#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 3.30 0.00 -0.52 0.74 -1.26 -5.08 119.66 116.85 7hvp s GLN 2 Ca 0.00 -0.33 0.05 0.00 0.05 0.00 0.00 55.36 55.13 7hvp s GLN 2 Cb 0.00 -2.97 -0.02 0.00 1.10 0.00 0.00 33.01 31.13 7hvp s GLN 2 CO 0.00 0.62 -0.16 0.42 -0.55 0.00 0.00 175.29 175.62 7hvp s ILE 3 N -0.63 1.27 0.26 -2.34 1.01 -1.26 -5.14 121.20 114.36 7hvp s ILE 3 Ca 0.11 -0.78 0.09 0.00 0.00 0.00 0.00 60.65 60.06 7hvp s ILE 3 Cb -0.12 -1.08 -0.04 0.00 0.01 0.00 0.00 42.46 41.23 7hvp s ILE 3 CO 0.02 0.28 0.06 0.42 0.00 0.00 0.00 174.94 175.73 7hvp s THR 4 N -0.49 3.78 -0.44 2.92 -4.23 -1.26 -5.08 115.64 110.85 7hvp s THR 4 Ca 0.06 -1.72 0.16 0.00 -1.18 0.00 0.00 61.69 59.00 7hvp s THR 4 Cb -0.07 -3.02 0.62 0.00 1.34 0.00 0.00 72.50 71.37 7hvp s THR 4 CO -0.00 -0.35 1.53 0.18 -0.54 0.00 0.00 174.62 175.44 7hvp n LEU 5 N -0.94 4.45 -0.06 4.79 4.77 -1.26 -4.35 117.00 124.40 7hvp n LEU 5 Ca -0.07 -2.79 -0.00 0.00 -0.03 0.00 0.00 56.01 53.12 7hvp n LEU 5 Cb 0.58 -0.56 0.29 0.00 -2.33 0.00 0.00 43.42 41.40 7hvp n LEU 5 CO 0.41 0.69 1.03 -0.50 -1.33 0.00 0.00 177.39 177.69 7hvp h TRP 6 N 2.81 0.67 -1.32 -1.77 4.06 -2.07 -3.42 115.95 114.91 7hvp h TRP 6 Ca 0.00 -0.04 -0.58 0.00 2.06 0.00 0.00 58.89 60.33 7hvp h TRP 6 Cb 1.52 -0.21 -0.09 0.00 -1.00 0.00 0.00 29.16 29.39 7hvp h TRP 6 CO 0.68 0.55 -0.48 -0.65 -3.56 0.00 0.00 178.44 174.98 7hvp s GLN 7 N -5.25 2.21 0.17 0.49 -0.21 -1.26 -5.10 119.66 110.71 7hvp s GLN 7 Ca -0.09 -1.94 -0.31 0.00 0.02 0.00 0.00 55.36 53.05 7hvp s GLN 7 Cb 0.16 -1.93 -0.08 0.00 1.00 0.00 0.00 33.01 32.15 7hvp s GLN 7 CO 0.77 -0.21 1.36 1.03 -2.12 0.00 0.00 175.29 176.12 7hvp s ARG 8 N -3.94 4.35 -0.16 2.91 0.52 -1.26 -4.87 118.95 116.49 7hvp s ARG 8 Ca 0.36 2.09 -0.02 0.00 -0.52 0.00 0.00 55.73 57.63 7hvp s ARG 8 Cb 0.03 -3.21 -0.02 0.00 0.52 0.00 0.00 34.95 32.27 7hvp s ARG 8 CO 0.20 -0.35 1.21 -2.30 0.02 0.00 0.00 175.30 174.09 7hvp n PRO 9 N 3.19 0.36 -3.65 3.54 -0.02 -1.26 -4.87 135.00 132.29 7hvp n PRO 9 Ca 0.09 -0.69 -0.36 0.00 -2.02 0.00 0.00 63.50 60.51 7hvp n PRO 9 Cb 0.42 -2.10 -0.09 0.00 -0.02 0.00 0.00 33.50 31.71 7hvp n PRO 9 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 7hvp s LEU 10 N 0.03 4.15 0.13 2.45 1.02 -1.26 -1.60 118.68 123.59 7hvp s LEU 10 Ca 0.10 0.20 0.04 0.00 0.02 0.00 0.00 54.13 54.49 7hvp s LEU 10 Cb 0.02 -2.15 -0.04 0.00 0.02 0.00 0.00 46.19 44.04 7hvp s LEU 10 CO 0.01 0.08 -0.10 0.54 0.02 0.00 0.00 176.35 176.90 7hvp s VAL 11 N 0.89 1.12 -0.05 -1.59 0.11 -0.23 -4.95 120.40 115.70 7hvp s VAL 11 Ca 0.09 -1.96 -0.22 0.00 -2.93 0.00 0.00 61.98 56.96 7hvp s VAL 11 Cb -0.13 -1.73 -0.04 0.00 -1.53 0.00 0.00 36.38 32.95 7hvp s VAL 11 CO 0.03 -0.69 0.66 -0.89 -3.33 0.00 0.00 175.10 170.88 7hvp s THR 12 N -3.09 5.01 0.08 5.04 2.01 -1.26 -0.24 115.64 123.20 7hvp s THR 12 Ca 0.14 1.36 0.08 0.00 0.31 0.00 0.00 61.69 63.58 7hvp s THR 12 Cb 0.01 -4.00 -0.03 0.00 0.01 0.00 0.00 72.50 68.49 7hvp s THR 12 CO 0.00 0.30 -0.22 0.27 -0.69 0.00 0.00 174.62 174.29 7hvp s ILE 13 N 0.52 1.77 -0.19 1.82 -4.36 0.16 -4.66 121.20 116.26 7hvp s ILE 13 Ca 0.35 -1.40 -0.03 0.00 -0.26 0.00 0.00 60.65 59.30 7hvp s ILE 13 Cb -0.18 -1.57 -0.01 0.00 1.25 0.00 0.00 42.46 41.95 7hvp s ILE 13 CO 0.17 0.09 -0.06 -0.13 0.24 0.00 0.00 174.94 175.26 7hvp s ARG 14 N -1.56 3.46 -0.48 0.37 0.52 0.59 -1.08 118.95 120.76 7hvp s ARG 14 Ca 0.08 -0.61 0.03 0.00 -0.52 0.00 0.00 55.73 54.71 7hvp s ARG 14 Cb -0.09 -2.91 0.15 0.00 0.52 0.00 0.00 34.95 32.62 7hvp s ARG 14 CO 0.03 -0.00 0.32 -1.50 0.02 0.00 0.00 175.30 174.17 7hvp s ILE 15 N 0.96 1.28 -0.50 1.52 2.07 -0.46 0.14 121.20 126.20 7hvp s ILE 15 Ca -0.00 -2.88 -0.26 0.00 -1.41 0.00 0.00 60.65 56.10 7hvp s ILE 15 Cb -0.15 -1.88 0.04 0.00 0.13 0.00 0.00 42.46 40.61 7hvp s ILE 15 CO 0.00 -1.03 0.64 0.61 -1.91 0.00 0.00 174.94 173.25 7hvp n GLY 16 N 3.04 -0.53 2.93 1.50 0.00 -1.26 -3.19 105.19 107.68 7hvp n GLY 16 Ca 0.18 1.10 0.00 0.00 0.00 0.00 0.00 46.02 47.30 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 -0.46 2.56 3.62 -0.02 0.00 -1.26 -5.01 105.19 104.62 7hvp n GLY 17 Ca -0.04 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.66 7hvp n GLY 17 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 7hvp s GLN 18 N -0.02 2.57 -0.15 1.61 -1.52 -1.19 -5.11 119.66 115.85 7hvp s GLN 18 Ca 0.00 -0.73 -0.04 0.00 -1.95 0.00 0.00 55.36 52.64 7hvp s GLN 18 Cb 0.00 -2.53 -0.03 0.00 -0.22 0.00 0.00 33.01 30.23 7hvp s GLN 18 CO 0.00 0.59 -0.02 -0.51 -0.25 0.00 0.00 175.29 175.10 7hvp s LEU 19 N -1.60 3.35 0.11 2.90 2.01 -1.26 -1.36 118.68 122.84 7hvp s LEU 19 Ca 0.19 -0.07 0.01 0.00 0.01 0.00 0.00 54.13 54.27 7hvp s LEU 19 Cb -0.11 -1.81 -0.04 0.00 0.01 0.00 0.00 46.19 44.24 7hvp s LEU 19 CO 0.10 0.20 -0.04 -0.54 1.01 0.00 0.00 176.35 177.08 7hvp s LYS 20 N 0.18 0.87 -0.25 1.70 -0.14 -0.24 -4.99 119.74 116.88 7hvp s LYS 20 Ca -0.01 -1.37 -0.01 0.00 -1.36 0.00 0.00 55.97 53.22 7hvp s LYS 20 Cb -0.13 -0.13 0.03 0.00 -1.68 0.00 0.00 37.83 35.92 7hvp s LYS 20 CO 0.02 -0.07 -0.07 -2.00 -0.76 0.00 0.00 175.35 172.47 7hvp s GLU 21 N -3.88 2.78 0.05 1.68 2.56 -1.26 0.39 118.70 121.01 7hvp s GLU 21 Ca 0.15 -1.01 -0.00 0.00 0.00 0.00 0.00 54.97 54.10 7hvp s GLU 21 Cb 0.06 -2.97 -0.03 0.00 2.00 0.00 0.00 34.13 33.18 7hvp s GLU 21 CO -0.03 -0.42 -0.04 0.00 -0.56 0.00 0.00 175.26 174.22 7hvp s ALA 22 N 1.30 0.46 -0.11 6.30 0.00 0.67 -4.45 121.76 125.93 7hvp s ALA 22 Ca -0.01 -1.04 -0.19 0.00 0.00 0.00 0.00 51.96 50.72 7hvp s ALA 22 Cb -0.17 0.22 -0.04 0.00 0.00 0.00 0.00 23.12 23.13 7hvp s ALA 22 CO -0.05 -0.29 0.50 -1.17 0.00 0.00 0.00 175.76 174.76 7hvp s LEU 23 N -2.50 4.28 -0.89 0.00 2.96 0.41 -1.07 118.68 121.88 7hvp s LEU 23 Ca 0.01 0.85 -0.25 0.00 -0.22 0.00 0.00 54.13 54.52 7hvp s LEU 23 Cb 0.02 -2.73 0.02 0.00 0.50 0.00 0.00 46.19 44.00 7hvp s LEU 23 CO -0.07 -0.01 1.51 -0.76 -1.32 0.00 0.00 176.35 175.71 7hvp s LEU 24 N 0.64 3.34 -0.53 -0.68 1.02 -0.63 -0.56 118.68 121.28 7hvp s LEU 24 Ca 0.27 -0.91 -0.08 0.00 0.02 0.00 0.00 54.13 53.43 7hvp s LEU 24 Cb -0.15 -2.56 0.14 0.00 0.02 0.00 0.00 46.19 43.63 7hvp s LEU 24 CO 0.11 -1.86 0.39 -0.62 0.02 0.00 0.00 176.35 174.39 7hvp s ASP 25 N 5.37 5.69 0.00 2.29 2.15 -0.99 -4.87 116.67 126.31 7hvp s ASP 25 Ca 0.48 -2.16 