#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 7hvp s GLN 2 N 0.00 0.95 -0.16 -0.52 0.74 -1.26 -5.10 119.66 114.30 7hvp s GLN 2 Ca 0.00 -0.95 -0.07 0.00 0.05 0.00 0.00 55.36 54.39 7hvp s GLN 2 Cb 0.00 -2.24 -0.04 0.00 1.10 0.00 0.00 33.01 31.83 7hvp s GLN 2 CO 0.00 -0.81 0.08 0.42 -0.55 0.00 0.00 175.29 174.42 7hvp s ILE 3 N 1.58 4.93 0.52 -2.34 1.01 -1.26 -5.12 121.20 120.52 7hvp s ILE 3 Ca 0.04 0.01 -0.05 0.00 0.00 0.00 0.00 60.65 60.64 7hvp s ILE 3 Cb -0.18 -3.20 -0.02 0.00 0.01 0.00 0.00 42.46 39.08 7hvp s ILE 3 CO -0.16 0.50 0.83 0.42 0.00 0.00 0.00 174.94 176.54 7hvp s THR 4 N 0.01 4.43 -1.50 2.92 -4.23 -1.26 -5.04 115.64 110.98 7hvp s THR 4 Ca 0.07 0.13 0.19 0.00 -1.18 0.00 0.00 61.69 60.90 7hvp s THR 4 Cb -0.12 -3.71 0.67 0.00 1.34 0.00 0.00 72.50 70.69 7hvp s THR 4 CO 0.01 -0.71 1.57 0.18 -0.54 0.00 0.00 174.62 175.13 7hvp n LEU 5 N -2.39 4.31 0.16 4.79 4.32 -1.26 -4.44 117.00 122.49 7hvp n LEU 5 Ca 0.02 -2.17 0.03 0.00 -0.02 0.00 0.00 56.01 53.88 7hvp n LEU 5 Cb 0.56 -0.53 0.42 0.00 -1.62 0.00 0.00 43.42 42.24 7hvp n LEU 5 CO 0.53 0.85 0.86 -0.50 -1.22 0.00 0.00 177.39 177.91 7hvp h TRP 6 N 4.06 0.13 -2.90 -1.77 4.06 -2.07 -3.43 115.95 114.03 7hvp h TRP 6 Ca 0.00 -0.02 -0.45 0.00 2.06 0.00 0.00 58.89 60.48 7hvp h TRP 6 Cb 1.23 -0.04 -0.14 0.00 -1.00 0.00 0.00 29.16 29.22 7hvp h TRP 6 CO 0.64 0.32 -0.67 -0.65 -3.56 0.00 0.00 178.44 174.52 7hvp s GLN 7 N -4.59 1.47 0.33 0.49 1.11 -1.26 -5.09 119.66 112.11 7hvp s GLN 7 Ca -0.04 -1.75 -0.29 0.00 0.01 0.00 0.00 55.36 53.29 7hvp s GLN 7 Cb 0.15 -0.95 -0.12 0.00 -1.01 0.00 0.00 33.01 31.09 7hvp s GLN 7 CO 0.72 -0.02 1.43 0.54 0.01 0.00 0.00 175.29 177.97 7hvp n ARG 8 N -0.52 2.38 -1.21 2.91 1.74 -1.26 -4.82 116.66 115.88 7hvp n ARG 8 Ca -0.05 0.84 -0.40 0.00 -0.77 0.00 0.00 57.85 57.47 7hvp n ARG 8 Cb 0.64 -2.52 -0.04 0.00 -1.02 0.00 0.00 32.46 29.52 7hvp n ARG 8 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 7hvp n PRO 9 N 1.07 1.90 -2.68 5.56 -0.04 -1.26 -4.93 135.00 134.62 7hvp n PRO 9 Ca 0.06 -1.95 -0.42 0.00 -0.04 0.00 0.00 63.50 61.15 7hvp n PRO 9 Cb 0.36 -2.92 -0.03 0.00 -0.04 0.00 0.00 33.50 30.87 7hvp n PRO 9 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 7hvp s LEU 10 N 1.19 4.37 0.15 1.53 2.01 -1.26 -1.49 118.68 125.18 7hvp s LEU 10 Ca 0.53 1.69 -0.01 0.00 0.01 0.00 0.00 54.13 56.36 7hvp s LEU 10 Cb 0.14 -3.57 -0.04 0.00 0.01 0.00 0.00 46.19 42.73 7hvp s LEU 10 CO 0.05 -0.28 0.06 -0.69 1.01 0.00 0.00 176.35 176.50 7hvp s VAL 11 N 1.04 0.17 -0.13 -1.59 1.01 -0.69 -4.95 120.40 115.27 7hvp s VAL 11 Ca 0.53 -1.94 -0.05 0.00 0.00 0.00 0.00 61.98 60.51 7hvp s VAL 11 Cb -0.22 -2.16 -0.04 0.00 0.00 0.00 0.00 36.38 33.96 7hvp s VAL 11 CO 0.28 -0.36 0.07 -0.89 0.00 0.00 0.00 175.10 174.20 7hvp s THR 12 N -4.01 4.93 0.27 3.92 2.01 -1.26 -0.85 115.64 120.65 7hvp s THR 12 Ca 0.27 -0.00 0.04 0.00 0.31 0.00 0.00 61.69 62.31 7hvp s THR 12 Cb 0.07 -3.14 -0.06 0.00 0.01 0.00 0.00 72.50 69.38 7hvp s THR 12 CO 0.04 0.57 0.01 0.27 -0.69 0.00 0.00 174.62 174.82 7hvp s ILE 13 N -0.59 1.17 -0.03 1.82 -4.36 -0.58 -4.58 121.20 114.05 7hvp s ILE 13 Ca 0.11 -2.04 -0.00 0.00 -0.26 0.00 0.00 60.65 58.46 7hvp s ILE 13 Cb -0.12 -2.50 0.03 0.00 1.25 0.00 0.00 42.46 41.12 7hvp s ILE 13 CO 0.02 -0.22 0.02 -0.60 0.24 0.00 0.00 174.94 174.41 7hvp s ARG 14 N -3.85 0.13 0.03 0.37 3.52 -0.85 0.44 118.95 118.75 7hvp s ARG 14 Ca 0.31 0.19 0.05 0.00 -0.13 0.00 0.00 55.73 56.15 7hvp s ARG 14 Cb 0.06 -0.47 -0.02 0.00 -1.56 0.00 0.00 34.95 32.97 7hvp s ARG 14 CO 0.11 -0.21 -0.14 0.42 -0.81 0.00 0.00 175.30 174.68 7hvp s ILE 15 N 1.41 1.07 0.00 4.11 1.09 0.48 -3.46 121.20 125.92 7hvp s ILE 15 Ca -0.04 -0.96 0.00 0.00 -1.10 0.00 0.00 60.65 58.55 7hvp s ILE 15 Cb -0.13 -0.97 0.00 0.00 -1.06 0.00 0.00 42.46 40.30 7hvp s ILE 15 CO -0.03 0.02 0.00 0.61 -0.10 0.00 0.00 174.94 175.44 7hvp n GLY 16 N 1.97 3.75 0.01 6.18 0.00 -1.26 0.18 105.19 116.01 7hvp n GLY 16 Ca -0.18 0.08 0.10 0.00 0.00 0.00 0.00 46.02 46.02 7hvp n GLY 16 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 7hvp n GLY 17 N 0.00 -0.89 3.63 -0.02 0.00 -1.26 -4.98 105.19 101.67 7hvp n GLY 17 Ca 0.00 -0.47 -0.47 0.00 0.00 0.00 0.00 46.02 45.08 7hvp n GLY 17 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 7hvp n GLN 18 N -2.15 1.65 -3.92 1.61 3.00 0.46 -4.97 117.38 113.07 7hvp n GLN 18 Ca -0.03 0.59 -0.35 0.00 -0.01 0.00 0.00 57.00 57.19 7hvp n GLN 18 Cb 0.50 -2.21 -0.13 0.00 0.00 0.00 0.00 30.24 28.40 7hvp n GLN 18 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.06 175.89 7hvp s LEU 19 N 0.45 3.21 0.24 1.08 2.96 -1.26 0.18 118.68 125.54 7hvp s LEU 19 Ca 0.73 -0.26 0.02 0.00 -0.22 0.00 0.00 54.13 54.41 7hvp s LEU 19 Cb -0.76 -1.83 -0.05 0.00 0.50 0.00 0.00 46.19 44.05 7hvp s LEU 19 CO 0.48 0.01 0.04 -0.54 -1.32 0.00 0.00 176.35 175.02 7hvp s LYS 20 N 1.34 1.35 -0.29 1.98 1.02 0.17 -4.96 119.74 120.35 7hvp s LYS 20 Ca 0.04 -1.70 -0.05 0.00 0.02 0.00 0.00 55.97 54.28 7hvp s LYS 20 Cb -0.15 -0.43 0.02 0.00 -0.52 0.00 0.00 37.83 36.75 7hvp s LYS 20 CO 0.01 -0.19 0.05 -1.21 -0.92 0.00 0.00 175.35 173.08 7hvp s GLU 21 N -3.94 2.97 0.24 1.68 2.02 -1.25 -1.52 118.70 118.89 7hvp s GLU 21 Ca 0.32 -0.93 0.09 0.00 0.02 0.00 0.00 54.97 54.47 7hvp s GLU 21 Cb 0.07 -3.28 -0.04 0.00 0.10 0.00 0.00 34.13 30.98 7hvp s GLU 21 CO 0.10 -0.46 0.02 0.00 0.02 0.00 0.00 175.26 174.95 7hvp s ALA 22 N 1.44 3.22 -0.18 5.21 0.00 -0.03 -4.40 121.76 127.03 7hvp s ALA 22 Ca 0.01 -1.56 -0.16 0.00 0.00 0.00 0.00 51.96 50.26 7hvp s ALA 22 Cb -0.17 -0.89 -0.04 0.00 0.00 0.00 0.00 23.12 22.02 7hvp s ALA 22 CO 0.01 0.31 0.39 -1.17 0.00 0.00 0.00 175.76 175.29 7hvp s LEU 23 N -3.54 4.20 0.09 0.00 2.96 0.46 -1.70 118.68 121.16 7hvp s LEU 23 Ca 0.31 0.57 -0.31 0.00 -0.22 0.00 0.00 54.13 54.47 7hvp s LEU 23 Cb -0.07 -2.51 -0.07 0.00 0.50 0.00 0.00 46.19 44.04 7hvp s LEU 23 CO 0.20 -0.02 1.29 -0.76 -1.32 0.00 0.00 176.35 175.74 7hvp s LEU 24 N 1.00 4.37 -0.24 -0.68 1.02 -0.56 -0.73 118.68 122.86 7hvp s LEU 24 Ca 0.20 2.18 -0.03 0.00 0.02 0.00 0.00 54.13 56.50 7hvp s LEU 24 Cb -0.14 -3.58 0.13 0.00 0.02 0.00 0.00 46.19 42.61 7hvp s LEU 24 CO 0.07 -0.55 0.37 -0.62 0.02 0.00 0.00 176.35 175.64 7hvp s ASP 25 N 1.02 0.33 0.59 2.29 2.15 -0.29 -4.74 116.67 118.01 7hvp s ASP 25 Ca 0.61 0.20 0.35 0.00 