#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2jvw s ALA 2 N 0.00 3.70 0.41 3.04 0.00 -1.26 -4.88 121.76 122.77 2jvw s ALA 2 Ca 0.00 1.42 0.14 0.00 0.00 0.00 0.00 51.96 53.52 2jvw s ALA 2 Cb 0.00 -3.80 0.88 0.00 0.00 0.00 0.00 23.12 20.20 2jvw s ALA 2 CO 0.00 -1.37 1.92 -0.07 0.00 0.00 0.00 175.76 176.24 2jvw h LEU 3 N 9.40 0.00 -8.30 0.00 -0.00 -2.14 -3.38 115.31 110.89 2jvw h LEU 3 Ca -0.48 0.00 -0.73 0.00 -0.00 0.00 0.00 57.88 56.68 2jvw h LEU 3 Cb 1.23 0.00 -0.24 0.00 -0.00 0.00 0.00 40.66 41.65 2jvw h LEU 3 CO 0.95 0.27 -0.40 -0.63 -0.00 0.00 0.00 178.44 178.63 2jvw s ILE 4 N -4.41 4.93 -0.36 1.22 -1.09 -1.26 -5.01 121.20 115.22 2jvw s ILE 4 Ca -0.03 -1.05 0.00 0.00 -2.23 0.00 0.00 60.65 57.34 2jvw s ILE 4 Cb 0.15 -3.90 0.14 0.00 -1.58 0.00 0.00 42.46 37.26 2jvw s ILE 4 CO 0.71 -0.48 0.21 -0.32 -1.23 0.00 0.00 174.94 173.83 2jvw s MET 5 N 1.59 0.64 -0.18 2.79 1.75 -1.26 -5.09 119.30 119.53 2jvw s MET 5 Ca 0.04 -1.39 -0.02 0.00 -1.25 0.00 0.00 55.69 53.06 2jvw s MET 5 Cb -0.22 -1.44 0.06 0.00 2.84 0.00 0.00 34.83 36.06 2jvw s MET 5 CO 0.06 -1.19 0.02 0.99 -0.65 0.00 0.00 175.02 174.25 2jvw s THR 6 N 1.01 0.62 -0.09 10.11 2.01 -1.26 -5.13 115.64 122.92 2jvw s THR 6 Ca 0.18 -0.54 0.02 0.00 0.31 0.00 0.00 61.69 61.66 2jvw s THR 6 Cb -0.23 -1.05 0.01 0.00 0.01 0.00 0.00 72.50 71.24 2jvw s THR 6 CO -0.00 -0.13 -0.16 -1.58 -0.69 0.00 0.00 174.62 172.06 2jvw s GLN 7 N 1.82 2.19 -0.07 4.92 0.74 -1.26 -5.07 119.66 122.93 2jvw s GLN 7 Ca -0.01 -0.57 -0.09 0.00 0.05 0.00 0.00 55.36 54.74 2jvw s GLN 7 Cb -0.17 -1.78 -0.05 0.00 1.10 0.00 0.00 33.01 32.11 2jvw s GLN 7 CO -0.08 0.03 0.35 0.37 -0.55 0.00 0.00 175.29 175.41 2jvw h GLN 8 N 7.06 -0.23 0.20 1.67 5.75 -2.08 -3.40 115.11 124.08 2jvw h GLN 8 Ca -0.28 0.02 -0.32 0.00 -0.15 0.00 0.00 58.65 57.91 2jvw h GLN 8 Cb 1.20 0.05 0.02 0.00 1.07 0.00 0.00 27.48 29.82 2jvw h GLN 8 CO 0.48 -0.09 -1.49 -2.95 -2.65 0.00 0.00 178.83 172.12 2jvw h ASN 9 N -1.05 0.68 -5.24 -0.69 7.08 -2.07 -3.50 115.58 110.79 2jvw h ASN 9 Ca -0.02 -0.78 0.00 0.00 -3.08 0.00 0.00 56.30 52.41 2jvw h ASN 9 Cb 0.24 -0.22 -0.01 0.00 -2.08 0.00 0.00 38.32 36.25 2jvw h ASN 9 CO 0.04 1.63 -1.05 0.59 -2.08 0.00 0.00 177.43 176.56 2jvw n ASN 10 N -3.63 -7.20 -0.02 6.14 3.02 -1.26 -4.93 115.26 107.38 2jvw n ASN 10 Ca -0.16 1.35 -0.07 0.00 -0.03 0.00 0.00 54.58 55.66 2jvw n ASN 10 Cb 1.08 -5.00 0.11 0.00 -0.61 0.00 0.00 39.78 35.36 2jvw n ASN 10 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 2jvw h PRO 11 N 3.24 0.61 -4.44 3.52 0.13 -1.98 -3.36 132.00 129.71 2jvw h PRO 11 Ca -0.06 -0.29 -0.66 0.00 -0.87 0.00 0.00 66.00 64.13 2jvw h PRO 11 Cb 0.21 -0.01 -0.01 0.00 0.13 0.00 0.00 31.00 31.32 2jvw h PRO 11 CO 0.08 0.87 