#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 4hvp s GLN 2 N 0.00 3.71 -0.10 0.54 0.74 -1.26 -5.09 119.66 118.20 4hvp s GLN 2 Ca 0.00 -0.49 0.04 0.00 0.05 0.00 0.00 55.36 54.96 4hvp s GLN 2 Cb 0.00 -2.99 -0.00 0.00 1.10 0.00 0.00 33.01 31.11 4hvp s GLN 2 CO 0.00 0.21 -0.22 0.42 -0.55 0.00 0.00 175.29 175.14 4hvp s ILE 3 N 0.48 2.23 0.29 -2.34 1.01 -1.26 -5.11 121.20 116.49 4hvp s ILE 3 Ca -0.02 -0.97 -0.06 0.00 0.00 0.00 0.00 60.65 59.60 4hvp s ILE 3 Cb -0.14 -1.86 -0.06 0.00 0.01 0.00 0.00 42.46 40.42 4hvp s ILE 3 CO 0.02 0.56 0.58 0.42 0.00 0.00 0.00 174.94 176.52 4hvp s THR 4 N 0.25 4.98 -0.30 2.92 -4.23 -1.26 -5.04 115.64 112.96 4hvp s THR 4 Ca -0.15 0.20 0.12 0.00 -1.18 0.00 0.00 61.69 60.67 4hvp s THR 4 Cb -0.17 -3.71 0.76 0.00 1.34 0.00 0.00 72.50 70.72 4hvp s THR 4 CO 0.08 -0.31 1.71 0.18 -0.54 0.00 0.00 174.62 175.74 4hvp n LEU 5 N -0.85 5.66 0.24 4.79 4.77 -1.26 -4.18 117.00 126.17 4hvp n LEU 5 Ca -0.01 -2.90 0.13 0.00 -0.03 0.00 0.00 56.01 53.21 4hvp n LEU 5 Cb 0.54 -0.70 0.41 0.00 -2.33 0.00 0.00 43.42 41.34 4hvp n LEU 5 CO 0.47 0.67 0.87 -0.50 -1.33 0.00 0.00 177.39 177.57 4hvp h TRP 6 N 3.41 0.00 -2.41 -1.77 4.06 -2.06 -3.44 115.95 113.73 4hvp h TRP 6 Ca 0.08 0.00 -0.53 0.00 2.06 0.00 0.00 58.89 60.50 4hvp h TRP 6 Cb 2.03 0.00 -0.14 0.00 -1.00 0.00 0.00 29.16 30.06 4hvp h TRP 6 CO 1.11 0.05 -0.64 -1.14 -3.56 0.00 0.00 178.44 174.27 4hvp s GLN 7 N -3.44 1.70 0.25 0.49 -0.44 -1.26 -5.10 119.66 111.87 4hvp s GLN 7 Ca 0.04 -1.92 -0.31 0.00 -2.50 0.00 0.00 55.36 50.67 4hvp s GLN 7 Cb 0.07 -1.23 -0.12 0.00 -1.64 0.00 0.00 33.01 30.09 4hvp s GLN 7 CO 0.62 -0.04 1.60 0.54 0.50 0.00 0.00 175.29 178.51 4hvp n ARG 8 N -0.73 2.59 -1.72 1.67 1.74 -1.26 -4.83 116.66 114.13 4hvp n ARG 8 Ca -0.04 0.93 -0.42 0.00 -0.77 0.00 0.00 57.85 57.55 4hvp n ARG 8 Cb 0.65 -2.71 -0.02 0.00 -1.02 0.00 0.00 32.46 29.37 4hvp n ARG 8 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 4hvp n PRO 9 N 2.72 2.53 -3.75 5.56 -0.05 -1.26 -4.91 135.00 135.84 4hvp n PRO 9 Ca 0.12 -2.51 -0.35 0.00 -0.05 0.00 0.00 63.50 60.70 4hvp n PRO 9 Cb 0.35 -3.25 -0.08 0.00 -0.05 0.00 0.00 33.50 30.46 4hvp n PRO 9 CO 0.00 0.00 0.00 -1.17 -0.05 0.00 0.00 175.50 174.28 4hvp s LEU 10 N 2.62 4.16 0.13 1.53 2.96 -1.26 -1.90 118.68 126.92 4hvp s LEU 10 Ca 0.51 0.20 0.06 0.00 -0.22 0.00 0.00 54.13 54.68 4hvp s LEU 10 Cb 0.12 -2.08 -0.04 0.00 0.50 0.00 0.00 46.19 44.69 4hvp s LEU 10 CO -0.01 0.16 -0.13 -0.69 -1.32 0.00 0.00 176.35 174.36 4hvp s VAL 11 N 0.45 1.33 -0.09 1.68 1.01 -0.41 -4.97 120.40 119.41 4hvp s VAL 11 Ca 0.07 -1.80 -0.13 0.00 0.00 0.00 0.00 61.98 60.12 4hvp s VAL 11 Cb -0.11 -1.61 -0.05 0.00 0.00 0.00 0.00 36.38 34.60 4hvp s VAL 11 CO -0.01 -0.48 0.31 0.42 0.00 0.00 0.00 175.10 175.33 4hvp s THR 12 N -2.39 5.24 0.06 3.92 -4.23 -1.26 -0.13 115.64 116.86 4hvp s THR 12 Ca 0.11 0.59 0.07 0.00 -1.18 0.00 0.00 61.69 61.28 4hvp s THR 12 Cb -0.03 -3.61 -0.03 0.00 1.34 0.00 0.00 72.50 70.17 4hvp s THR 12 CO 0.03 0.52 -0.19 0.27 -0.54 0.00 0.00 174.62 174.71 4hvp s ILE 13 N -0.49 1.50 -0.14 2.99 -4.36 -0.44 -4.74 121.20 115.53 4hvp s ILE 13 Ca 0.19 -1.26 -0.05 0.00 -0.26 