0.43 0.00 0.00 52.55 54.14 7hvp s ASP 25 Cb -0.33 1.06 1.85 0.00 -0.30 0.00 0.00 42.92 45.20 7hvp s ASP 25 CO 0.30 -0.30 2.19 0.71 -0.17 0.00 0.00 175.17 177.90 7hvp h THR 26 N 6.19 0.24 -0.21 1.71 1.35 -1.94 -0.87 112.91 119.38 7hvp h THR 26 Ca -0.19 -0.27 0.00 0.00 -0.55 0.00 0.00 66.41 65.40 7hvp h THR 26 Cb 1.16 1.21 0.00 0.00 -1.73 0.00 0.00 68.15 68.78 7hvp h THR 26 CO 0.27 0.04 0.00 0.61 -0.25 0.00 0.00 175.52 176.19 7hvp n GLY 27 N -0.77 0.27 3.49 5.82 0.00 -1.26 -4.81 105.19 107.92 7hvp n GLY 27 Ca -0.02 -0.37 -0.36 0.00 0.00 0.00 0.00 46.02 45.27 7hvp n GLY 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 7hvp s ALA 28 N -1.73 3.17 0.13 4.61 0.00 -0.33 -4.96 121.76 122.65 7hvp s ALA 28 Ca 0.28 -1.00 -0.01 0.00 0.00 0.00 0.00 51.96 51.23 7hvp s ALA 28 Cb 0.15 -1.95 -0.11 0.00 0.00 0.00 0.00 23.12 21.21 7hvp s ALA 28 CO 0.22 -0.24 1.30 -0.44 0.00 0.00 0.00 175.76 176.60 7hvp h ASP 29 N 7.67 0.36 -2.23 0.00 3.32 -1.87 0.37 116.42 124.04 7hvp h ASP 29 Ca -0.37 -0.32 -0.57 0.00 0.02 0.00 0.00 57.03 55.79 7hvp h ASP 29 Cb 1.18 -0.11 -0.13 0.00 0.22 0.00 0.00 39.33 40.48 7hvp h ASP 29 CO 0.61 1.15 -0.57 -1.81 -1.72 0.00 0.00 179.24 176.90 7hvp s ASP 30 N -7.01 3.21 -0.15 6.45 1.01 -1.26 -3.52 116.67 115.40 7hvp s ASP 30 Ca -0.04 -1.47 -0.08 0.00 0.71 0.00 0.00 52.55 51.67 7hvp s ASP 30 Cb 0.09 0.02 -0.04 0.00 1.01 0.00 0.00 42.92 44.00 7hvp s ASP 30 CO 0.85 -0.66 0.12 -0.89 0.21 0.00 0.00 175.17 174.81 7hvp s THR 31 N -3.03 5.36 -0.04 -1.27 2.01 -1.26 -3.08 115.64 114.32 7hvp s THR 31 Ca 0.28 0.16 0.02 0.00 0.31 0.00 0.00 61.69 62.46 7hvp s THR 31 Cb 0.07 -3.38 0.01 0.00 0.01 0.00 0.00 72.50 69.22 7hvp s THR 31 CO 0.14 0.54 -0.08 0.54 -0.69 0.00 0.00 174.62 175.07 7hvp s VAL 32 N -0.41 0.79 0.20 3.82 0.11 -0.82 -1.64 120.40 122.46 7hvp s VAL 32 Ca 0.11 -0.30 0.09 0.00 -2.93 0.00 0.00 61.98 58.96 7hvp s VAL 32 Cb -0.12 -0.75 -0.05 0.00 -1.53 0.00 0.00 36.38 33.94 7hvp s VAL 32 CO 0.01 0.27 -0.18 -0.76 -3.33 0.00 0.00 175.10 171.11 7hvp s LEU 33 N 0.61 2.50 0.74 2.54 1.43 -0.14 -0.07 118.68 126.29 7hvp s LEU 33 Ca -0.10 -0.94 -0.11 0.00 -1.03 0.00 0.00 54.13 51.95 7hvp s LEU 33 Cb -0.13 -0.90 0.05 0.00 0.03 0.00 0.00 46.19 45.24 7hvp s LEU 33 CO 0.01 -0.03 1.10 -0.70 0.23 0.00 0.00 176.35 176.96 7hvp s GLU 34 N -3.15 2.42 0.16 1.70 2.12 -1.26 -1.66 118.70 119.02 7hvp s GLU 34 Ca 0.21 0.18 -0.32 0.00 0.36 0.00 0.00 54.97 55.41 7hvp s GLU 34 Cb -0.05 -2.04 -0.17 0.00 0.26 0.00 0.00 34.13 32.14 7hvp s GLU 34 CO 0.09 -1.26 0.89 0.39 -0.54 0.00 0.00 175.26 174.84 7hvp n GLU 35 N -3.08 0.54 -3.54 4.30 -0.58 -1.14 -4.59 120.64 112.55 7hvp n GLU 35 Ca 0.07 0.19 -0.11 0.00 -0.42 0.00 0.00 57.16 56.90 7hvp n GLU 35 Cb 0.59 -1.49 -0.04 0.00 -0.57 0.00 0.00 31.44 29.93 7hvp n GLU 35 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 7hvp s MET 36 N -0.68 0.74 -1.02 3.49 0.23 -1.26 -5.04 119.30 115.76 7hvp s MET 36 Ca 0.72 -0.00 -0.02 0.00 -1.03 0.00 0.00 55.69 55.35 7hvp s MET 36 Cb -0.94 0.34 0.31 0.00 -1.53 0.00 0.00 34.83 33.01 7hvp s MET 36 CO 0.56 -0.27 1.44 -1.71 -2.03 0.00 0.00 175.02 173.01 7hvp n ASN 37 N 0.40 6.24 -4.76 -1.18 