2.62 1.47 -0.23 0.00 0.00 178.00 182.82 2jvw n LEU 12 N -4.06 5.46 -0.04 1.56 -0.00 -1.26 -4.48 117.00 114.17 2jvw n LEU 12 Ca -0.01 -3.61 0.10 0.00 -0.00 0.00 0.00 56.01 52.49 2jvw n LEU 12 Cb 0.49 -1.48 -0.11 0.00 -0.00 0.00 0.00 43.42 42.32 2jvw n LEU 12 CO 0.45 0.31 -0.02 1.57 -0.00 0.00 0.00 177.39 179.70 2jvw n HIS 13 N 7.33 0.00 -2.24 1.47 -0.00 -1.26 -4.76 115.22 115.76 2jvw n HIS 13 Ca 0.50 0.00 -0.33 0.00 0.46 0.00 0.00 57.72 58.35 2jvw n HIS 13 Cb 0.41 0.00 -0.04 0.00 -0.12 0.00 0.00 29.99 30.24 2jvw n HIS 13 CO 0.00 0.00 0.00 0.20 0.46 0.00 0.00 176.34 177.00 2jvw s GLY 14 N -2.95 0.65 -0.02 1.57 0.00 -1.26 -4.94 107.32 100.36 2jvw s GLY 14 Ca 0.09 -2.37 -0.30 0.00 0.00 0.00 0.00 44.72 42.15 2jvw s GLY 14 CO 0.84 3.28 2.01 -0.42 0.00 0.00 0.00 173.10 178.82 2jvw s ILE 15 N 8.76 3.03 0.88 0.90 1.01 -1.26 -4.99 121.20 129.52 2jvw s ILE 15 Ca 0.63 0.03 -0.13 0.00 0.00 0.00 0.00 60.65 61.19 2jvw s ILE 15 Cb 0.00 -3.03 0.14 0.00 0.01 0.00 0.00 42.46 39.59 2jvw s ILE 15 CO 0.10 -0.01 1.23 0.42 0.00 0.00 0.00 174.94 176.69 2jvw s THR 16 N 5.27 2.03 0.45 2.92 -4.23 -1.26 -4.80 115.64 116.02 2jvw s THR 16 Ca 0.91 -0.06 0.10 0.00 -1.18 0.00 0.00 61.69 61.46 2jvw s THR 16 Cb -0.40 -2.97 0.27 0.00 1.34 0.00 0.00 72.50 70.73 2jvw s THR 16 CO 0.40 0.00 2.09 0.25 -0.54 0.00 0.00 174.62 176.82 2jvw h LEU 17 N -1.30 0.31 0.20 4.79 5.85 -1.98 0.26 115.31 123.43 2jvw h LEU 17 Ca -0.44 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.26 2jvw h LEU 17 Cb 1.28 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 42.23 2jvw h LEU 17 CO 0.49 0.22 -0.09 -0.61 -0.34 0.00 0.00 178.44 178.11 2jvw h GLN 18 N 0.36 -0.25 -0.03 1.25 -0.00 -1.99 -1.55 115.11 112.89 2jvw h GLN 18 Ca 0.10 0.02 -0.05 0.00 -0.00 0.00 0.00 58.65 58.72 2jvw h GLN 18 Cb -0.03 0.06 -0.01 0.00 0.00 0.00 0.00 27.48 27.50 2jvw h GLN 18 CO -0.02 0.09 -0.21 -0.22 0.00 0.00 0.00 178.83 178.48 2jvw h LYS 19 N -0.64 0.05 0.60 1.69 1.63 -1.86 -1.15 116.57 116.89 2jvw h LYS 19 Ca -0.03 -0.01 -0.03 0.00 -0.85 0.00 0.00 60.65 59.73 2jvw h LYS 19 Cb 0.46 -0.01 0.01 0.00 -0.60 0.00 0.00 32.23 32.09 2jvw h LYS 19 CO 0.04 0.26 -0.29 1.25 -3.45 0.00 0.00 179.45 177.26 2jvw h LEU 20 N 0.05 -0.69 -0.94 5.20 6.46 -0.41 -0.16 115.31 124.81 2jvw h LEU 20 Ca 0.01 0.02 0.08 0.00 -0.12 0.00 0.00 57.88 57.87 2jvw h LEU 20 Cb 0.39 0.18 -0.07 0.00 -0.73 0.00 0.00 40.66 40.43 2jvw h LEU 20 CO 0.03 -0.49 0.59 0.25 -0.62 0.00 0.00 178.44 178.20 2jvw h LEU 21 N -0.81 0.92 0.07 2.25 5.85 -1.02 -1.68 115.31 120.89 2jvw h LEU 21 Ca -0.08 0.02 0.02 0.00 0.84 0.00 0.00 57.88 58.68 2jvw h LEU 21 Cb 0.62 -0.17 -0.03 0.00 0.37 0.00 0.00 40.66 41.46 2jvw h LEU 21 CO 0.13 0.56 -0.20 0.74 -0.34 0.00 0.00 178.44 