0.24 0.00 0.43 0.00 0.00 52.55 51.54 7hvp s ASP 25 Cb -0.04 -1.99 1.10 0.00 -0.30 0.00 0.00 42.92 41.69 7hvp s ASP 25 CO 0.01 -0.61 1.78 0.35 -0.17 0.00 0.00 175.17 176.52 7hvp n THR 26 N 4.55 0.31 1.50 1.71 -2.24 -1.26 -2.43 114.28 116.42 7hvp n THR 26 Ca -0.03 0.08 0.14 0.00 -2.27 0.00 0.00 64.05 61.97 7hvp n THR 26 Cb 0.41 -0.67 0.53 0.00 -2.10 0.00 0.00 70.33 68.50 7hvp n THR 26 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 7hvp n GLY 27 N 0.89 -0.07 3.36 3.38 0.00 -1.26 -4.80 105.19 106.69 7hvp n GLY 27 Ca 0.08 -0.43 -0.33 0.00 0.00 0.00 0.00 46.02 45.34 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 -2.03 2.60 0.09 4.61 0.00 -1.02 -5.04 121.76 120.97 7hvp s ALA 28 Ca 0.38 -0.89 -0.12 0.00 0.00 0.00 0.00 51.96 51.33 7hvp s ALA 28 Cb 0.21 -1.19 -0.19 0.00 0.00 0.00 0.00 23.12 21.94 7hvp s ALA 28 CO 0.35 0.25 1.23 -0.44 0.00 0.00 0.00 175.76 177.15 7hvp h ASP 29 N 6.70 0.85 -0.44 0.00 3.32 -1.87 -0.27 116.42 124.71 7hvp h ASP 29 Ca -0.25 -0.66 -0.64 0.00 0.02 0.00 0.00 57.03 55.50 7hvp h ASP 29 Cb 1.21 -0.26 -0.09 0.00 0.22 0.00 0.00 39.33 40.41 7hvp h ASP 29 CO 0.55 1.46 -0.42 -1.81 -1.72 0.00 0.00 179.24 177.31 7hvp s ASP 30 N -7.23 4.36 -0.22 6.45 1.01 -1.26 -3.00 116.67 116.79 7hvp s ASP 30 Ca -0.09 -1.47 -0.04 0.00 0.71 0.00 0.00 52.55 51.66 7hvp s ASP 30 Cb 0.07 0.49 -0.01 0.00 1.01 0.00 0.00 42.92 44.48 7hvp s ASP 30 CO 0.91 -0.98 -0.04 -0.89 0.21 0.00 0.00 175.17 174.38 7hvp s THR 31 N -2.83 3.40 -0.12 -1.27 2.01 -1.26 -1.86 115.64 113.71 7hvp s THR 31 Ca 0.18 -0.48 0.03 0.00 0.31 0.00 0.00 61.69 61.73 7hvp s THR 31 Cb -0.00 -2.54 0.01 0.00 0.01 0.00 0.00 72.50 69.97 7hvp s THR 31 CO 0.11 0.43 -0.22 0.54 -0.69 0.00 0.00 174.62 174.78 7hvp s VAL 32 N 1.43 2.00 0.15 3.82 0.11 -0.67 0.26 120.40 127.50 7hvp s VAL 32 Ca 0.05 -0.96 0.07 0.00 -2.93 0.00 0.00 61.98 58.21 7hvp s VAL 32 Cb -0.14 -1.75 -0.04 0.00 -1.53 0.00 0.00 36.38 32.92 7hvp s VAL 32 CO -0.03 0.54 -0.01 -0.76 -3.33 0.00 0.00 175.10 171.51 7hvp s LEU 33 N 0.59 3.30 0.60 2.54 1.02 0.26 0.33 118.68 127.32 7hvp s LEU 33 Ca -0.13 -0.36 -0.19 0.00 0.02 0.00 0.00 54.13 53.47 7hvp s LEU 33 Cb -0.17 -1.99 -0.03 0.00 0.02 0.00 0.00 46.19 44.02 7hvp s LEU 33 CO 0.04 0.12 1.24 -1.83 0.02 0.00 0.00 176.35 175.93 7hvp s GLU 34 N -2.73 2.92 -0.35 1.70 -1.05 -1.25 -0.74 118.70 117.19 7hvp s GLU 34 Ca 0.26 1.91 -0.38 0.00 -0.15 0.00 0.00 54.97 56.61 7hvp s GLU 34 Cb -0.10 -1.95 -0.13 0.00 -0.44 0.00 0.00 34.13 31.51 7hvp s GLU 34 CO 0.18 -1.27 2.08 -1.91 0.95 0.00 0.00 175.26 175.29 7hvp n GLU 35 N -1.58 0.96 -4.19 -4.83 0.00 -1.15 -4.66 120.64 105.18 7hvp n GLU 35 Ca 0.14 0.29 -0.12 0.00 0.00 0.00 0.00 57.16 57.46 7hvp n GLU 35 Cb 0.49 -2.24 -0.10 0.00 0.00 0.00 0.00 31.44 29.59 7hvp n GLU 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 7hvp s MET 36 N 5.56 1.25 -0.13 5.31 0.23 -1.26 -5.05 119.30 125.22 7hvp s MET 36 Ca 1.08 -1.63 -0.03 0.00 -1.03 0.00 0.00 55.69 54.08 7hvp s MET 36 Cb -1.00 0.29 -0.03 0.00 -1.53 0.00 0.00 34.83 32.56 7hvp s MET 36 CO 0.55 -0.42 -0.02 -0.80 -2.03 0.00 0.00 175.02 172.30 7hvp s ASN 37 N -3.16 4.97 -0.03 -1.18 -0.87 -1.26 -5.03 114.94 108.37 7hvp s ASN 37 Ca 0.38 -0.03 0.02 0.00 -1.57 0.00 0.00 52.86 51.67 7hvp s ASN 37 Cb 0.06 -1.64 0.01 0.00 -0.02 0.00 0.00 41.25 39.66 7hvp s ASN 37 CO 0.13 0.25 -0.09 -0.76 -2.57 0.00 0.00 177.10 174.06 7hvp s LEU 38 N -0.10 1.70 0.52 0.60 1.43 -1.26 -5.13 118.68 116.44 7hvp s LEU 38 Ca 0.03 -0.19 -0.21 0.00 -1.03 0.00 0.00 54.13 52.73 7hvp s LEU 38 Cb -0.13 -0.57 -0.07 0.00 0.03 0.00 0.00 46.19 45.44 7hvp s LEU 38 CO 0.02 0.04 0.98 -0.81 0.23 0.00 0.00 176.35 176.82 7hvp n PRO 39 N 3.47 1.13 0.00 1.29 -0.04 -1.26 -4.86 135.00 134.72 7hvp n PRO 39 Ca -0.20 0.42 0.00 0.00 -0.04 0.00 0.00 63.50 63.68 7hvp n PRO 39 Cb 0.53 -2.12 0.00 0.00 -0.04 0.00 0.00 33.50 31.88 7hvp n PRO 39 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 7hvp n GLY 40 N 1.24 1.85 3.80 0.55 0.00 -1.26 -5.02 105.19 106.35 7hvp n GLY 40 Ca 0.11 -2.07 -0.34 0.00 0.00 0.00 0.00 46.02 43.72 7hvp n GLY 40 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 7hvp s LYS 41 N -1.96 3.77 0.06 1.61 -0.14 -1.26 -5.06 119.74 116.75 7hvp s LYS 41 Ca 0.00 1.38 0.03 0.00 -1.36 0.00 0.00 55.97 56.02 7hvp s LYS 41 Cb 0.00 -2.09 -0.03 0.00 -1.68 0.00 0.00 37.83 34.03 7hvp s LYS 41 CO 0.00 -0.46 -0.09 1.67 -0.76 0.00 0.00 175.35 175.71 7hvp s TRP 42 N -1.96 0.83 0.01 3.18 1.48 -1.26 -4.68 118.94 116.53 7hvp s TRP 42 Ca 0.68 -0.54 0.06 0.00 -1.06 0.00 0.00 56.10 55.24 7hvp s TRP 42 Cb -0.17 -0.48 -0.03 0.00 -1.16 0.00 0.00 33.47 31.63 7hvp s TRP 42 CO 0.20 -0.05 -0.19 -1.59 -4.06 0.00 0.00 176.95 171.26 7hvp s LYS 43 N -1.89 2.19 -0.14 3.25 -2.85 -0.76 -4.87 119.74 114.68 7hvp s LYS 43 Ca -0.05 -0.90 -0.29 0.00 -1.00 0.00 0.00 55.97 53.72 7hvp s LYS 43 Cb -0.08 -2.21 -0.01 0.00 -2.06 0.00 0.00 37.83 33.47 7hvp s LYS 43 CO 0.00 0.57 1.02 -2.14 0.10 0.00 0.00 175.35 174.90 7hvp s PRO 44 N -1.09 4.38 0.45 1.78 0.02 -1.26 0.13 135.00 139.41 7hvp s PRO 44 Ca 0.13 1.39 0.03 0.00 0.02 0.00 0.00 61.00 62.57 7hvp s PRO 44 Cb -0.10 -3.57 -0.02 0.00 0.02 0.00 0.00 34.50 30.83 7hvp s PRO 44 CO 0.03 -0.40 0.08 0.15 -0.33 0.00 0.00 177.00 176.53 7hvp s LYS 45 N 2.33 2.05 -0.27 5.54 3.01 -0.36 -4.91 119.74 127.12 7hvp s LYS 45 Ca 0.47 -2.28 -0.03 0.00 -1.01 0.00 0.00 55.97 53.12 7hvp s LYS 45 Cb -0.18 -0.96 0.09 0.00 -1.01 0.00 0.00 37.83 35.78 7hvp s LYS 45 CO 0.15 -0.44 0.11 1.41 0.51 0.00 0.00 175.35 177.09 7hvp s MET 46 N -3.77 0.31 0.36 1.68 1.75 -1.26 0.27 119.30 118.64 7hvp s MET 46 Ca 0.16 -0.58 0.07 0.00 -1.25 0.00 0.00 55.69 54.09 7hvp s MET 46 Cb 0.02 -1.47 -0.00 0.00 2.84 0.00 0.00 34.83 36.21 7hvp s MET 46 CO 0.10 -0.95 0.50 0.96 -0.65 0.00 0.00 175.02 174.99 7hvp s ILE 47 N 1.99 3.78 0.06 10.11 -4.36 -1.03 -4.94 121.20 126.81 7hvp s ILE 47 Ca 0.08 -0.99 0.03 0.00 -0.26 0.00 0.00 60.65 59.51 7hvp s ILE 47 Cb -0.16 -3.30 -0.03 0.00 1.25 0.00 0.00 42.46 40.22 7hvp s ILE 47 CO -0.29 -0.12 -0.09 -0.83 0.24 0.00 0.00 174.94 173.85 7hvp s GLY 48 N -4.22 0.65 0.00 6.27 0.00 -1.26 -1.75 107.32 107.00 7hvp s GLY 48 Ca 0.48 -0.93 0.00 0.00 0.00 0.00 0.00 44.72 44.27 7hvp s GLY 48 CO 0.32 -0.99 0.00 0.61 0.00 0.00 0.00 173.10 173.04 7hvp n GLY 49 