2.85 -1.26 -5.02 115.26 112.53 7hvp n ASN 37 Ca -0.11 -3.46 -0.39 0.00 -0.11 0.00 0.00 54.58 50.51 7hvp n ASN 37 Cb 0.59 -1.18 -0.06 0.00 1.24 0.00 0.00 39.78 40.37 7hvp n ASN 37 CO 0.00 0.00 0.00 -0.76 -2.11 0.00 0.00 177.26 174.39 7hvp s LEU 38 N -2.98 4.55 0.40 1.20 1.43 -1.26 -5.02 118.68 117.01 7hvp s LEU 38 Ca 0.33 1.91 -0.24 0.00 -1.03 0.00 0.00 54.13 55.10 7hvp s LEU 38 Cb 0.08 -3.74 -0.09 0.00 0.03 0.00 0.00 46.19 42.48 7hvp s LEU 38 CO 0.06 0.09 1.08 -2.16 0.23 0.00 0.00 176.35 175.65 7hvp s PRO 39 N -1.45 4.13 0.00 1.29 0.04 -1.26 -4.92 135.00 132.83 7hvp s PRO 39 Ca 0.44 1.60 0.00 0.00 0.04 0.00 0.00 61.00 63.07 7hvp s PRO 39 Cb -0.24 -2.58 0.00 0.00 0.04 0.00 0.00 34.50 31.72 7hvp s PRO 39 CO 0.29 -0.19 0.00 0.41 0.04 0.00 0.00 177.00 177.56 7hvp n GLY 40 N 0.44 3.52 3.85 0.56 0.00 -1.26 -5.09 105.19 107.20 7hvp n GLY 40 Ca 0.05 -1.71 -0.33 0.00 0.00 0.00 0.00 46.02 44.02 7hvp n GLY 40 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 7hvp s LYS 41 N -2.36 4.02 0.24 1.61 -2.85 -1.26 -5.08 119.74 114.07 7hvp s LYS 41 Ca 0.00 0.67 -0.05 0.00 -1.00 0.00 0.00 55.97 55.59 7hvp s LYS 41 Cb 0.00 -2.52 -0.02 0.00 -2.06 0.00 0.00 37.83 33.23 7hvp s LYS 41 CO 0.00 0.21 0.31 1.67 0.10 0.00 0.00 175.35 177.64 7hvp s TRP 42 N -1.89 0.88 0.01 1.78 1.48 -1.26 -4.53 118.94 115.40 7hvp s TRP 42 Ca 0.52 -1.14 0.02 0.00 -1.06 0.00 0.00 56.10 54.44 7hvp s TRP 42 Cb -0.11 -0.22 -0.01 0.00 -1.16 0.00 0.00 33.47 31.96 7hvp s TRP 42 CO 0.18 -0.85 -0.07 0.15 -4.06 0.00 0.00 176.95 172.30 7hvp s LYS 43 N -3.93 0.51 0.74 3.25 1.02 -0.87 -4.93 119.74 115.54 7hvp s LYS 43 Ca 0.32 -0.37 -0.10 0.00 0.02 0.00 0.00 55.97 55.84 7hvp s LYS 43 Cb 0.03 -0.44 0.06 0.00 -0.52 0.00 0.00 37.83 36.95 7hvp s LYS 43 CO 0.13 0.11 1.10 -1.25 -0.92 0.00 0.00 175.35 174.52 7hvp s PRO 44 N -0.55 2.28 -0.18 -1.68 0.05 -1.26 0.91 135.00 134.58 7hvp s PRO 44 Ca -0.01 0.07 -0.35 0.00 0.05 0.00 0.00 61.00 60.76 7hvp s PRO 44 Cb -0.04 -2.05 0.14 0.00 0.05 0.00 0.00 34.50 32.60 7hvp s PRO 44 CO 0.00 -1.32 1.32 -1.59 0.05 0.00 0.00 177.00 175.46 7hvp s LYS 45 N -5.40 0.19 -0.12 4.56 -2.85 -0.14 -4.80 119.74 111.17 7hvp s LYS 45 Ca 0.60 -0.08 0.03 0.00 -1.00 0.00 0.00 55.97 55.51 7hvp s LYS 45 Cb -0.11 0.08 0.00 0.00 -2.06 0.00 0.00 37.83 35.74 7hvp s LYS 45 CO 0.48 -0.08 -0.21 -1.64 0.10 0.00 0.00 175.35 173.99 7hvp s MET 46 N -2.23 3.08 0.06 1.78 -1.94 -1.26 0.14 119.30 118.92 7hvp s MET 46 Ca 0.12 -0.84 0.08 0.00 -1.71 0.00 0.00 55.69 53.33 7hvp s MET 46 Cb 0.01 -2.41 -0.03 0.00 2.01 0.00 0.00 34.83 34.41 7hvp s MET 46 CO -0.04 0.09 -0.22 0.96 -0.01 0.00 0.00 175.02 175.80 7hvp s ILE 47 N 0.57 1.76 0.29 2.53 -5.25 -0.74 -4.98 121.20 115.38 7hvp s ILE 47 Ca -0.12 -1.30 0.02 0.00 -0.99 0.00 0.00 60.65 58.26 7hvp s ILE 47 Cb -0.17 -1.54 -0.05 0.00 2.95 0.00 0.00 42.46 43.66 7hvp s ILE 47 CO 0.04 0.18 0.11 -0.83 -1.79 0.00 0.00 174.94 172.65 7hvp s GLY 48 N -1.33 1.93 0.00 6.27 0.00 -1.26 -1.63 107.32 111.30 7hvp s GLY 48 Ca 0.08 -1.82 0.00 0.00 0.00 0.00 0.00 44.72 42.98 7hvp s GLY 48 CO 0.02 -1.64 0.00 0.61 0.00 0.00 0.00 173.10 172.09 7hvp n GLY 49 N -0.56 -0.68 3.49 0.20 