0.00 0.00 60.65 59.27 4hvp s ILE 13 Cb -0.14 -1.35 -0.04 0.00 1.25 0.00 0.00 42.46 42.18 4hvp s ILE 13 CO 0.08 0.05 0.05 -0.13 0.24 0.00 0.00 174.94 175.23 4hvp s ARG 14 N -1.42 3.56 -0.27 0.37 0.52 -0.70 -0.08 118.95 120.92 4hvp s ARG 14 Ca 0.05 -0.34 0.08 0.00 -0.52 0.00 0.00 55.73 55.01 4hvp s ARG 14 Cb -0.09 -3.06 0.45 0.00 0.52 0.00 0.00 34.95 32.77 4hvp s ARG 14 CO 0.02 0.49 1.24 -0.89 0.02 0.00 0.00 175.30 176.19 4hvp n ILE 15 N 2.83 2.45 -1.92 1.52 5.41 0.35 -2.96 119.36 127.04 4hvp n ILE 15 Ca -0.18 -3.73 -0.02 0.00 1.00 0.00 0.00 62.75 59.83 4hvp n ILE 15 Cb 0.53 -0.75 -0.01 0.00 -0.71 0.00 0.00 39.64 38.69 4hvp n ILE 15 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 4hvp n GLY 16 N -0.90 -4.31 0.30 7.39 0.00 -1.26 -4.59 105.19 101.81 4hvp n GLY 16 Ca 0.35 0.34 0.00 0.00 0.00 0.00 0.00 46.02 46.71 4hvp n GLY 16 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 4hvp n GLY 17 N 0.94 1.10 3.83 -0.02 0.00 -1.26 -4.98 105.19 104.81 4hvp n GLY 17 Ca -0.13 -0.63 -0.31 0.00 0.00 0.00 0.00 46.02 44.95 4hvp n GLY 17 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 4hvp s GLN 18 N 0.00 3.35 -0.12 1.61 1.03 -1.26 -5.07 119.66 119.20 4hvp s GLN 18 Ca 0.00 0.94 -0.02 0.00 0.04 0.00 0.00 55.36 56.32 4hvp s GLN 18 Cb 0.00 -2.04 -0.03 0.00 0.03 0.00 0.00 33.01 30.97 4hvp s GLN 18 CO 0.00 -0.77 -0.05 -0.51 -2.54 0.00 0.00 175.29 171.42 4hvp s LEU 19 N -5.03 3.25 0.27 2.60 1.43 -1.26 0.13 118.68 120.07 4hvp s LEU 19 Ca 0.58 -0.06 0.02 0.00 -1.03 0.00 0.00 54.13 53.64 4hvp s LEU 19 Cb -0.13 -1.75 -0.04 0.00 0.03 0.00 0.00 46.19 44.30 4hvp s LEU 19 CO 0.48 0.26 0.15 -0.54 0.23 0.00 0.00 176.35 176.93 4hvp s LYS 20 N -0.19 1.46 -0.19 1.70 -0.14 0.88 -4.96 119.74 118.30 4hvp s LYS 20 Ca 0.03 -1.81 -0.03 0.00 -1.36 0.00 0.00 55.97 52.81 4hvp s LYS 20 Cb -0.13 0.04 -0.01 0.00 -1.68 0.00 0.00 37.83 36.05 4hvp s LYS 20 CO 0.02 -0.43 -0.07 -2.00 -0.76 0.00 0.00 175.35 172.12 4hvp s GLU 21 N -3.92 3.41 0.13 1.68 2.56 -1.26 -1.33 118.70 119.97 4hvp s GLU 21 Ca 0.38 -0.63 0.04 0.00 0.00 0.00 0.00 54.97 54.76 4hvp s GLU 21 Cb 0.06 -2.89 -0.04 0.00 2.00 0.00 0.00 34.13 33.26 4hvp s GLU 21 CO 0.16 -0.04 -0.10 0.00 -0.56 0.00 0.00 175.26 174.72 4hvp s ALA 22 N 1.05 1.38 -0.24 6.30 0.00 0.82 -4.55 121.76 126.52 4hvp s ALA 22 Ca 0.00 -1.41 -0.06 0.00 0.00 0.00 0.00 51.96 50.50 4hvp s ALA 22 Cb -0.15 0.03 -0.02 0.00 0.00 0.00 0.00 23.12 22.99 4hvp s ALA 22 CO -0.01 -0.07 0.02 -1.17 0.00 0.00 0.00 175.76 174.54 4hvp s LEU 23 N -2.95 3.22 -0.23 0.00 1.98 -0.80 -1.29 118.68 118.60 4hvp s LEU 23 Ca 0.14 -0.31 -0.29 0.00 -2.89 0.00 0.00 54.13 50.77 4hvp s LEU 23 Cb 0.01 -1.84 -0.03 0.00 0.66 0.00 0.00 46.19 44.99 4hvp s LEU 23 CO 0.01 -0.04 1.82 -0.76 -1.89 0.00 0.00 176.35 175.49 4hvp s LEU 24 N 1.55 3.73 -0.23 -0.68 1.43 -0.80 -0.56 118.68 123.12 4hvp s LEU 24 Ca 0.06 1.66 -0.03 0.00 -1.03 0.00 0.00 54.13 54.80 4hvp s LEU 24 Cb -0.15 -3.53 0.07 0.00 0.03 0.00 0.00 46.19 42.62 4hvp s LEU 24 CO 0.00 -1.52 0.06 -0.62 0.23 0.00 0.00 176.35 174.50 4hvp s ASP 25 N 5.63 3.20 0.55 2.29 2.15 0.16 -4.82 116.67 125.83 4hvp s ASP 25 Ca 0.81 -1.03 0.23 0.00 0.43 0.00 