179.33 2jvw h THR 22 N 1.04 0.53 -0.05 1.05 2.02 -0.95 -1.27 112.91 115.28 2jvw h THR 22 Ca 0.43 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 67.58 2jvw h THR 22 Cb 0.26 0.53 -0.01 0.00 -1.74 0.00 0.00 68.15 67.20 2jvw h THR 22 CO -0.20 0.00 -0.08 -0.33 0.37 0.00 0.00 175.52 175.28 2jvw h GLU 23 N -0.36 0.07 -0.50 6.66 4.39 -0.62 -0.85 114.58 123.37 2jvw h GLU 23 Ca 0.04 -0.01 -0.12 0.00 0.34 0.00 0.00 59.36 59.61 2jvw h GLU 23 Cb 0.40 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 29.02 2jvw h GLU 23 CO -0.14 0.16 -0.15 -0.07 -1.16 0.00 0.00 179.01 177.65 2jvw h LEU 24 N 0.07 0.98 -0.58 1.33 3.38 -0.79 0.14 115.31 119.85 2jvw h LEU 24 Ca 0.02 -0.34 -0.05 0.00 0.09 0.00 0.00 57.88 57.60 2jvw h LEU 24 Cb 0.19 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 2jvw h LEU 24 CO 0.01 1.12 0.16 0.58 0.09 0.00 0.00 178.44 180.40 2jvw h VAL 25 N 0.85 1.24 -0.05 1.22 2.07 -0.29 0.16 116.25 121.46 2jvw h VAL 25 Ca 0.13 -0.85 -0.01 0.00 0.82 0.00 0.00 66.70 66.78 2jvw h VAL 25 Cb 0.71 0.70 -0.00 0.00 -1.52 0.00 0.00 31.29 31.18 2jvw h VAL 25 CO 0.05 0.32 -0.02 -0.33 0.02 0.00 0.00 177.57 177.61 2jvw h GLU 26 N 0.82 0.11 0.00 1.57 4.39 -1.03 -2.49 114.58 117.95 2jvw h GLU 26 Ca 0.18 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.84 2jvw h GLU 26 Cb 0.31 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.96 2jvw h GLU 26 CO -0.00 0.46 -0.71 0.45 -1.16 0.00 0.00 179.01 178.05 2jvw h HIS 27 N -0.25 0.00 0.00 4.33 3.86 -0.75 -3.43 115.15 118.90 2jvw h HIS 27 Ca 0.01 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.22 2jvw h HIS 27 Cb 0.43 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.90 2jvw h HIS 27 CO 0.06 0.00 0.00 0.66 0.86 0.00 0.00 177.93 179.51 2jvw n TYR 28 N -2.41 -0.00 0.00 2.45 4.02 0.40 -5.05 117.16 116.57 2jvw n TYR 28 Ca 0.02 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.91 2jvw n TYR 28 Cb 0.49 0.13 0.00 0.00 -0.02 0.00 0.00 39.34 39.94 2jvw n TYR 28 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2jvw n GLY 29 N 2.99 3.09 0.28 2.72 0.00 -0.33 -4.71 105.19 109.23 2jvw n GLY 29 Ca 0.00 -1.83 0.11 0.00 0.00 0.00 0.00 46.02 44.30 2jvw n GLY 29 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 2jvw h TRP 30 N 0.00 0.00 -0.07 1.61 4.06 -1.87 -0.44 115.95 119.24 2jvw h TRP 30 Ca 0.00 0.00 -0.05 0.00 2.06 0.00 0.00 58.89 60.90 2jvw h TRP 30 Cb 0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.15 2jvw h TRP 30 CO 0.00 0.00 -0.17 0.93 -3.56 0.00 0.00 178.44 175.64 2jvw h GLU 31 N 0.00 0.12 0.22 0.49 3.07 -1.94 0.00 114.58 116.54 2jvw h GLU 31 Ca 0.00 -0.03 -0.34 0.00 -0.50 0.00 0.00 59.36 58.49 2jvw h GLU 31 Cb 0.01 -0.02 0.02 0.00 -0.84 0.00 0.00 28.75 27.93 2jvw h GLU 31 