0.00 -0.41 -5.00 105.19 102.23 7hvp n GLY 49 Ca -0.00 -0.79 -0.56 0.00 0.00 0.00 0.00 46.02 44.67 7hvp n GLY 49 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 7hvp n ILE 50 N 2.81 0.39 -0.18 -0.61 2.08 -1.26 -1.89 119.36 120.70 7hvp n ILE 50 Ca 0.00 -0.10 0.00 0.00 0.56 0.00 0.00 62.75 63.21 7hvp n ILE 50 Cb 0.00 -0.11 0.00 0.00 -0.75 0.00 0.00 39.64 38.78 7hvp n ILE 50 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 7hvp n GLY 51 N 1.69 1.00 0.00 7.39 0.00 -1.26 -4.96 105.19 109.05 7hvp n GLY 51 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 7hvp n GLY 51 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 7hvp n GLY 52 N -2.00 1.03 3.75 -0.02 0.00 -0.79 -5.04 105.19 102.12 7hvp n GLY 52 Ca 0.00 -1.64 -0.28 0.00 0.00 0.00 0.00 46.02 44.11 7hvp n GLY 52 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 7hvp s PHE 53 N 0.00 3.08 0.00 1.61 0.40 -1.26 -1.29 117.98 120.52 7hvp s PHE 53 Ca 0.00 -0.02 -0.01 0.00 -0.60 0.00 0.00 56.93 56.30 7hvp s PHE 53 Cb 0.00 -1.51 -0.01 0.00 0.51 0.00 0.00 43.02 42.01 7hvp s PHE 53 CO 0.00 0.51 0.00 0.96 0.70 0.00 0.00 175.22 177.40 7hvp s ILE 54 N -1.61 0.04 0.25 0.64 -4.36 -0.65 -4.99 121.20 110.53 7hvp s ILE 54 Ca 0.29 -0.36 -0.14 0.00 -0.26 0.00 0.00 60.65 60.18 7hvp s ILE 54 Cb -0.11 -0.13 -0.08 0.00 1.25 0.00 0.00 42.46 43.40 7hvp s ILE 54 CO 0.22 -0.20 0.65 -0.75 0.24 0.00 0.00 174.94 175.10 7hvp s LYS 55 N -0.58 3.99 0.06 0.37 2.20 -1.26 -1.79 119.74 122.73 7hvp s LYS 55 Ca -0.06 0.58 -0.10 0.00 -0.36 0.00 0.00 55.97 56.02 7hvp s LYS 55 Cb -0.04 -2.65 0.01 0.00 -1.51 0.00 0.00 37.83 33.63 7hvp s LYS 55 CO -0.00 0.30 0.22 0.14 -0.36 0.00 0.00 175.35 175.65 7hvp s VAL 56 N -1.77 0.11 -0.18 4.02 -7.23 0.36 -4.45 120.40 111.26 7hvp s VAL 56 Ca 0.48 -0.92 -0.09 0.00 -1.81 0.00 0.00 61.98 59.63 7hvp s VAL 56 Cb -0.12 -1.06 -0.05 0.00 0.56 0.00 0.00 36.38 35.71 7hvp s VAL 56 CO 0.19 -0.51 0.11 -0.13 -0.31 0.00 0.00 175.10 174.45 7hvp s ARG 57 N -3.02 4.00 -0.25 4.82 0.52 -0.32 -0.97 118.95 123.74 7hvp s ARG 57 Ca -0.02 -0.25 -0.05 0.00 -0.52 0.00 0.00 55.73 54.89 7hvp s ARG 57 Cb 0.01 -3.31 -0.00 0.00 0.52 0.00 0.00 34.95 32.16 7hvp s ARG 57 CO -0.06 0.37 0.02 -1.14 0.02 0.00 0.00 175.30 174.50 7hvp s GLN 58 N 0.15 3.26 -0.11 3.54 0.74 0.26 -0.32 119.66 127.18 7hvp s GLN 58 Ca 0.08 -0.72 -0.05 0.00 0.05 0.00 0.00 55.36 54.71 7hvp s GLN 58 Cb -0.12 -3.18 -0.04 0.00 1.10 0.00 0.00 33.01 30.77 7hvp s GLN 58 CO -0.01 -0.31 0.09 0.71 -0.55 0.00 0.00 175.29 175.23 7hvp s TYR 59 N 1.49 3.44 0.17 1.67 1.51 -0.33 -2.05 117.35 123.25 7hvp s TYR 59 Ca 0.04 0.41 0.07 0.00 -1.01 0.00 0.00 57.07 56.58 7hvp s TYR 59 Cb -0.16 -1.89 -0.04 0.00 -0.11 0.00 0.00 41.96 39.77 7hvp s TYR 59 CO -0.00 0.64 0.01 -0.51 -1.11 0.00 0.00 175.55 174.57 7hvp s ASP 60 N -0.97 4.82 -1.26 2.29 1.01 -1.26 -1.48 116.67 119.82 7hvp s ASP 60 Ca 0.14 -0.37 -0.25 0.00 0.71 0.00 0.00 52.55 52.79 7hvp s ASP 60 Cb -0.12 -1.05 0.02 0.00 1.01 0.00 0.00 42.92 42.79 7hvp s ASP 60 CO 0.03 0.09 0.60 0.00 0.21 0.00 0.00 175.17 176.10 7hvp n GLN 61 N -0.10 -0.78 -3.78 8.23 6.02 -1.12 -4.89 117.38 120.96 7hvp n GLN 61 Ca -0.10 0.18 -0.37 0.00 -0.01 0.00 0.00 57.00 56.71 7hvp n GLN 61 Cb 0.55 -3.17 -0.13 0.00 1.02 0.00 0.00 30.24 28.51 7hvp n GLN 61 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 7hvp s ILE 62 N -3.66 4.03 0.15 5.09 1.01 0.84 -4.77 121.20 123.88 7hvp s ILE 62 Ca 0.39 -0.45 -0.31 0.00 0.00 0.00 0.00 60.65 60.28 7hvp s ILE 62 Cb -0.19 -2.96 -0.08 0.00 0.01 0.00 0.00 42.46 39.23 7hvp s ILE 62 CO 0.95 0.23 1.35 -2.84 0.00 0.00 0.00 174.94 174.63 7hvp s PRO 63 N 1.55 4.35 0.10 2.79 0.02 -1.26 -2.00 135.00 140.54 7hvp s PRO 63 Ca 0.05 2.06 0.02 0.00 0.02 0.00 0.00 61.00 63.14 7hvp s PRO 63 Cb -0.16 -3.23 -0.04 0.00 0.02 0.00 0.00 34.50 31.09 7hvp s PRO 63 CO 0.02 -0.36 -0.07 0.08 -0.33 0.00 0.00 177.00 176.35 7hvp s VAL 64 N 0.68 0.70 -0.22 3.83 1.01 0.09 -4.55 120.40 121.94 7hvp s VAL 64 Ca 0.61 -1.94 -0.03 0.00 0.00 0.00 0.00 61.98 60.62 7hvp s VAL 64 Cb -0.36 -1.69 0.10 0.00 0.00 0.00 0.00 36.38 34.43 7hvp s VAL 64 CO 0.34 -0.87 0.24 -0.70 0.00 0.00 0.00 175.10 174.10 7hvp s GLU 65 N -3.83 0.22 -0.43 2.72 2.12 -1.22 0.83 118.70 119.10 7hvp s GLU 65 Ca 0.12 0.15 0.05 0.00 0.36 0.00 0.00 54.97 55.64 7hvp s GLU 65 Cb 0.05 -1.10 0.63 0.00 0.26 0.00 0.00 34.13 33.98 7hvp s GLU 65 CO -0.05 -0.72 1.84 1.51 -0.54 0.00 0.00 175.26 177.31 7hvp n ILE 66 N 5.32 3.11 0.00 -3.70 0.13 -1.26 -2.01 119.36 120.95 7hvp n ILE 66 Ca -0.05 -2.13 0.00 0.00 -1.10 0.00 0.00 62.75 59.47 7hvp n ILE 66 Cb 0.49 -0.48 0.00 0.00 -0.84 0.00 0.00 39.64 38.81 7hvp n ILE 66 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 7hvp n GLY 68 N -1.13 0.00 3.41 4.50 0.00 -1.26 -4.67 105.19 106.03 7hvp n GLY 68 Ca 0.55 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 46.16 7hvp n GLY 68 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 7hvp s HIS 69 N 0.00 3.24 0.56 1.61 4.02 -1.26 -5.10 115.29 118.36 7hvp s HIS 69 Ca 0.00 -0.78 -0.06 0.00 1.02 0.00 0.00 55.06 55.23 7hvp s HIS 69 Cb 0.00 -2.48 -0.01 0.00 -1.02 0.00 0.00 32.58 29.07 7hvp s HIS 69 CO 0.00 -0.60 0.88 0.15 1.02 0.00 0.00 174.74 176.19 7hvp s LYS 70 N 1.60 3.14 0.30 1.40 1.02 -1.26 -4.36 119.74 121.58 7hvp s LYS 70 Ca 0.03 0.12 -0.11 0.00 0.02 0.00 0.00 55.97 56.03 7hvp s LYS 70 Cb -0.19 -2.28 0.01 0.00 -0.52 0.00 0.00 37.83 34.85 7hvp s LYS 70 CO 0.08 -0.56 0.55 0.00 -0.92 0.00 0.00 175.35 174.50 7hvp s ALA 71 N -2.94 -0.15 -0.19 5.17 0.00 0.24 -4.80 121.76 119.09 7hvp s ALA 71 Ca 0.52 -0.98 -0.10 0.00 0.00 0.00 0.00 51.96 51.40 7hvp s ALA 71 Cb -0.10 1.01 0.06 0.00 0.00 0.00 0.00 23.12 24.08 7hvp s ALA 71 CO 0.46 -0.88 0.45 -1.50 0.00 0.00 0.00 175.76 174.29 7hvp s ILE 72 N -3.46 -0.02 0.00 0.00 -1.16 -1.26 -0.73 121.20 114.56 7hvp s ILE 72 Ca 0.22 0.08 0.00 0.00 -0.51 0.00 0.00 60.65 60.44 7hvp s ILE 72 Cb -0.02 -0.67 0.00 0.00 0.61 0.00 0.00 42.46 42.38 7hvp s ILE 72 CO 0.12 0.03 0.00 0.61 -2.81 0.00 0.00 174.94 172.89 7hvp n GLY 73 N 4.21 0.54 3.83 1.50 0.00 -0.85 -4.87 105.19 109.55 7hvp n GLY 73 Ca -0.22 -0.71 -0.33 0.00 0.00 0.00 0.00 46.02 44.76 7hvp n GLY 73 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 7hvp s THR 74 N -2.01 4.46 -0.21 2.61 2.01 -1.26 -0.11 115.64 121.13 7hvp s THR 74 Ca 0.00 