0.00 52.55 52.99 4hvp s ASP 25 Cb -0.27 -0.63 1.48 0.00 -0.30 0.00 0.00 42.92 43.20 4hvp s ASP 25 CO 0.33 -0.34 2.12 0.74 -0.17 0.00 0.00 175.17 177.85 4hvp h THR 26 N 6.50 0.73 -0.13 1.71 2.02 -1.93 -1.67 112.91 120.15 4hvp h THR 26 Ca -0.16 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.02 4hvp h THR 26 Cb 1.09 0.90 0.00 0.00 -1.74 0.00 0.00 68.15 68.40 4hvp h THR 26 CO 0.37 0.00 0.00 0.61 0.37 0.00 0.00 175.52 176.87 4hvp n GLY 27 N -1.49 -0.04 3.24 2.16 0.00 -1.26 -4.82 105.19 102.98 4hvp n GLY 27 Ca 0.01 -0.34 -0.32 0.00 0.00 0.00 0.00 46.02 45.37 4hvp n GLY 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 4hvp s ALA 28 N -1.84 2.20 0.04 4.61 0.00 -0.63 -4.99 121.76 121.14 4hvp s ALA 28 Ca 0.31 -0.98 -0.22 0.00 0.00 0.00 0.00 51.96 51.07 4hvp s ALA 28 Cb 0.16 -0.82 -0.15 0.00 0.00 0.00 0.00 23.12 22.32 4hvp s ALA 28 CO 0.25 0.31 1.42 -0.44 0.00 0.00 0.00 175.76 177.29 4hvp h ASP 29 N 6.61 0.22 -0.75 0.00 3.32 -1.87 0.21 116.42 124.17 4hvp h ASP 29 Ca -0.21 -0.38 -0.55 0.00 0.02 0.00 0.00 57.03 55.91 4hvp h ASP 29 Cb 1.23 -0.06 -0.03 0.00 0.22 0.00 0.00 39.33 40.68 4hvp h ASP 29 CO 0.48 0.55 -0.28 -1.81 -1.72 0.00 0.00 179.24 176.45 4hvp s ASP 30 N -5.82 4.76 -0.23 6.45 1.01 -1.26 -2.37 116.67 119.21 4hvp s ASP 30 Ca -0.14 -1.11 -0.10 0.00 0.71 0.00 0.00 52.55 51.91 4hvp s ASP 30 Cb 0.05 0.25 -0.05 0.00 1.01 0.00 0.00 42.92 44.19 4hvp s ASP 30 CO 0.71 -1.08 0.13 -0.89 0.21 0.00 0.00 175.17 174.26 4hvp s THR 31 N -2.71 5.11 -0.03 -1.27 2.01 -1.26 -2.94 115.64 114.54 4hvp s THR 31 Ca 0.41 0.09 0.01 0.00 0.31 0.00 0.00 61.69 62.51 4hvp s THR 31 Cb -0.03 -3.37 0.01 0.00 0.01 0.00 0.00 72.50 69.12 4hvp s THR 31 CO 0.25 0.36 -0.05 0.54 -0.69 0.00 0.00 174.62 175.03 4hvp s VAL 32 N 1.05 0.51 0.17 3.82 0.11 -0.37 -1.54 120.40 124.15 4hvp s VAL 32 Ca 0.06 -0.18 0.10 0.00 -2.93 0.00 0.00 61.98 59.04 4hvp s VAL 32 Cb -0.14 -0.50 -0.04 0.00 -1.53 0.00 0.00 36.38 34.17 4hvp s VAL 32 CO 0.04 0.19 -0.23 -0.76 -3.33 0.00 0.00 175.10 171.01 4hvp s LEU 33 N 0.49 2.40 0.71 2.54 1.02 -0.36 0.13 118.68 125.60 4hvp s LEU 33 Ca -0.06 -0.82 -0.15 0.00 0.02 0.00 0.00 54.13 53.11 4hvp s LEU 33 Cb -0.10 -1.09 0.03 0.00 0.02 0.00 0.00 46.19 45.05 4hvp s LEU 33 CO -0.00 0.10 1.18 -1.83 0.02 0.00 0.00 176.35 175.82 4hvp s GLU 34 N -2.49 2.33 -0.07 1.70 -1.05 -1.26 -1.67 118.70 116.19 4hvp s GLU 34 Ca 0.17 1.67 -0.34 0.00 -0.15 0.00 0.00 54.97 56.32 4hvp s GLU 34 Cb -0.08 -1.87 -0.11 0.00 -0.44 0.00 0.00 34.13 31.63 4hvp s GLU 34 CO 0.08 -1.67 1.90 -1.91 0.95 0.00 0.00 175.26 174.61 4hvp n GLU 35 N -2.60 2.29 -3.80 -4.83 0.00 -1.16 -4.57 120.64 105.97 4hvp n GLU 35 Ca 0.13 0.84 -0.10 0.00 0.00 0.00 0.00 57.16 58.03 4hvp n GLU 35 Cb 0.51 -2.70 -0.06 0.00 0.00 0.00 0.00 31.44 29.19 4hvp n GLU 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 4hvp s MET 36 N 4.15 1.06 0.02 5.31 0.23 -1.26 -5.03 119.30 123.77 4hvp s MET 36 Ca 0.92 -0.92 -0.16 0.00 -1.03 0.00 0.00 55.69 54.50 4hvp s MET 36 Cb -0.65 0.41 -0.06 0.00 -1.53 0.00 0.00 34.83 33.00 4hvp s MET 36 CO 0.50 -0.39 0.46 -0.80 -2.03 0.00 0.00 175.02 172.76 4hvp s ASN 37 N -2.87 6.88 0.10 -1.18 -0.87 -1.26 -5.04 114.94 110.71 4hvp s ASN 37 Ca 0.08 1.05 0.02 0.00 -1.57 0.00 0.00 52.86 52.44 4hvp s ASN 37 Cb 0.03 -2.29 -0.04 0.00 -0.02 0.00 0.00 41.25 38.93 4hvp s ASN 37 CO -0.08 0.29 -0.07 -0.76 -2.57 0.00 0.00 177.10 173.91 4hvp s LEU 38 N -0.97 2.50 -0.48 0.60 1.43 -1.26 -5.09 118.68 115.40 4hvp s LEU 38 Ca 0.26 -0.99 -0.27 0.00 -1.03 0.00 0.00 54.13 52.10 4hvp s LEU 38 Cb -0.17 -0.12 0.03 0.00 0.03 0.00 0.00 46.19 45.95 4hvp s LEU 38 CO 0.15 -0.43 1.01 -2.16 0.23 0.00 0.00 176.35 175.15 4hvp s PRO 39 N -3.72 3.57 0.00 1.29 0.04 -1.26 -4.91 135.00 130.00 4hvp s PRO 39 Ca 0.12 0.24 0.00 0.00 0.04 0.00 0.00 61.00 61.40 4hvp s PRO 39 Cb 0.04 -3.94 0.00 0.00 0.04 0.00 0.00 34.50 30.64 4hvp s PRO 39 CO -0.04 -1.33 0.00 0.41 0.04 0.00 0.00 177.00 176.08 4hvp n GLY 40 N 4.94 -1.48 3.42 0.56 0.00 -1.26 -5.05 105.19 106.32 4hvp n GLY 40 Ca 0.08 -1.02 -0.31 0.00 0.00 0.00 0.00 46.02 44.77 4hvp n GLY 40 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 4hvp s LYS 41 N -1.25 2.06 0.07 1.61 2.36 -1.26 -5.13 119.74 118.19 4hvp s LYS 41 Ca 0.00 -0.97 -0.03 0.00 -2.55 0.00 0.00 55.97 52.42 4hvp s LYS 41 Cb 0.00 -2.15 -0.03 0.00 -1.05 0.00 0.00 37.83 34.60 4hvp s LYS 41 CO 0.00 0.55 0.04 1.67 1.55 0.00 0.00 175.35 179.15 4hvp s TRP 42 N -0.84 0.45 -0.02 4.03 1.48 -1.26 -4.59 118.94 118.19 4hvp s TRP 42 Ca 0.13 -0.95 0.03 0.00 -1.06 0.00 0.00 56.10 54.25 4hvp s TRP 42 Cb -0.10 -0.31 -0.00 0.00 -1.16 0.00 0.00 33.47 31.90 4hvp s TRP 42 CO 0.03 -0.44 -0.12 -1.59 -4.06 0.00 0.00 176.95 170.78 4hvp s LYS 43 N -3.92 1.13 0.10 3.25 0.00 -1.00 -4.93 119.74 114.37 4hvp s LYS 43 Ca 0.08 -0.42 -0.30 0.00 0.00 0.00 0.00 55.97 55.33 4hvp s LYS 43 Cb 0.07 -1.05 -0.06 0.00 0.00 0.00 0.00 37.83 36.79 4hvp s LYS 43 CO -0.09 0.20 1.03 -1.25 0.00 0.00 0.00 175.35 175.23 4hvp s PRO 44 N -0.02 4.61 0.16 1.78 0.04 -1.26 0.18 135.00 140.49 4hvp s PRO 44 Ca -0.00 1.55 -0.00 0.00 0.04 0.00 0.00 61.00 62.58 4hvp s PRO 44 Cb -0.08 -3.36 -0.04 0.00 0.04 0.00 0.00 34.50 31.06 4hvp s PRO 44 CO 0.00 0.07 0.07 0.15 0.04 0.00 0.00 177.00 177.34 4hvp s LYS 45 N 0.23 1.05 -0.05 4.56 3.01 -0.99 -4.91 119.74 122.64 4hvp s LYS 45 Ca 0.50 -1.52 0.05 0.00 -1.01 0.00 0.00 55.97 53.99 4hvp s LYS 45 Cb -0.25 0.15 -0.01 0.00 -1.01 0.00 0.00 37.83 36.71 4hvp s LYS 45 CO 0.31 -0.28 -0.20 -1.64 0.51 0.00 0.00 175.35 174.05 4hvp s MET 46 N -4.06 2.09 0.28 1.68 -1.94 -1.26 0.27 119.30 116.36 4hvp s MET 46 Ca 0.29 -0.71 0.05 0.00 -1.71 0.00 0.00 55.69 53.61 4hvp s MET 46 Cb 0.07 -1.78 -0.06 0.00 2.01 0.00 0.00 34.83 35.07 4hvp s MET 46 CO 0.05 0.28 -0.03 0.96 -0.01 0.00 0.00 175.02 176.28 4hvp s ILE 47 N 0.00 1.45 0.17 2.53 -4.36 -0.69 -4.96 121.20 115.34 4hvp s ILE 47 Ca -0.05 -2.08 0.04 0.00 -0.26 0.00 0.00 60.65 58.31 4hvp s ILE 47 Cb -0.13 -2.49 -0.05 0.00 1.25 0.00 0.00 42.46 41.05 4hvp s ILE 47 CO 0.03 -0.25 -0.08 -0.83 0.24 0.00 0.00 174.94 174.05 4hvp s GLY 48 N -3.43 1.21 0.00 6.27 0.00 -1.26 -2.25 107.32 107.86 4hvp s GLY 48 Ca 0.30 -1.57 0.00 0.00 0.00 0.00 0.00 44.72 43.45 4hvp s GLY 48 CO 0.12 -1.62 0.00 0.61 0.00 0.00 0.00 173.10 172.21 4hvp n GLY 49 N -0.26 3.80 0.23 0.20 0.00 -1.03 -5.03 105.19 103.11 4hvp n GLY 49 Ca -0.09 -1.35 0.01 0.00 0.00 0.00 0.00 46.02 44.60 4hvp n GLY 49 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 173.32 173.48 4hvp h ILE 50 N 0.60 1.20 0.00 -0.61 3.07 -2.03 -3.19 117.51 116.56 4hvp h ILE 50 Ca 0.00 -0.91 0.00 0.00 1.55 0.00 0.00 64.86 65.50 4hvp h ILE 50 Cb 0.00 1.27 0.00 0.00 -0.27 0.00 0.00 36.82 37.82 4hvp h ILE 50 CO 0.00 0.28 -0.58 0.61 -1.05 0.00 0.00 178.15 177.41 4hvp n GLY 51 N -0.75 -1.38 0.00 0.16 0.00 -1.26 -5.08 105.19 96.88 4hvp n GLY 51 Ca -0.01 -0.26 0.00 0.00 0.00 0.00 0.00 46.02 45.75 4hvp n GLY 51 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 4hvp n GLY 52 N 1.38 0.35 3.89 -0.02 0.00 -1.21 -5.14 105.19 104.44 4hvp n GLY 52 Ca 0.04 -1.33 -0.32 0.00 0.00 0.00 0.00 46.02 44.41 4hvp n GLY 52 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 4hvp s PHE 53 N -4.00 3.46 -0.01 1.61 0.08 -1.26 -2.45 117.98 115.41 4hvp s PHE 53 Ca 0.00 0.24 -0.06 0.00 0.12 0.00 0.00 56.93 57.23 4hvp s PHE 53 Cb 0.00 -1.75 0.00 0.00 -0.57 0.00 0.00 43.02 40.70 4hvp s PHE 53 CO 0.00 0.59 0.13 0.96 -0.10 0.00 0.00 175.22 176.80 4hvp s ILE 54 N -1.43 0.07 -0.11 0.64 -4.36 -0.95 -4.99 121.20 110.06 4hvp s ILE 54 Ca 0.32 -0.57 -0.19 0.00 -0.26 0.00 0.00 60.65 59.95 4hvp s ILE 54 Cb -0.13 -0.37 -0.04 0.00 1.25 0.00 0.00 42.46 43.17 4hvp s ILE 54 CO 0.24 -0.31 0.53 -0.75 0.24 0.00 0.00 174.94 174.89 4hvp s LYS 55 N -1.09 4.35 0.11 0.37 2.20 -1.26 -1.71 119.74 122.72 4hvp s LYS 55 Ca -0.12 0.55 0.01 0.00 -0.36 0.00 0.00 55.97 56.05 4hvp s LYS 55 Cb -0.06 -3.45 -0.00 0.00 -1.51 0.00 0.00 37.83 32.81 4hvp s LYS 55 CO 0.01 0.11 0.03 1.33 -0.36 0.00 0.00 175.35 176.47 4hvp n VAL 56 N 3.76 0.00 -3.78 4.02 0.24 0.14 -4.61 118.33 118.10 4hvp n VAL 56 Ca -0.05 -0.63 -0.16 0.00 -2.04 0.00 0.00 64.34 61.46 4hvp n VAL 56 Cb 0.51 0.20 -0.16 0.00 -1.47 0.00 0.00 33.84 32.92 4hvp n VAL 56 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 4hvp s ARG 57 N -2.43 -0.01 -0.01 7.34 1.70 -0.77 -2.34 118.95 122.42 4hvp s ARG 57 Ca 0.04 0.19 -0.18 0.00 -0.47 0.00 0.00 55.73 55.31 4hvp s ARG 57 Cb 0.00 -0.29 -0.05 0.00 -0.57 0.00 0.00 34.95 34.04 4hvp s ARG 57 CO 0.03 -0.18 0.52 -1.14 -1.08 0.00 0.00 175.30 173.45 4hvp s GLN 58 N 1.16 4.20 -0.28 3.89 0.74 0.47 -2.36 119.66 127.48 4hvp s GLN 58 Ca -0.08 0.60 0.03 0.00 0.05 0.00 0.00 55.36 55.95 4hvp s GLN 58 Cb -0.13 -3.31 0.07 0.00 1.10 0.00 0.00 33.01 30.73 4hvp s GLN 58 CO -0.03 0.46 -0.07 0.71 -0.55 0.00 0.00 175.29 175.81 4hvp s TYR 59 N -0.42 3.35 0.43 1.67 1.51 -0.62 -2.39 117.35 120.88 4hvp s TYR 59 Ca 0.28 -2.40 -0.23 0.00 -1.01 0.00 0.00 57.07 53.71 4hvp s TYR 59 Cb -0.17 -2.12 -0.08 0.00 -0.11 0.00 0.00 41.96 39.47 4hvp s TYR 59 CO 0.15 -0.89 1.08 -0.51 -1.11 0.00 0.00 175.55 174.27 4hvp s ASP 60 N 1.09 6.54 -1.02 2.29 1.01 -1.26 -1.64 116.67 123.67 4hvp s ASP 60 Ca -0.05 2.09 -0.16 0.00 0.71 0.00 0.00 52.55 55.14 4hvp s ASP 60 Cb -0.20 -2.59 0.01 0.00 1.01 0.00 0.00 42.92 41.15 4hvp s ASP 60 CO -0.05 -0.65 0.71 0.00 0.21 0.00 0.00 175.17 175.39 4hvp n GLN 61 N -0.32 -1.10 -4.36 8.23 6.02 -1.17 -4.88 117.38 119.79 4hvp n GLN 61 Ca 0.06 0.58 -0.34 