CO -0.00 0.30 -1.61 0.93 -1.40 0.00 0.00 179.01 177.22 2jvw h GLU 32 N 0.11 0.47 -0.03 2.33 4.39 -1.39 -3.24 114.58 117.22 2jvw h GLU 32 Ca 0.02 -0.80 -0.00 0.00 0.34 0.00 0.00 59.36 58.92 2jvw h GLU 32 Cb 0.38 0.30 -0.00 0.00 -0.10 0.00 0.00 28.75 29.33 2jvw h GLU 32 CO 0.03 1.38 0.02 -0.07 -1.16 0.00 0.00 179.01 179.21 2jvw h LEU 33 N 0.12 0.04 -1.38 1.33 3.38 -1.08 -1.15 115.31 116.57 2jvw h LEU 33 Ca -0.30 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 57.60 2jvw h LEU 33 Cb 2.13 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 42.87 2jvw h LEU 33 CO 0.23 0.10 0.00 0.77 0.09 0.00 0.00 178.44 179.62 2jvw h SER 34 N -0.02 0.00 0.12 -0.43 4.64 -1.17 0.17 113.55 116.86 2jvw h SER 34 Ca 0.01 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 61.13 2jvw h SER 34 Cb 0.07 0.00 0.01 0.00 -0.31 0.00 0.00 62.40 62.17 2jvw h SER 34 CO -0.00 0.00 -0.94 0.22 -0.87 0.00 0.00 176.83 175.24 2jvw h TYR 35 N 0.00 0.46 0.00 4.77 3.20 -1.39 -3.37 116.97 120.64 2jvw h TYR 35 Ca 0.00 -0.34 0.00 0.00 3.14 0.00 0.00 58.73 61.53 2jvw h TYR 35 Cb 0.22 -0.02 0.00 0.00 1.54 0.00 0.00 36.73 38.47 2jvw h TYR 35 CO 0.00 1.36 -0.35 -1.33 -1.64 0.00 0.00 178.16 176.20 2jvw n MET 36 N -4.11 0.28 -3.68 1.82 2.81 -0.50 -4.60 117.12 109.13 2jvw n MET 36 Ca -0.17 0.14 -0.30 0.00 -1.81 0.00 0.00 57.70 55.57 2jvw n MET 36 Cb 0.82 -1.74 -0.15 0.00 -0.71 0.00 0.00 33.22 31.44 2jvw n MET 36 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 2jvw s VAL 37 N -3.14 0.61 -1.08 2.03 1.01 0.56 -5.01 120.40 115.39 2jvw s VAL 37 Ca 0.08 -1.20 -0.18 0.00 0.00 0.00 0.00 61.98 60.67 2jvw s VAL 37 Cb 0.13 -1.47 0.11 0.00 0.00 0.00 0.00 36.38 35.15 2jvw s VAL 37 CO 0.67 -0.68 1.38 0.20 0.00 0.00 0.00 175.10 176.67 2jvw s ASN 38 N 1.75 6.74 0.02 3.32 0.01 -1.26 -4.36 114.94 121.16 2jvw s ASN 38 Ca 0.09 -2.19 0.01 0.00 -0.71 0.00 0.00 52.86 50.06 2jvw s ASN 38 Cb -0.17 -2.47 -0.01 0.00 0.41 0.00 0.00 41.25 39.01 2jvw s ASN 38 CO -0.28 -1.12 -0.05 0.27 -1.51 0.00 0.00 177.10 174.42 2jvw s ILE 39 N 3.25 0.31 -1.08 0.60 -4.36 -1.26 -5.06 121.20 113.59 2jvw s ILE 39 Ca 0.42 -0.62 -0.19 0.00 -0.26 0.00 0.00 60.65 60.00 2jvw s ILE 39 Cb -0.02 -0.35 -0.07 0.00 1.25 0.00 0.00 42.46 43.28 2jvw s ILE 39 CO -0.04 -0.21 2.04 -3.20 0.24 0.00 0.00 174.94 173.76 2jvw n ASN 40 N 2.17 3.17 0.17 4.36 2.85 -1.26 -3.76 115.26 122.96 2jvw n ASN 40 Ca -0.19 -2.75 0.00 0.00 -0.11 0.00 0.00 54.58 51.53 2jvw n ASN 40 Cb 0.57 -1.38 0.00 0.00 1.24 0.00 0.00 39.78 40.21 2jvw n ASN 40 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2jvw h PHE 42 N 0.00 0.00 0.09 0.00 0.04 -1.91 -2.28 116.94 112.88 2jvw h PHE 42 Ca 0.00 0.00 -0.26 0.00 2.80 0.00 0.00 57.97 60.51 2jvw h PHE 42 Cb 0.00 0.00 0.01 