1.34 -0.10 0.00 0.31 0.00 0.00 61.69 63.24 7hvp s THR 74 Cb 0.00 -3.66 0.07 0.00 0.01 0.00 0.00 72.50 68.92 7hvp s THR 74 CO 0.00 -0.52 0.48 -0.69 -0.69 0.00 0.00 174.62 173.20 7hvp s VAL 75 N -2.42 -0.20 -0.24 3.82 1.01 -0.55 -4.55 120.40 117.27 7hvp s VAL 75 Ca 0.60 0.08 -0.13 0.00 0.00 0.00 0.00 61.98 62.54 7hvp s VAL 75 Cb -0.10 -0.72 -0.04 0.00 0.00 0.00 0.00 36.38 35.52 7hvp s VAL 75 CO 0.23 0.03 0.27 -0.76 0.00 0.00 0.00 175.10 174.87 7hvp s LEU 76 N 1.78 4.10 -0.16 3.92 1.43 -0.65 -1.19 118.68 127.91 7hvp s LEU 76 Ca -0.08 0.24 -0.04 0.00 -1.03 0.00 0.00 54.13 53.22 7hvp s LEU 76 Cb -0.09 -2.28 -0.03 0.00 0.03 0.00 0.00 46.19 43.83 7hvp s LEU 76 CO -0.15 -0.03 -0.03 -0.69 0.23 0.00 0.00 176.35 175.68 7hvp s VAL 77 N 1.38 3.89 0.16 -1.59 1.01 0.56 -0.97 120.40 124.84 7hvp s VAL 77 Ca 0.12 -0.35 -0.24 0.00 0.00 0.00 0.00 61.98 61.50 7hvp s VAL 77 Cb -0.15 -2.71 0.07 0.00 0.00 0.00 0.00 36.38 33.59 7hvp s VAL 77 CO 0.07 0.48 0.98 -0.83 0.00 0.00 0.00 175.10 175.80 7hvp s GLY 78 N 0.50 -0.17 -0.98 4.51 0.00 -0.67 -1.17 107.32 109.35 7hvp s GLY 78 Ca -0.03 0.04 -0.07 0.00 0.00 0.00 0.00 44.72 44.66 7hvp s GLY 78 CO 0.03 0.35 2.78 -1.55 0.00 0.00 0.00 173.10 174.71 7hvp n PRO 79 N -0.51 2.70 -3.34 2.90 -0.04 -1.26 -2.86 135.00 132.59 7hvp n PRO 79 Ca -0.06 -1.61 -0.38 0.00 -0.04 0.00 0.00 63.50 61.41 7hvp n PRO 79 Cb 0.61 -2.46 -0.06 0.00 -0.04 0.00 0.00 33.50 31.55 7hvp n PRO 79 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 7hvp s THR 80 N 2.26 4.82 -2.00 0.52 -1.32 -1.26 -5.00 115.64 113.65 7hvp s THR 80 Ca 0.58 1.11 0.14 0.00 -1.21 0.00 0.00 61.69 62.31 7hvp s THR 80 Cb 0.18 -3.85 0.41 0.00 -1.51 0.00 0.00 72.50 67.74 7hvp s THR 80 CO -0.04 0.56 1.33 -0.81 -2.21 0.00 0.00 174.62 173.45 7hvp n PRO 81 N 1.73 0.66 -3.53 7.08 -0.04 -1.26 -4.49 135.00 135.15 7hvp n PRO 81 Ca -0.11 0.00 -0.16 0.00 -0.04 0.00 0.00 63.50 63.19 7hvp n PRO 81 Cb 0.51 -1.34 -0.05 0.00 -0.04 0.00 0.00 33.50 32.58 7hvp n PRO 81 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 7hvp s VAL 82 N -2.00 0.01 -0.09 0.52 1.01 -1.26 -5.12 120.40 113.46 7hvp s VAL 82 Ca 0.21 -0.06 -0.25 0.00 0.00 0.00 0.00 61.98 61.88 7hvp s VAL 82 Cb 0.10 -0.97 -0.03 0.00 0.00 0.00 0.00 36.38 35.48 7hvp s VAL 82 CO 0.17 -0.04 0.78 0.20 0.00 0.00 0.00 175.10 176.21 7hvp s ASN 83 N -1.55 7.02 -0.10 3.32 0.01 -1.26 -4.58 114.94 117.81 7hvp s ASN 83 Ca -0.09 1.24 0.03 0.00 -0.71 0.00 0.00 52.86 53.33 7hvp s ASN 83 Cb -0.01 -2.45 -0.01 0.00 0.41 0.00 0.00 41.25 39.20 7hvp s ASN 83 CO 0.05 -0.23 -0.18 -0.63 -1.51 0.00 0.00 177.10 174.59 7hvp s ILE 84 N 1.30 2.66 -0.32 0.60 1.01 0.90 0.17 121.20 127.52 7hvp s ILE 84 Ca 0.40 -0.82 -0.09 0.00 0.00 0.00 0.00 60.65 60.14 7hvp s ILE 84 Cb -0.18 -2.06 0.01 0.00 0.01 0.00 0.00 42.46 40.24 7hvp s ILE 84 CO 0.17 0.55 0.14 -0.63 0.00 0.00 0.00 174.94 175.18 7hvp s ILE 85 N 0.06 4.33 0.72 2.92 -1.09 0.09 -1.94 121.20 126.30 7hvp s ILE 85 Ca -0.07 -0.67 -0.03 0.00 -2.23 0.00 0.00 60.65 57.65 7hvp s ILE 85 Cb -0.15 -3.29 0.12 0.00 -1.58 0.00 0.00 42.46 37.56 7hvp s ILE 85 CO 0.05 -0.02 1.00 -0.83 -1.23 0.00 0.00 174.94 173.91 7hvp s GLY 86 