N 1.14 5.75 0.36 0.20 0.00 -0.28 -4.96 105.19 107.40 7hvp n GLY 49 Ca -0.20 -1.78 -0.03 0.00 0.00 0.00 0.00 46.02 44.01 7hvp n GLY 49 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 7hvp h ILE 50 N 0.31 1.24 0.00 -0.61 3.07 -2.02 -3.12 117.51 116.39 7hvp h ILE 50 Ca 0.00 -0.46 0.00 0.00 1.55 0.00 0.00 64.86 65.95 7hvp h ILE 50 Cb 0.00 -0.13 0.00 0.00 -0.27 0.00 0.00 36.82 36.42 7hvp h ILE 50 CO 0.00 0.24 0.00 1.23 -1.05 0.00 0.00 178.15 178.57 7hvp h GLY 51 N 1.27 0.00 0.00 0.16 0.00 -2.03 -3.49 103.07 98.98 7hvp h GLY 51 Ca 0.34 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.67 7hvp h GLY 51 CO -0.07 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.08 7hvp n GLY 52 N -0.23 0.67 3.86 4.60 0.00 -1.18 -5.11 105.19 107.80 7hvp n GLY 52 Ca 0.00 -2.11 -0.31 0.00 0.00 0.00 0.00 46.02 43.60 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 -1.19 3.43 0.02 1.61 0.40 -1.26 -1.13 117.98 119.86 7hvp s PHE 53 Ca 0.00 1.15 -0.02 0.00 -0.60 0.00 0.00 56.93 57.45 7hvp s PHE 53 Cb 0.00 -2.51 -0.01 0.00 0.51 0.00 0.00 43.02 41.01 7hvp s PHE 53 CO 0.00 -0.05 0.03 0.96 0.70 0.00 0.00 175.22 176.86 7hvp s ILE 54 N -2.24 0.10 0.01 0.64 -4.36 -0.72 -4.99 121.20 109.65 7hvp s ILE 54 Ca 0.53 -0.87 -0.21 0.00 -0.26 0.00 0.00 60.65 59.84 7hvp s ILE 54 Cb -0.10 -0.36 -0.05 0.00 1.25 0.00 0.00 42.46 43.19 7hvp s ILE 54 CO 0.26 -0.48 0.63 -0.75 0.24 0.00 0.00 174.94 174.84 7hvp s LYS 55 N -1.52 4.34 0.37 0.37 2.20 -1.26 -2.46 119.74 121.78 7hvp s LYS 55 Ca -0.15 0.80 0.01 0.00 -0.36 0.00 0.00 55.97 56.27 7hvp s LYS 55 Cb -0.09 -3.34 -0.01 0.00 -1.51 0.00 0.00 37.83 32.89 7hvp s LYS 55 CO -0.00 0.37 0.05 1.33 -0.36 0.00 0.00 175.35 176.74 7hvp n VAL 56 N 2.67 0.00 -3.69 4.02 0.24 0.75 -4.68 118.33 117.63 7hvp n VAL 56 Ca -0.06 -1.91 -0.27 0.00 -2.04 0.00 0.00 64.34 60.06 7hvp n VAL 56 Cb 0.51 0.52 -0.17 0.00 -1.47 0.00 0.00 33.84 33.23 7hvp n VAL 56 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 7hvp s ARG 57 N -3.36 0.42 -0.33 7.34 1.70 -0.67 -1.22 118.95 122.82 7hvp s ARG 57 Ca 0.07 -0.25 -0.26 0.00 -0.47 0.00 0.00 55.73 54.82 7hvp s ARG 57 Cb 0.00 -1.92 0.01 0.00 -0.57 0.00 0.00 34.95 32.48 7hvp s ARG 57 CO 0.05 -0.63 0.95 -1.14 -1.08 0.00 0.00 175.30 173.45 7hvp s GLN 58 N 1.97 3.96 -0.23 3.89 0.74 0.35 -2.85 119.66 127.50 7hvp s GLN 58 Ca 0.01 0.77 -0.03 0.00 0.05 0.00 0.00 55.36 56.16 7hvp s GLN 58 Cb -0.16 -3.76 0.01 0.00 1.10 0.00 0.00 33.01 30.20 7hvp s GLN 58 CO -0.08 -0.86 -0.06 0.71 -0.55 0.00 0.00 175.29 174.45 7hvp s TYR 59 N 3.40 2.97 0.46 1.67 2.02 -0.92 -1.82 117.35 125.13 7hvp s TYR 59 Ca 0.39 -1.21 -0.09 0.00 -0.37 0.00 0.00 57.07 55.79 7hvp s TYR 59 Cb -0.13 -2.08 -0.05 0.00 -0.40 0.00 0.00 41.96 39.30 7hvp s TYR 59 CO 0.16 -0.64 0.82 -0.51 -1.57 0.00 0.00 175.55 173.81 7hvp s ASP 60 N 1.41 6.42 0.00 2.29 1.01 -1.26 -1.84 116.67 124.70 7hvp s ASP 60 Ca 0.04 1.14 0.00 0.00 0.71 0.00 0.00 52.55 54.44 7hvp s ASP 60 Cb -0.15 -2.33 0.00 0.00 1.01 0.00 0.00 42.92 41.45 7hvp s ASP 60 CO -0.05 -0.52 0.00 0.00 0.21 0.00 0.00 175.17 174.81 7hvp n GLN 61 N -1.77 0.00 -4.52 8.23 10.64 -1.24 -4.88 117.38 123.85 