0.00 2.20 0.00 0.00 35.95 38.16 2jvw h PHE 42 CO 0.00 0.10 -1.14 -0.22 -0.60 0.00 0.00 178.31 176.45 2jvw h LYS 43 N 0.00 0.38 -5.31 1.51 3.11 -1.90 -3.36 116.57 111.00 2jvw h LYS 43 Ca -0.00 -0.53 -0.71 0.00 -2.81 0.00 0.00 60.65 56.60 2jvw h LYS 43 Cb 0.18 0.18 -0.13 0.00 -1.00 0.00 0.00 32.23 31.46 2jvw h LYS 43 CO 0.01 1.21 1.74 0.21 -2.81 0.00 0.00 179.45 179.81 2jvw s LYS 44 N -2.93 4.02 -0.18 1.90 2.20 -0.86 -4.68 119.74 119.21 2jvw s LYS 44 Ca -0.06 -2.25 -0.12 0.00 -0.36 0.00 0.00 55.97 53.18 2jvw s LYS 44 Cb 0.07 -5.29 0.05 0.00 -1.51 0.00 0.00 37.83 31.15 2jvw s LYS 44 CO 0.89 -2.01 0.25 -3.47 -0.36 0.00 0.00 175.35 170.65 2jvw n ASP 45 N 7.02 -0.62 -4.52 1.43 2.03 -1.26 -4.72 116.55 115.91 2jvw n ASP 45 Ca 0.42 1.37 -0.34 0.00 0.52 0.00 0.00 54.79 56.76 2jvw n ASP 45 Cb 0.45 -5.29 -0.11 0.00 -0.72 0.00 0.00 41.12 35.45 2jvw n ASP 45 CO 0.00 0.00 0.00 -2.65 -1.92 0.00 0.00 177.20 172.63 2jvw n PRO 46 N 1.72 0.43 -4.08 -0.67 -0.02 -1.26 -4.89 135.00 126.23 2jvw n PRO 46 Ca -0.42 -0.09 -0.32 0.00 -2.02 0.00 0.00 63.50 60.65 2jvw n PRO 46 Cb 0.64 -2.38 -0.16 0.00 -0.02 0.00 0.00 33.50 31.59 2jvw n PRO 46 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 2jvw s SER 47 N 9.33 3.69 0.09 2.55 0.01 -1.26 -5.03 113.70 123.08 2jvw s SER 47 Ca 1.17 -0.98 -0.32 0.00 1.31 0.00 0.00 55.95 57.14 2jvw s SER 47 Cb -0.70 -1.47 -0.14 0.00 0.21 0.00 0.00 66.02 63.92 2jvw s SER 47 CO 0.37 -0.10 1.61 0.40 0.41 0.00 0.00 173.24 175.94 2jvw h ILE 48 N 6.33 0.25 -0.29 1.44 1.08 -2.00 -1.67 117.51 122.66 2jvw h ILE 48 Ca -0.33 0.00 -0.11 0.00 -0.39 0.00 0.00 64.86 64.03 2jvw h ILE 48 Cb 1.09 0.25 -0.00 0.00 -3.07 0.00 0.00 36.82 35.09 2jvw h ILE 48 CO 0.54 0.00 -0.26 0.11 -0.69 0.00 0.00 178.15 177.85 2jvw h LYS 49 N -0.76 0.68 -0.55 2.37 1.57 -1.99 -2.22 116.57 115.66 2jvw h LYS 49 Ca -0.03 -0.35 0.00 0.00 -1.87 0.00 0.00 60.65 58.40 2jvw h LYS 49 Cb 0.68 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.97 2jvw h LYS 49 CO -0.06 0.96 0.35 1.03 -0.57 0.00 0.00 179.45 181.16 2jvw h SER 50 N 0.42 0.65 -0.09 0.86 0.87 -1.99 -0.05 113.55 114.22 2jvw h SER 50 Ca 0.05 -0.04 0.01 0.00 -1.23 0.00 0.00 61.79 60.58 2jvw h SER 50 Cb 0.82 -0.16 -0.01 0.00 -0.44 0.00 0.00 62.40 62.61 2jvw h SER 50 CO 0.07 0.49 0.03 0.28 -0.53 0.00 0.00 176.83 177.17 2jvw h SER 51 N 0.74 0.04 -0.77 6.23 0.02 -1.20 0.20 113.55 118.82 2jvw h SER 51 Ca 0.20 0.01 0.04 0.00 -0.84 0.00 0.00 61.79 61.20 2jvw h SER 51 Cb -0.05 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 62.44 2jvw h SER 51 CO -0.04 0.04 0.48 -0.07 -1.14 0.00 0.00 176.83 176.10 2jvw h LEU 52 N 0.08 0.77 -1.24 5.07 3.38 -1.22 0.14 115.31 122.30 2jvw h LEU 52 Ca 0.04 0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 