N 1.55 1.76 0.00 6.18 0.00 -1.18 -1.14 107.32 114.49 7hvp s GLY 86 Ca 0.03 -1.54 0.11 0.00 0.00 0.00 0.00 44.72 43.32 7hvp s GLY 86 CO 0.05 -1.00 1.32 0.54 0.00 0.00 0.00 173.10 174.00 7hvp n ARG 87 N -2.88 0.03 -0.37 2.90 1.74 0.12 -2.01 116.66 116.19 7hvp n ARG 87 Ca 0.13 0.29 -0.01 0.00 -0.77 0.00 0.00 57.85 57.49 7hvp n ARG 87 Cb 0.60 -1.50 0.12 0.00 -1.02 0.00 0.00 32.46 30.67 7hvp n ARG 87 CO 0.00 0.00 0.00 -2.95 -1.52 0.00 0.00 177.63 173.16 7hvp h ASN 88 N 0.00 1.13 0.00 0.55 -1.07 -1.80 -2.68 115.58 111.71 7hvp h ASN 88 Ca 0.00 -0.03 -0.24 0.00 0.07 0.00 0.00 56.30 56.11 7hvp h ASN 88 Cb 0.16 -0.28 -0.04 0.00 -2.07 0.00 0.00 38.32 36.09 7hvp h ASN 88 CO 0.00 0.81 -2.19 0.18 0.07 0.00 0.00 177.43 176.30 7hvp n LEU 89 N -4.39 0.00 0.10 6.14 4.32 -1.14 -4.37 117.00 117.66 7hvp n LEU 89 Ca 0.12 0.00 0.04 0.00 -0.02 0.00 0.00 56.01 56.15 7hvp n LEU 89 Cb 0.03 0.32 0.45 0.00 -1.62 0.00 0.00 43.42 42.60 7hvp n LEU 89 CO 0.37 0.32 1.04 -0.07 -1.22 0.00 0.00 177.39 177.83 7hvp h LEU 90 N 0.00 0.29 -1.81 2.23 3.38 -1.25 -0.35 115.31 117.80 7hvp h LEU 90 Ca -0.35 -0.03 -0.03 0.00 0.09 0.00 0.00 57.88 57.57 7hvp h LEU 90 Cb 1.78 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 42.45 7hvp h LEU 90 CO 0.02 0.29 -0.14 0.71 0.09 0.00 0.00 178.44 179.41 7hvp h THR 91 N 0.32 0.59 0.00 0.22 1.35 -1.68 -2.89 112.91 110.83 7hvp h THR 91 Ca 0.08 -0.61 -0.12 0.00 -0.55 0.00 0.00 66.41 65.21 7hvp h THR 91 Cb 0.11 1.40 -0.02 0.00 -1.73 0.00 0.00 68.15 67.91 7hvp h THR 91 CO -0.01 0.14 -0.80 1.56 -0.25 0.00 0.00 175.52 176.16 7hvp h GLN 92 N 0.00 0.00 0.00 4.72 4.20 -1.27 -3.31 115.11 119.45 7hvp h GLN 92 Ca -0.00 0.00 -0.18 0.00 0.06 0.00 0.00 58.65 58.53 7hvp h GLN 92 Cb 0.39 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.14 7hvp h GLN 92 CO 0.02 0.39 -1.29 -0.84 -0.67 0.00 0.00 178.83 176.44 7hvp h ILE 93 N 0.00 0.68 0.00 2.54 3.07 -1.49 -3.49 117.51 118.82 7hvp h ILE 93 Ca -0.05 -2.22 0.00 0.00 1.55 0.00 0.00 64.86 64.14 7hvp h ILE 93 Cb 1.41 2.20 0.00 0.00 -0.27 0.00 0.00 36.82 40.16 7hvp h ILE 93 CO 0.05 0.39 0.00 0.61 -1.05 0.00 0.00 178.15 178.15 7hvp n GLY 94 N 1.39 1.36 0.00 0.16 0.00 -1.10 -5.11 105.19 101.88 7hvp n GLY 94 Ca -0.08 -1.10 0.00 0.00 0.00 0.00 0.00 46.02 44.83 7hvp n GLY 94 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 7hvp n THR 96 N 2.59 0.00 -3.48 2.61 -1.04 -1.26 -5.06 114.28 108.64 7hvp n THR 96 Ca 0.00 0.00 -0.37 0.00 -2.04 0.00 0.00 64.05 61.64 7hvp n THR 96 Cb 0.00 0.00 -0.07 0.00 -1.82 0.00 0.00 70.33 68.44 7hvp n THR 96 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 7hvp s LEU 97 N 0.00 4.20 -0.08 -4.42 2.01 -1.26 -5.08 118.68 114.05 7hvp s LEU 97 Ca 0.00 0.48 0.00 0.00 0.01 0.00 0.00 54.13 54.62 7hvp s LEU 97 Cb 0.00 -2.41 0.02 0.00 0.01 0.00 0.00 46.19 43.81 7hvp s LEU 97 CO 0.00 0.02 -0.05 0.20 1.01 0.00 0.00 176.35 177.53 7hvp s ASN 98 N 0.77 1.62 0.00 2.29 -0.87 -1.26 -5.30 114.94 112.19 7hvp s ASN 98 Ca 0.17 -0.19 0.00 0.00 -1.57 0.00 0.00 52.86 51.27 7hvp s ASN 98 Cb -0.14 -0.61 0.00 0.00 -0.02 0.00 0.00 41.25 40.48 7hvp s ASN 98 CO 0.06 -0.11 0.00 2.22 -2.57 0.00 0.00 177.10 176.70