7hvp n GLN 61 Ca 0.03 0.00 -0.33 0.00 -1.83 0.00 0.00 57.00 54.86 7hvp n GLN 61 Cb 0.54 0.00 -0.15 0.00 -0.86 0.00 0.00 30.24 29.77 7hvp n GLN 61 CO 0.00 0.00 0.00 0.42 -1.83 0.00 0.00 177.06 175.65 7hvp s ILE 62 N -0.22 2.85 -0.03 -0.39 -1.09 -1.08 -4.79 121.20 116.45 7hvp s ILE 62 Ca 0.00 -0.71 -0.30 0.00 -2.23 0.00 0.00 60.65 57.41 7hvp s ILE 62 Cb 0.00 -2.21 -0.04 0.00 -1.58 0.00 0.00 42.46 38.63 7hvp s ILE 62 CO 0.00 0.51 1.25 -2.84 -1.23 0.00 0.00 174.94 172.63 7hvp s PRO 63 N 0.77 4.34 0.09 2.79 0.02 -1.26 -1.33 135.00 140.41 7hvp s PRO 63 Ca -0.05 1.76 0.07 0.00 0.02 0.00 0.00 61.00 62.79 7hvp s PRO 63 Cb -0.15 -3.54 -0.03 0.00 0.02 0.00 0.00 34.50 30.79 7hvp s PRO 63 CO 0.01 -0.46 -0.19 0.08 -0.33 0.00 0.00 177.00 176.11 7hvp s VAL 64 N 2.17 1.50 -0.25 3.83 1.01 -0.69 -4.53 120.40 123.44 7hvp s VAL 64 Ca 0.58 -1.43 -0.02 0.00 0.00 0.00 0.00 61.98 61.12 7hvp s VAL 64 Cb -0.27 -1.38 0.03 0.00 0.00 0.00 0.00 36.38 34.76 7hvp s VAL 64 CO 0.24 -0.09 -0.06 -0.70 0.00 0.00 0.00 175.10 174.49 7hvp s GLU 65 N -1.78 2.80 -0.30 2.72 2.12 0.12 -2.58 118.70 121.80 7hvp s GLU 65 Ca 0.04 -1.00 0.10 0.00 0.36 0.00 0.00 54.97 54.47 7hvp s GLU 65 Cb -0.10 -3.00 0.59 0.00 0.26 0.00 0.00 34.13 31.88 7hvp s GLU 65 CO 0.03 -0.42 1.60 -0.89 -0.54 0.00 0.00 175.26 175.04 7hvp n ILE 66 N 4.66 2.68 0.00 -3.70 -0.00 -1.26 -0.30 119.36 121.43 7hvp n ILE 66 Ca -0.16 -2.19 0.00 0.00 -0.00 0.00 0.00 62.75 60.39 7hvp n ILE 66 Cb 0.47 -0.34 0.00 0.00 -0.00 0.00 0.00 39.64 39.77 7hvp n ILE 66 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 7hvp n GLY 68 N -0.79 0.00 3.83 7.39 0.00 -1.26 -4.80 105.19 109.56 7hvp n GLY 68 Ca 0.36 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 46.02 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 3.56 0.10 1.61 3.76 -1.26 -5.06 115.29 118.00 7hvp s HIS 69 Ca 0.00 0.54 -0.16 0.00 -0.15 0.00 0.00 55.06 55.29 7hvp s HIS 69 Cb 0.00 -2.05 -0.07 0.00 1.11 0.00 0.00 32.58 31.58 7hvp s HIS 69 CO 0.00 0.60 0.53 0.15 -0.85 0.00 0.00 174.74 175.17 7hvp s LYS 70 N -0.64 4.04 0.10 1.40 -0.14 -1.26 -4.37 119.74 118.86 7hvp s LYS 70 Ca 0.14 0.55 -0.06 0.00 -1.36 0.00 0.00 55.97 55.25 7hvp s LYS 70 Cb -0.12 -3.08 -0.02 0.00 -1.68 0.00 0.00 37.83 32.93 7hvp s LYS 70 CO 0.04 0.57 0.13 0.00 -0.76 0.00 0.00 175.35 175.33 7hvp s ALA 71 N -1.29 0.18 -0.20 5.17 0.00 -1.07 -4.50 121.76 120.06 7hvp s ALA 71 Ca 0.33 -0.96 -0.05 0.00 0.00 0.00 0.00 51.96 51.28 7hvp s ALA 71 Cb -0.17 0.57 0.10 0.00 0.00 0.00 0.00 23.12 23.62 7hvp s ALA 71 CO 0.18 -0.50 0.36 0.42 0.00 0.00 0.00 175.76 176.22 7hvp s ILE 72 N -3.93 -0.57 -0.01 0.00 1.01 -1.26 -1.70 121.20 114.75 7hvp s ILE 72 Ca 0.11 0.11 -0.03 0.00 0.00 0.00 0.00 60.65 60.85 7hvp s ILE 72 Cb 0.06 -0.66 0.01 0.00 0.01 0.00 0.00 42.46 41.88 7hvp s ILE 72 CO -0.06 0.01 0.12 0.61 0.00 0.00 0.00 174.94 175.62 7hvp n GLY 73 N 5.37 0.39 3.77 6.18 0.00 -0.44 -4.82 105.19 115.64 7hvp n GLY 73 Ca -0.06 -0.82 -0.41 0.00 0.00 0.00 0.00 46.02 44.73 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 -2.02 2.19 -0.19 2.61 2.01 -1.26 -2.64 115.64 116.35 7hvp s THR 74 Ca 0.03 0.19 -0.08 0.00 0.31 0.00 0.00 61.69 62.14 7hvp s THR 74 Cb -0.00 -3.12 0.08 0.00 0.01 0.00 0.00 72.50 69.47 7hvp s THR 74 CO -0.00 0.04 0.42 -0.69 -0.69 0.00 0.00 174.62 173.70 7hvp s VAL 75 N -1.15 -0.42 -0.02 3.82 1.01 -0.77 -4.55 120.40 118.32 7hvp s VAL 75 Ca 0.54 0.14 0.04 0.00 0.00 0.00 0.00 61.98 62.70 7hvp s VAL 75 Cb -0.44 -0.65 -0.03 0.00 0.00 0.00 0.00 36.38 35.26 7hvp s VAL 75 CO 0.59 0.06 -0.12 -0.76 0.00 0.00 0.00 175.10 174.87 7hvp s LEU 76 N 2.17 2.88 0.00 3.92 1.43 0.14 -2.17 118.68 127.05 7hvp s LEU 76 Ca -0.05 -0.21 0.05 0.00 -1.03 0.00 0.00 54.13 52.89 7hvp s LEU 76 Cb -0.11 -1.64 -0.01 0.00 0.03 0.00 0.00 46.19 44.46 7hvp s LEU 76 CO -0.13 0.31 -0.14 0.68 0.23 0.00 0.00 176.35 177.30 7hvp s VAL 77 N -0.86 1.12 0.00 -1.59 -7.23 -1.13 0.92 120.40 111.63 7hvp s VAL 77 Ca 0.14 -0.72 0.00 0.00 -1.81 0.00 0.00 61.98 59.59 7hvp s VAL 77 Cb -0.11 -0.96 0.00 0.00 0.56 0.00 0.00 36.38 35.88 7hvp s VAL 77 CO 0.04 0.23 0.00 0.61 -0.31 0.00 0.00 175.10 175.67 7hvp n GLY 78 N 2.50 0.71 2.82 2.32 0.00 0.08 -1.67 105.19 111.95 7hvp n GLY 78 Ca -0.15 -0.62 -0.42 0.00 0.00 0.00 0.00 46.02 44.83 7hvp n GLY 78 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 7hvp n PRO 79 N 0.00 2.63 -4.21 1.61 -0.02 -1.26 -2.93 135.00 130.82 7hvp n PRO 79 Ca 0.00 -2.50 -0.35 0.00 -2.02 0.00 0.00 63.50 58.63 7hvp n PRO 79 Cb 0.00 -3.24 -0.09 0.00 -0.02 0.00 0.00 33.50 30.15 7hvp n PRO 79 CO 0.00 0.00 0.00 -0.08 1.98 0.00 0.00 175.50 177.40 7hvp s THR 80 N 3.56 4.63 -0.04 3.45 -1.32 -1.26 -4.99 115.64 119.67 7hvp s THR 80 Ca 0.49 -0.12 0.23 0.00 -1.21 0.00 0.00 61.69 61.08 7hvp s THR 80 Cb 0.14 -2.99 0.23 0.00 -1.51 0.00 0.00 72.50 68.37 7hvp s THR 80 CO -0.05 0.58 1.69 -0.65 -2.21 0.00 0.00 174.62 173.98 7hvp h PRO 81 N 5.45 0.00 -2.92 7.08 0.11 -1.99 -3.44 132.00 136.29 7hvp h PRO 81 Ca -0.48 0.00 0.06 0.00 0.11 0.00 0.00 66.00 65.68 7hvp h PRO 81 Cb 1.20 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.27 7hvp h PRO 81 CO 0.58 0.00 0.28 0.54 -0.21 0.00 0.00 178.00 179.19 7hvp s VAL 82 N -3.60 0.00 -0.39 3.15 0.11 -1.26 -5.13 120.40 113.28 7hvp s VAL 82 Ca -0.03 -0.96 -0.23 0.00 -2.93 0.00 0.00 61.98 57.84 7hvp s VAL 82 Cb 0.07 -2.28 0.01 0.00 -1.53 0.00 0.00 36.38 32.65 7hvp s VAL 82 CO 0.21 0.00 0.79 0.20 -3.33 0.00 0.00 175.10 172.97 7hvp s ASN 83 N -2.98 6.51 -0.12 3.54 0.01 -1.26 -4.55 114.94 116.09 7hvp s ASN 83 Ca 0.13 0.23 0.00 0.00 -0.71 0.00 0.00 52.86 52.51 7hvp s ASN 83 Cb -0.05 -2.39 -0.02 0.00 0.41 0.00 0.00 41.25 39.20 7hvp s ASN 83 CO 0.08 -0.78 -0.13 0.27 -1.51 0.00 0.00 177.10 175.02 7hvp s ILE 84 N 3.16 3.03 -0.45 0.60 -4.36 0.15 -0.44 121.20 122.89 7hvp s ILE 84 Ca 0.31 -0.67 -0.24 0.00 -0.26 0.00 0.00 60.65 59.79 7hvp s ILE 84 Cb -0.13 -2.26 0.03 0.00 1.25 0.00 0.00 42.46 41.34 7hvp s ILE 84 CO 0.19 0.53 0.83 -0.63 0.24 0.00 0.00 174.94 176.09 7hvp s ILE 85 N 0.25 4.60 1.00 8.37 -1.09 0.28 -1.67 121.20 132.93 7hvp s ILE 85 Ca -0.09 0.53 -0.17 0.00 -2.23 0.00 0.00 60.65 58.69 7hvp s ILE 85 Cb -0.15 -4.35 0.22 0.00 -1.58 0.00 0.00 42.46 36.59 7hvp s ILE 85 CO 0.05 -0.75 1.30 -0.83 -1.23 0.00 0.00 174.94 173.49 