2jvw h LEU 52 Cb 0.02 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 40.59 2jvw h LEU 52 CO -0.04 0.51 0.14 0.50 0.09 0.00 0.00 178.44 179.64 2jvw h LYS 53 N 0.91 0.66 -0.23 1.13 3.11 -0.58 -2.24 116.57 119.33 2jvw h LYS 53 Ca 0.32 -0.11 -0.17 0.00 -2.81 0.00 0.00 60.65 57.89 2jvw h LYS 53 Cb 0.08 -0.11 -0.00 0.00 -1.00 0.00 0.00 32.23 31.19 2jvw h LYS 53 CO -0.14 0.59 -0.53 0.35 -2.81 0.00 0.00 179.45 176.90 2jvw h PHE 54 N 0.65 0.82 0.00 1.91 3.57 0.44 -3.02 116.94 121.31 2jvw h PHE 54 Ca 0.15 -0.29 -0.03 0.00 3.53 0.00 0.00 57.97 61.34 2jvw h PHE 54 Cb 0.20 -0.16 -0.00 0.00 2.79 0.00 0.00 35.95 38.78 2jvw h PHE 54 CO 0.01 1.05 -0.12 -0.07 -2.23 0.00 0.00 178.31 176.95 2jvw h LEU 55 N 0.51 0.00 -1.82 0.59 3.38 -0.26 -0.29 115.31 117.42 2jvw h LEU 55 Ca 0.01 0.00 0.06 0.00 0.09 0.00 0.00 57.88 58.05 2jvw h LEU 55 Cb 1.09 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.83 2jvw h LEU 55 CO 0.11 0.12 0.25 0.03 0.09 0.00 0.00 178.44 179.04 2jvw h ARG 56 N 0.00 0.21 0.00 1.13 3.08 -1.28 -3.11 114.38 114.42 2jvw h ARG 56 Ca -0.00 -0.01 -0.15 0.00 0.07 0.00 0.00 59.98 59.88 2jvw h ARG 56 Cb 0.24 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.22 2jvw h ARG 56 CO 0.02 0.14 -1.03 1.63 -1.07 0.00 0.00 179.97 179.66 2jvw n LYS 57 N -4.47 0.52 -2.86 0.04 5.02 -0.68 -4.70 118.16 111.03 2jvw n LYS 57 Ca 0.05 0.54 -0.44 0.00 -2.02 0.00 0.00 58.31 56.44 2jvw n LYS 57 Cb 0.28 -1.71 -0.01 0.00 -0.02 0.00 0.00 35.03 33.57 2jvw n LYS 57 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 2jvw s THR 58 N -2.33 4.78 0.17 -0.18 2.01 -0.21 -4.85 115.64 115.03 2jvw s THR 58 Ca -0.24 -2.27 -0.12 0.00 0.31 0.00 0.00 61.69 59.37 2jvw s THR 58 Cb 0.05 -4.95 0.07 0.00 0.01 0.00 0.00 72.50 67.68 2jvw s THR 58 CO 0.45 -1.69 1.69 -2.24 -0.69 0.00 0.00 174.62 172.14 2jvw h ASP 59 N 7.59 0.86 -0.18 3.53 2.03 -1.83 -2.85 116.42 125.58 2jvw h ASP 59 Ca 0.31 -0.21 -0.00 0.00 -0.73 0.00 0.00 57.03 56.39 2jvw h ASP 59 Cb 0.90 -0.23 -0.01 0.00 -0.83 0.00 0.00 39.33 39.17 2jvw h ASP 59 CO 1.27 0.85 0.11 4.11 -1.03 0.00 0.00 179.24 184.55 2jvw h TRP 60 N 0.83 0.25 -0.40 4.15 5.08 -1.89 -1.04 115.95 122.94 2jvw h TRP 60 Ca 0.19 0.00 -0.03 0.00 1.08 0.00 0.00 58.89 60.13 2jvw h TRP 60 Cb 0.30 -0.08 -0.02 0.00 -3.00 0.00 0.00 29.16 26.36 2jvw h TRP 60 CO 0.02 0.18 0.12 0.00 -1.28 0.00 0.00 178.44 177.48 2jvw h ALA 61 N 1.86 0.52 -0.99 0.11 0.00 -1.87 -2.10 119.26 116.78 2jvw h ALA 61 Ca 0.07 -0.17 0.07 0.00 0.00 0.00 0.00 54.91 54.88 2jvw h ALA 61 Cb 0.00 -0.15 -0.07 0.00 0.00 0.00 0.00 17.79 17.57 2jvw h ALA 61 CO -0.01 0.17 0.64 -0.09 0.00 0.00 0.00 179.25 179.95 2jvw h ARG 62 N 0.49 1.12 -0.66 0.00 1.12 -1.14 0.14 114.38 115.45 