0.00 -0.01 0.00 0.00 57.00 57.29 4hvp n GLN 61 Cb 0.50 -3.50 -0.11 0.00 1.02 0.00 0.00 30.24 28.14 4hvp n GLN 61 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 4hvp s ILE 62 N -3.30 4.06 0.09 5.09 -1.09 0.59 -4.72 121.20 121.92 4hvp s ILE 62 Ca 0.30 -0.31 -0.29 0.00 -2.23 0.00 0.00 60.65 58.12 4hvp s ILE 62 Cb -0.13 -2.77 -0.06 0.00 -1.58 0.00 0.00 42.46 37.93 4hvp s ILE 62 CO 0.88 0.51 0.92 -2.84 -1.23 0.00 0.00 174.94 173.18 4hvp s PRO 63 N 0.10 4.65 0.06 2.79 0.02 -1.26 -2.41 135.00 138.96 4hvp s PRO 63 Ca 0.00 1.36 0.05 0.00 0.02 0.00 0.00 61.00 62.43 4hvp s PRO 63 Cb -0.13 -3.38 -0.03 0.00 0.02 0.00 0.00 34.50 30.98 4hvp s PRO 63 CO 0.02 0.21 -0.13 0.08 -0.33 0.00 0.00 177.00 176.85 4hvp s VAL 64 N 0.05 1.02 -0.22 3.83 1.01 -0.33 -4.68 120.40 121.09 4hvp s VAL 64 Ca 0.45 -1.24 0.00 0.00 0.00 0.00 0.00 61.98 61.20 4hvp s VAL 64 Cb -0.23 -0.99 0.06 0.00 0.00 0.00 0.00 36.38 35.22 4hvp s VAL 64 CO 0.28 -0.23 -0.05 -0.70 0.00 0.00 0.00 175.10 174.40 4hvp s GLU 65 N -1.66 1.58 -0.36 2.72 2.12 -1.15 -1.74 118.70 120.21 4hvp s GLU 65 Ca -0.03 -0.88 0.05 0.00 0.36 0.00 0.00 54.97 54.47 4hvp s GLU 65 Cb -0.10 -2.47 0.59 0.00 0.26 0.00 0.00 34.13 32.41 4hvp s GLU 65 CO 0.02 -0.56 1.75 -0.89 -0.54 0.00 0.00 175.26 175.04 4hvp n ILE 66 N 4.72 2.81 0.00 -3.70 -0.00 -1.26 -1.73 119.36 120.21 4hvp n ILE 66 Ca -0.12 -1.57 0.00 0.00 -0.00 0.00 0.00 62.75 61.05 4hvp n ILE 66 Cb 0.45 -0.51 0.00 0.00 -0.00 0.00 0.00 39.64 39.58 4hvp n ILE 66 CO 0.00 0.00 0.00 0.61 -0.00 0.00 0.00 176.55 177.16 4hvp n GLY 68 N -0.69 0.00 3.76 7.39 0.00 -1.26 -4.71 105.19 109.68 4hvp n GLY 68 Ca 0.47 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 46.15 4hvp n GLY 68 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 4hvp s HIS 69 N 0.00 3.30 -0.03 1.61 3.76 -1.26 -5.09 115.29 117.58 4hvp s HIS 69 Ca 0.00 0.26 -0.19 0.00 -0.15 0.00 0.00 55.06 54.98 4hvp s HIS 69 Cb 0.00 -1.80 -0.05 0.00 1.11 0.00 0.00 32.58 31.84 4hvp s HIS 69 CO 0.00 0.56 0.54 0.15 -0.85 0.00 0.00 174.74 175.13 4hvp s LYS 70 N -1.27 4.25 0.00 1.40 -0.14 -1.26 -4.10 119.74 118.62 4hvp s LYS 70 Ca 0.18 0.62 -0.05 0.00 -1.36 0.00 0.00 55.97 55.35 4hvp s LYS 70 Cb -0.12 -3.34 -0.00 0.00 -1.68 0.00 0.00 37.83 32.69 4hvp s LYS 70 CO 0.07 0.39 0.10 0.00 -0.76 0.00 0.00 175.35 175.15 4hvp s ALA 71 N -0.20 -0.22 -0.12 5.17 0.00 -0.71 -4.67 121.76 121.02 4hvp s ALA 71 Ca 0.29 -0.17 -0.04 0.00 0.00 0.00 0.00 51.96 52.03 4hvp s ALA 71 Cb -0.17 0.08 0.05 0.00 0.00 0.00 0.00 23.12 23.07 4hvp s ALA 71 CO 0.15 -0.17 0.08 0.42 0.00 0.00 0.00 175.76 176.24 4hvp s ILE 72 N -1.19 -0.10 0.00 0.00 1.01 -1.26 -1.19 121.20 118.47 4hvp s ILE 72 Ca -0.13 0.07 0.00 0.00 0.00 0.00 0.00 60.65 60.59 4hvp s ILE 72 Cb -0.07 -0.41 0.00 0.00 0.01 0.00 0.00 42.46 41.99 4hvp s ILE 72 CO 0.01 -0.10 0.00 0.61 0.00 0.00 0.00 174.94 175.46 4hvp n GLY 73 N 5.29 1.34 3.77 6.18 0.00 -1.01 -4.87 105.19 115.89 4hvp n GLY 73 Ca -0.05 -0.55 -0.38 0.00 0.00 0.00 0.00 46.02 45.04 4hvp n GLY 73 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 4hvp s THR 74 N -1.93 3.79 -0.05 2.61 2.01 -1.26 -0.30 115.64 120.51 4hvp s THR 74 Ca 0.00 1.52 -0.01 0.00 0.31 0.00 0.00 61.69 63.51 4hvp s THR 74 Cb 0.00 -3.86 0.03 0.00 0.01 0.00 0.00 72.50 68.68 4hvp s THR 74 CO 0.00 0.15 0.03 -0.69 -0.69 0.00 0.00 174.62 173.42 4hvp s VAL 75 N -1.50 0.11 -0.13 3.82 1.01 -0.65 -4.55 120.40 118.52 4hvp s VAL 75 Ca 0.52 0.27 -0.09 0.00 0.00 0.00 0.00 61.98 62.68 4hvp s VAL 75 Cb -0.24 -0.31 -0.04 0.00 0.00 0.00 0.00 36.38 35.79 4hvp s VAL 75 CO 0.30 0.21 0.17 -0.76 0.00 0.00 0.00 175.10 175.01 4hvp s LEU 76 N 1.94 4.35 -0.05 3.92 1.43 -0.59 -1.59 118.68 128.08 4hvp s LEU 76 Ca 0.03 0.46 0.02 0.00 -1.03 0.00 0.00 54.13 53.61 4hvp s LEU 76 Cb -0.12 -2.13 0.01 0.00 0.03 0.00 0.00 46.19 43.98 4hvp s LEU 76 CO -0.04 0.34 -0.11 0.68 0.23 0.00 0.00 176.35 177.45 4hvp s VAL 77 N -0.65 1.00 -0.09 -1.59 -7.23 -1.00 -1.23 120.40 109.62 4hvp s VAL 77 Ca 0.14 -0.42 0.00 0.00 -1.81 0.00 0.00 61.98 59.90 4hvp s VAL 77 Cb -0.12 -0.92 0.00 0.00 0.56 0.00 0.00 36.38 35.90 4hvp s VAL 77 CO 0.03 0.32 0.00 0.61 -0.31 0.00 0.00 175.10 175.76 4hvp n GLY 78 N 3.75 -0.61 2.65 2.32 0.00 -0.67 -1.85 105.19 110.76 4hvp n GLY 78 Ca -0.23 -0.62 -0.41 0.00 0.00 0.00 0.00 46.02 44.77 4hvp n GLY 78 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 4hvp n PRO 79 N 0.00 3.25 -3.79 1.61 -0.04 -1.26 -2.97 135.00 131.80 4hvp n PRO 79 Ca 0.00 -2.70 -0.37 0.00 -0.04 0.00 0.00 63.50 60.39 4hvp n PRO 79 Cb 0.00 -3.09 -0.06 0.00 -0.04 0.00 0.00 33.50 30.31 4hvp n PRO 79 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 4hvp s THR 80 N 2.32 5.38 0.45 0.52 -1.32 -1.26 -5.03 115.64 116.70 4hvp s THR 80 Ca 0.51 0.31 0.15 0.00 -1.21 0.00 0.00 61.69 61.46 4hvp s THR 80 Cb 0.14 -3.49 0.19 0.00 -1.51 0.00 0.00 72.50 67.83 4hvp s THR 80 CO -0.07 0.56 2.00 1.55 -2.21 0.00 0.00 174.62 176.45 4hvp h PRO 81 N 4.72 0.00 -3.85 7.08 0.13 -1.98 -3.44 132.00 134.66 4hvp h PRO 81 Ca -0.53 0.00 -0.22 0.00 -0.87 0.00 0.00 66.00 64.37 4hvp h PRO 81 Cb 1.22 0.00 -0.26 0.00 0.13 0.00 0.00 31.00 32.09 4hvp h PRO 81 CO 0.60 0.18 -0.72 0.54 -0.23 0.00 0.00 178.00 178.37 4hvp s VAL 82 N -4.62 0.07 0.21 1.56 0.11 -1.26 -5.10 120.40 111.38 4hvp s VAL 82 Ca -0.04 -0.26 -0.31 0.00 -2.93 0.00 0.00 61.98 58.45 4hvp s VAL 82 Cb 0.16 -0.11 -0.10 0.00 -1.53 0.00 0.00 36.38 34.80 4hvp s VAL 82 CO 0.69 -0.12 1.47 0.20 -3.33 0.00 0.00 175.10 174.01 4hvp s ASN 83 N -0.39 6.65 0.06 3.54 0.01 -1.26 -4.79 114.94 118.76 4hvp s ASN 83 Ca -0.04 2.62 0.04 0.00 -0.71 0.00 0.00 52.86 54.77 4hvp s ASN 83 Cb -0.03 -2.61 -0.03 0.00 0.41 0.00 0.00 41.25 38.99 4hvp s ASN 83 CO -0.00 -0.73 -0.12 0.27 -1.51 0.00 0.00 177.10 175.01 4hvp s ILE 84 N 0.42 0.91 -0.34 0.60 -4.36 0.34 -1.91 121.20 116.86 4hvp s ILE 84 Ca 0.63 -1.19 -0.11 0.00 -0.26 0.00 0.00 60.65 59.72 4hvp s ILE 84 Cb -0.42 -0.90 0.00 0.00 1.25 0.00 0.00 42.46 42.40 4hvp s ILE 84 CO 0.39 -0.26 0.19 -0.63 0.24 0.00 0.00 174.94 174.87 4hvp s ILE 85 N -1.26 4.72 0.53 8.37 -1.09 0.28 -1.23 121.20 131.51 4hvp s ILE 85 Ca -0.04 -0.53 -0.03 0.00 -2.23 0.00 0.00 60.65 57.82 4hvp s ILE 85 Cb -0.10 -3.48 0.11 0.00 -1.58 0.00 0.00 42.46 37.41 4hvp s ILE 85 CO 0.02 -0.05 0.73 0.61 -1.23 0.00 0.00 174.94 175.02 4hvp n GLY 86 N 5.01 0.24 