7hvp s GLY 86 N 2.17 1.76 0.11 6.18 0.00 -0.78 -2.35 107.32 114.41 7hvp s GLY 86 Ca 0.32 -1.19 0.10 0.00 0.00 0.00 0.00 44.72 43.95 7hvp s GLY 86 CO 0.24 -0.40 1.31 0.54 0.00 0.00 0.00 173.10 174.79 7hvp n ARG 87 N -3.91 0.05 0.08 2.90 1.74 -0.11 -2.45 116.66 114.97 7hvp n ARG 87 Ca 0.15 0.49 -0.11 0.00 -0.77 0.00 0.00 57.85 57.61 7hvp n ARG 87 Cb 0.59 -1.65 -0.06 0.00 -1.02 0.00 0.00 32.46 30.33 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 0.34 0.00 0.55 -1.07 -1.80 -3.13 115.58 110.47 7hvp h ASN 88 Ca 0.00 -0.30 0.00 0.00 0.07 0.00 0.00 56.30 56.07 7hvp h ASN 88 Cb 0.07 -0.11 0.00 0.00 -2.07 0.00 0.00 38.32 36.22 7hvp h ASN 88 CO 0.00 1.14 -1.86 0.18 0.07 0.00 0.00 177.43 176.96 7hvp n LEU 89 N -3.63 0.10 0.07 6.14 4.77 -1.12 -4.35 117.00 118.98 7hvp n LEU 89 Ca -0.05 -0.05 -0.05 0.00 -0.03 0.00 0.00 56.01 55.83 7hvp n LEU 89 Cb 0.88 0.00 0.15 0.00 -2.33 0.00 0.00 43.42 42.11 7hvp n LEU 89 CO 0.50 0.02 0.55 -0.07 -1.33 0.00 0.00 177.39 177.06 7hvp h LEU 90 N 0.00 0.33 -0.71 2.23 3.38 -1.57 -2.75 115.31 116.22 7hvp h LEU 90 Ca 0.00 -0.17 -0.10 0.00 0.09 0.00 0.00 57.88 57.70 7hvp h LEU 90 Cb 0.91 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.55 7hvp h LEU 90 CO 0.00 0.79 -0.50 0.71 0.09 0.00 0.00 178.44 179.53 7hvp h THR 91 N 0.24 1.09 -0.04 0.22 1.35 -1.76 -2.28 112.91 111.74 7hvp h THR 91 Ca 0.01 -1.90 -0.14 0.00 -0.55 0.00 0.00 66.41 63.83 7hvp h THR 91 Cb 0.98 2.11 -0.01 0.00 -1.73 0.00 0.00 68.15 69.50 7hvp h THR 91 CO 0.08 0.49 -0.60 1.56 -0.25 0.00 0.00 175.52 176.80 7hvp h GLN 92 N 0.00 0.13 -0.01 4.72 4.20 -1.68 -2.36 115.11 120.10 7hvp h GLN 92 Ca -0.00 -0.09 0.00 0.00 0.06 0.00 0.00 58.65 58.61 7hvp h GLN 92 Cb 1.07 0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.87 7hvp h GLN 92 CO 0.06 0.69 -0.12 0.44 -0.67 0.00 0.00 178.83 179.24 7hvp n ILE 93 N -3.85 0.00 -1.03 2.54 -5.35 -1.18 -4.87 119.36 105.61 7hvp n ILE 93 Ca -0.02 -0.24 0.00 0.00 -0.27 0.00 0.00 62.75 62.22 7hvp n ILE 93 Cb 0.61 0.63 0.00 0.00 -1.74 0.00 0.00 39.64 39.14 7hvp n ILE 93 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 7hvp n GLY 94 N 1.27 -4.18 0.00 3.28 0.00 -0.86 -5.06 105.19 99.63 7hvp n GLY 94 Ca 0.15 -0.76 0.00 0.00 0.00 0.00 0.00 46.02 45.42 7hvp n GLY 94 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 7hvp n THR 96 N -0.36 0.00 -3.64 2.61 -2.24 -1.26 -4.99 114.28 104.41 7hvp n THR 96 Ca 0.00 0.00 -0.38 0.00 -2.27 0.00 0.00 64.05 61.40 7hvp n THR 96 Cb 0.00 0.00 -0.11 0.00 -2.10 0.00 0.00 70.33 68.12 7hvp n THR 96 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 7hvp s LEU 97 N 0.00 3.88 0.05 3.22 1.43 -1.26 -5.09 118.68 120.92 7hvp s LEU 97 Ca 0.00 -0.11 0.04 0.00 -1.03 0.00 0.00 54.13 53.03 7hvp s LEU 97 Cb 0.00 -2.06 -0.04 0.00 0.03 0.00 0.00 46.19 44.12 7hvp s LEU 97 CO 0.00 -0.06 -0.02 0.20 0.23 0.00 0.00 176.35 176.70 7hvp s ASN 98 N 1.71 4.95 0.00 2.29 0.01 -1.26 -5.30 114.94 117.34 7hvp s ASN 98 Ca 0.07 -0.14 0.00 0.00 -0.71 0.00 0.00 52.86 52.08 7hvp s ASN 98 Cb -0.16 -1.20 0.00 0.00 0.41 0.00 0.00 41.25 40.31 7hvp s ASN 98 CO 0.09 0.22 0.00 2.22 -1.51 0.00 0.00 177.10 178.12