2jvw h ARG 62 Ca 0.13 -0.07 -0.03 0.00 -1.11 0.00 0.00 59.98 58.90 2jvw h ARG 62 Cb 0.26 -0.25 -0.03 0.00 -0.01 0.00 0.00 29.97 29.94 2jvw h ARG 62 CO -0.00 0.74 0.30 0.93 -3.11 0.00 0.00 179.97 178.82 2jvw h GLU 63 N 1.15 0.95 -0.05 0.20 5.08 -1.08 -1.52 114.58 119.31 2jvw h GLU 63 Ca 0.43 -0.14 -0.15 0.00 -1.00 0.00 0.00 59.36 58.50 2jvw h GLU 63 Cb 0.18 -0.17 -0.01 0.00 0.50 0.00 0.00 28.75 29.25 2jvw h GLU 63 CO -0.18 0.75 -0.65 0.00 -1.00 0.00 0.00 179.01 177.93 2jvw h ARG 64 N 0.94 0.21 0.38 2.33 3.08 -0.55 -2.23 114.38 118.54 2jvw h ARG 64 Ca 0.23 -0.16 -0.02 0.00 0.07 0.00 0.00 59.98 60.10 2jvw h ARG 64 Cb 0.13 0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.21 2jvw h ARG 64 CO -0.03 0.79 -0.18 0.28 -1.07 0.00 0.00 179.97 179.76 2jvw h VAL 65 N 0.15 0.64 0.00 2.04 2.07 -0.20 -2.49 116.25 118.46 2jvw h VAL 65 Ca -0.01 -0.23 -0.03 0.00 0.82 0.00 0.00 66.70 67.25 2jvw h VAL 65 Cb 1.17 0.76 -0.00 0.00 -1.52 0.00 0.00 31.29 31.69 2jvw h VAL 65 CO 0.10 0.05 -0.15 1.05 0.02 0.00 0.00 177.57 178.64 2jvw h GLU 66 N -0.63 0.00 -0.63 1.57 4.11 -1.36 -1.73 114.58 115.90 2jvw h GLU 66 Ca -0.05 0.00 0.02 0.00 0.07 0.00 0.00 59.36 59.39 2jvw h GLU 66 Cb 0.46 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.68 2jvw h GLU 66 CO 0.08 0.15 0.41 -0.97 0.07 0.00 0.00 179.01 178.75 2jvw h ASN 67 N 0.00 0.69 -0.94 3.06 -1.24 -1.20 0.99 115.58 116.94 2jvw h ASN 67 Ca -0.00 -0.01 0.03 0.00 0.71 0.00 0.00 56.30 57.03 2jvw h ASN 67 Cb 0.43 -0.16 -0.05 0.00 0.73 0.00 0.00 38.32 39.27 2jvw h ASN 67 CO 0.02 0.49 0.62 0.40 -1.29 0.00 0.00 177.43 177.67 2jvw h ILE 68 N 0.82 1.18 -0.68 2.57 2.04 -0.87 -0.69 117.51 121.89 2jvw h ILE 68 Ca 0.24 -0.42 0.01 0.00 1.00 0.00 0.00 64.86 65.69 2jvw h ILE 68 Cb -0.05 -0.13 -0.03 0.00 -0.74 0.00 0.00 36.82 35.86 2jvw h ILE 68 CO -0.07 0.22 0.45 0.22 0.00 0.00 0.00 178.15 178.97 2jvw h TYR 69 N 1.21 0.86 -0.50 1.37 3.20 -1.00 -1.13 116.97 120.98 2jvw h TYR 69 Ca 0.37 0.02 0.00 0.00 3.14 0.00 0.00 58.73 62.26 2jvw h TYR 69 Cb -0.04 -0.29 -0.02 0.00 1.54 0.00 0.00 36.73 37.92 2jvw h TYR 69 CO -0.01 0.54 0.32 -0.07 -1.64 0.00 0.00 178.16 177.31 2jvw h LEU 70 N 0.92 0.58 -1.08 2.82 3.38 -0.16 0.05 115.31 121.82 2jvw h LEU 70 Ca 0.25 -0.02 0.11 0.00 0.09 0.00 0.00 57.88 58.30 2jvw h LEU 70 Cb -0.10 -0.14 -0.08 0.00 0.09 0.00 0.00 40.66 40.43 2jvw h LEU 70 CO -0.05 0.43 0.62 0.11 0.09 0.00 0.00 178.44 179.63 2jvw h LYS 71 N 0.67 0.94 -0.06 1.13 1.57 -0.78 -1.01 116.57 119.03 2jvw h LYS 71 Ca 0.18 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.89 2jvw h LYS 71 Cb -0.06 -0.21 -0.00 0.00 0.08 0.00 0.00 32.23 32.03 2jvw h LYS 71 CO -0.04 0.62 -0.00 1.25 -0.57 0.00 0.00 179.45 180.71 2jvw h LEU 72 N 0.97 0.11 -1.73 2.94 5.85 -0.45 -2.71 115.31 120.29 2jvw h LEU 72 Ca 0.47 -0.33 -0.03 0.00 0.84 0.00 0.00 57.88 58.82 2jvw h LEU 72 Cb 0.45 -0.03 -0.00 0.00 0.37 0.00 0.00 40.66 41.45 2jvw h LEU 72 CO -0.23 0.42 -0.15 1.56 -0.34 0.00 0.00 178.44 179.70 2jvw h GLN 73 N -0.20 0.00 0.00 1.25 1.08 -0.54 0.13 115.11 116.84 2jvw h GLN 73 Ca 0.02 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.22 2jvw h GLN 73 Cb 0.36 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.79 2jvw h GLN 73 CO 0.00 0.15 -0.20 2.89 -0.95 0.00 0.00 178.83 180.72 2jvw n ARG 74 N -3.57 0.21 0.00 1.46 1.85 -0.43 -3.25 116.66 112.93 2jvw n ARG 74 Ca -0.01 0.13 0.12 0.00 -1.00 0.00 0.00 57.85 57.08 2jvw n ARG 74 Cb 0.28 -1.70 0.10 0.00 -1.05 0.00 0.00 32.46 30.09 2jvw n ARG 74 CO 0.00 0.00 0.00 0.72 -0.01 0.00 0.00 177.63 178.34 2jvw n HIS 75 N -2.04 0.00 -1.86 2.89 8.25 0.32 -4.71 115.22 118.07 2jvw n HIS 75 Ca 0.05 0.00 -0.27 0.00 -0.26 0.00 0.00 57.72 57.24 2jvw n HIS 75 Cb 0.41 -0.02 -0.07 0.00 1.12 0.00 0.00 29.99 31.42 2jvw n HIS 75 CO 0.00 0.00 0.00 1.17 0.64 0.00 0.00 176.34 178.15 2jvw n LYS 76 N 0.02 1.28 -2.23 -0.41 4.81 -0.33 -4.88 118.16 116.42 2jvw n LYS 76 Ca 0.11 -2.24 -0.32 0.00 -0.87 0.00 0.00 58.31 54.98 2jvw n LYS 76 Cb 0.46 -3.68 -0.04 0.00 0.02 0.00 0.00 35.03 31.79 2jvw n LYS 76 CO 0.00 0.00 0.00 -1.21 1.17 0.00 0.00 177.40 177.36 2jvw s GLU 77 N 6.75 2.93 0.29 1.64 2.02 -1.26 -4.81 118.70 126.25 2jvw s GLU 77 Ca 0.70 -0.68 -0.03 0.00 0.02 0.00 0.00 54.97 54.98 2jvw s GLU 77 Cb 0.00 -5.19 0.40 0.00 0.10 0.00 0.00 34.13 29.44 2jvw s GLU 77 CO 0.15 -3.02 1.94 0.07 0.02 0.00 0.00 175.26 174.42 2jvw h ARG 78 N 10.56 1.10 -7.26 1.61 0.11 -1.97 -3.45 114.38 115.08 2jvw h ARG 78 Ca 0.15 -0.09 -0.46 0.00 0.10 0.00 0.00 59.98 59.68 2jvw h ARG 78 Cb 1.00 -0.23 0.10 0.00 1.11 0.00 0.00 29.97 31.94 2jvw h ARG 78 CO 1.29 0.76 0.17 0.54 0.10 0.00 0.00 179.97 182.83 2jvw s ASN 79 N -6.31 4.10 0.00 0.08 2.20 -1.26 -5.04 114.94 108.71 2jvw s ASN 79 Ca -0.12 -0.23 0.02 0.00 -0.94 0.00 0.00 52.86 51.60 2jvw s ASN 79 Cb 0.17 -0.08 0.03 0.00 -2.00 0.00 0.00 41.25 39.37 2jvw s ASN 79 CO 0.80 -2.04 0.71 0.00 -2.94 0.00 0.00 177.10 173.63 2jvw n GLN 80 N -3.02 0.39 -3.54 3.55 10.64 -1.26 -5.07 117.38 119.07 2jvw n GLN 80 Ca 0.15 -0.92 -0.08 0.00 -1.83 0.00 0.00 57.00 54.32 2jvw n GLN 80 Cb 0.60 -1.04 -0.02 0.00 -0.86 0.00 0.00 30.24 28.92 2jvw n GLN 80 CO 0.00 0.00 0.00 -0.48 -1.83 0.00 0.00 177.06 174.75 2jvw s LEU 81 N -0.42 -0.38 0.00 2.61 2.34 -1.26 -5.28 118.68 116.29 2jvw s LEU 81 Ca 0.03 -0.09 0.09 0.00 0.06 0.00 0.00 54.13 54.22 2jvw s LEU 81 Cb 0.02 2.21 0.07 0.00 -0.56 0.00 0.00 46.19 47.93 2jvw s LEU 81 CO 0.03 -0.78 0.79 -0.62 -1.06 0.00 0.00 176.35 174.71