0.29 6.18 0.00 -1.15 -0.67 105.19 115.09 4hvp n GLY 86 Ca -0.13 -1.94 0.17 0.00 0.00 0.00 0.00 46.02 44.12 4hvp n GLY 86 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 4hvp h ARG 87 N 0.00 0.00 -0.74 1.61 3.08 -0.62 -2.40 114.38 115.31 4hvp h ARG 87 Ca -0.24 0.00 0.01 0.00 0.07 0.00 0.00 59.98 59.82 4hvp h ARG 87 Cb 0.82 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.84 4hvp h ARG 87 CO 0.23 0.05 0.49 -2.95 -1.07 0.00 0.00 179.97 176.72 4hvp h ASN 88 N 0.00 0.84 0.35 7.04 -1.07 -1.74 -2.59 115.58 118.42 4hvp h ASN 88 Ca -0.00 -0.02 -0.31 0.00 0.07 0.00 0.00 56.30 56.03 4hvp h ASN 88 Cb 0.31 -0.21 -0.06 0.00 -2.07 0.00 0.00 38.32 36.29 4hvp h ASN 88 CO 0.01 0.61 -1.90 0.18 0.07 0.00 0.00 177.43 176.40 4hvp n LEU 89 N -4.57 0.63 -0.27 6.14 4.32 -1.12 -4.28 117.00 117.85 4hvp n LEU 89 Ca 0.07 0.30 -0.05 0.00 -0.02 0.00 0.00 56.01 56.30 4hvp n LEU 89 Cb 0.02 0.26 0.06 0.00 -1.62 0.00 0.00 43.42 42.13 4hvp n LEU 89 CO 0.36 0.42 1.11 -0.07 -1.22 0.00 0.00 177.39 177.99 4hvp h LEU 90 N 0.00 0.92 -1.35 2.23 3.38 -1.45 -2.22 115.31 116.83 4hvp h LEU 90 Ca -0.36 -0.10 -0.07 0.00 0.09 0.00 0.00 57.88 57.44 4hvp h LEU 90 Cb 2.08 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 42.59 4hvp h LEU 90 CO 0.07 0.75 -0.33 0.71 0.09 0.00 0.00 178.44 179.73 4hvp h THR 91 N 1.01 1.19 -0.23 0.22 1.35 -1.64 -1.40 112.91 113.41 4hvp h THR 91 Ca 0.26 -1.14 -0.06 0.00 -0.55 0.00 0.00 66.41 64.92 4hvp h THR 91 Cb 0.04 1.62 -0.01 0.00 -1.73 0.00 0.00 68.15 68.07 4hvp h THR 91 CO -0.04 0.32 -0.13 1.56 -0.25 0.00 0.00 175.52 176.98 4hvp h GLN 92 N 0.00 0.37 -0.00 4.72 4.20 -1.59 -1.40 115.11 121.41 4hvp h GLN 92 Ca -0.00 -0.10 0.00 0.00 0.06 0.00 0.00 58.65 58.61 4hvp h GLN 92 Cb 0.59 -0.04 0.00 0.00 0.30 0.00 0.00 27.48 28.33 4hvp h GLN 92 CO 0.04 0.51 -0.45 0.44 -0.67 0.00 0.00 178.83 178.71 4hvp n ILE 93 N -4.23 0.00 -1.70 2.54 -5.35 -1.01 -4.92 119.36 104.70 4hvp n ILE 93 Ca 0.00 -0.06 -0.00 0.00 -0.27 0.00 0.00 62.75 62.42 4hvp n ILE 93 Cb 0.30 0.40 -0.00 0.00 -1.74 0.00 0.00 39.64 38.60 4hvp n ILE 93 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 4hvp n GLY 94 N 1.44 -4.37 0.00 3.28 0.00 -0.53 -5.09 105.19 99.91 4hvp n GLY 94 Ca 0.08 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.87 4hvp n GLY 94 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 4hvp n THR 96 N 0.94 0.00 -3.96 2.61 -2.24 -1.26 -5.02 114.28 105.35 4hvp n THR 96 Ca -0.00 0.00 -0.35 0.00 -2.27 0.00 0.00 64.05 61.43 4hvp n THR 96 Cb 0.00 0.00 -0.09 0.00 -2.10 0.00 0.00 70.33 68.15 4hvp n THR 96 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 4hvp s LEU 97 N 0.00 4.00 0.01 3.22 1.43 -1.26 -5.11 118.68 120.97 4hvp s LEU 97 Ca 0.00 0.20 0.06 0.00 -1.03 0.00 0.00 54.13 53.36 4hvp s LEU 97 Cb 0.00 -2.00 -0.02 0.00 0.03 0.00 0.00 46.19 44.20 4hvp s LEU 97 CO 0.00 0.25 -0.18 0.20 0.23 0.00 0.00 176.35 176.84 4hvp s ASN 98 N -0.06 2.18 0.00 2.29 0.01 -1.26 -5.30 114.94 112.80 4hvp s ASN 98 Ca 0.08 -0.39 0.00 0.00 -0.71 0.00 0.00 52.86 51.84 4hvp s ASN 98 Cb -0.12 -0.22 0.00 0.00 0.41 0.00 0.00 41.25 41.32 4hvp s ASN 98 CO 0.01 0.19 0.00 2.22 -1.51 0.00 0.00 177.10 178.01