15 0.00 0.04 0.00 0.00 61.00 63.02 1yop s PRO 75 Cb -0.14 -3.96 0.32 0.00 0.04 0.00 0.00 34.50 30.76 1yop s PRO 75 CO 0.20 -1.11 0.99 -2.14 0.04 0.00 0.00 177.00 174.97 1yop s PRO 76 N 4.33 -1.62 0.14 0.56 0.02 -1.26 -5.02 135.00 132.14 1yop s PRO 76 Ca 0.67 0.70 -0.07 0.00 0.02 0.00 0.00 61.00 62.32 1yop s PRO 76 Cb -0.24 -1.48 -0.06 0.00 0.02 0.00 0.00 34.50 32.74 1yop s PRO 76 CO 0.26 -4.15 0.42 -1.21 -0.33 0.00 0.00 177.00 171.98 1yop s GLU 77 N -4.51 3.70 -0.84 5.54 2.02 -1.26 -4.98 118.70 118.37 1yop s GLU 77 Ca 0.69 0.07 -0.23 0.00 0.02 0.00 0.00 54.97 55.51 1yop s GLU 77 Cb -0.24 -2.86 -0.18 0.00 0.10 0.00 0.00 34.13 30.96 1yop s GLU 77 CO 0.64 0.47 2.28 -2.30 0.02 0.00 0.00 175.26 176.38 1yop n PRO 78 N 0.32 0.39 -1.23 0.39 -0.02 -1.26 -4.45 135.00 129.13 1yop n PRO 78 Ca -0.04 -0.88 0.00 0.00 -2.02 0.00 0.00 63.50 60.56 1yop n PRO 78 Cb 0.52 -3.33 0.00 0.00 -0.02 0.00 0.00 33.50 30.67 1yop n PRO 78 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 1yop n ILE 79 N 8.33 -4.21 0.04 4.25 -0.00 -1.26 -5.08 119.36 121.43 1yop n ILE 79 Ca 0.47 1.79 0.00 0.00 -0.00 0.00 0.00 62.75 65.01 1yop n ILE 79 Cb 0.40 -2.58 0.00 0.00 -0.00 0.00 0.00 39.64 37.47 1yop n ILE 79 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.55 176.55 1yop n ALA 80 N -0.24 3.00 -0.10 -1.39 0.00 -1.26 -4.96 120.51 115.56 1yop n ALA 80 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 53.44 53.34 1yop n ALA 80 Cb 0.00 0.05 -0.14 0.00 0.00 0.00 0.00 19.45 19.36 1yop n ALA 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1yop n ALA 81 N -2.91 1.54 -1.64 0.00 0.00 -1.26 -4.94 120.51 111.30 1yop n ALA 81 Ca 0.00 -1.19 -0.42 0.00 0.00 0.00 0.00 53.44 51.82 1yop n ALA 81 Cb 0.00 -0.13 -0.03 0.00 0.00 0.00 0.00 19.45 19.29 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 -2.45 3.17 0.00 0.00 0.00 -1.26 -5.34 121.76 115.87 1yop s ALA 82 Ca -0.13 1.06 0.00 0.00 0.00 0.00 0.00 51.96 52.89 1yop s ALA 82 Cb 0.06 -3.96 0.00 0.00 0.00 0.00 0.00 23.12 19.22 1yop s ALA 82 CO 0.72 -2.17 0.00 0.00 0.00 0.00 0.00 175.76 174.32