#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 3.99 -1.10 3.17 0.00 -1.26 -5.02 121.76 121.54 2jvw s ALA 2 Ca 0.00 -1.89 -0.23 0.00 0.00 0.00 0.00 51.96 49.84 2jvw s ALA 2 Cb 0.00 -0.96 -0.05 0.00 0.00 0.00 0.00 23.12 22.11 2jvw s ALA 2 CO 0.00 -0.20 1.88 -1.17 0.00 0.00 0.00 175.76 176.28 2jvw s LEU 3 N -4.10 3.20 -0.65 0.00 0.20 -1.26 -4.92 118.68 111.16 2jvw s LEU 3 Ca 0.47 -1.45 -0.26 0.00 0.69 0.00 0.00 54.13 53.57 2jvw s LEU 3 Cb -0.03 -2.58 0.04 0.00 -0.43 0.00 0.00 46.19 43.19 2jvw s LEU 3 CO 0.27 -2.66 1.16 0.27 -0.29 0.00 0.00 176.35 175.11 2jvw s ILE 4 N 9.57 3.99 -0.99 6.68 -4.36 -1.26 -4.97 121.20 129.86 2jvw s ILE 4 Ca 0.66 0.46 -0.23 0.00 -0.26 0.00 0.00 60.65 61.27 2jvw s ILE 4 Cb -0.02 -4.78 0.01 0.00 1.25 0.00 0.00 42.46 38.93 2jvw s ILE 4 CO 0.07 -1.54 1.65 -0.32 0.24 0.00 0.00 174.94 175.04 2jvw s MET 5 N 5.03 3.20 0.00 0.37 1.75 -1.26 -4.69 119.30 123.69 2jvw s MET 5 Ca 0.35 -0.84 0.00 0.00 -1.25 0.00 0.00 55.69 53.95 2jvw s MET 5 Cb -0.10 -5.25 0.00 0.00 2.84 0.00 0.00 34.83 32.32 2jvw s MET 5 CO 0.18 -2.68 0.00 2.41 -0.65 0.00 0.00 175.02 174.29 2jvw n THR 6 N 7.26 0.00 -0.18 10.11 -1.04 -1.26 -4.65 114.28 124.52 2jvw n THR 6 Ca 0.36 0.00 0.12 0.00 -2.04 0.00 0.00 64.05 62.49 2jvw n THR 6 Cb 0.49 0.00 0.23 0.00 -1.82 0.00 0.00 70.33 69.23 2jvw n THR 6 CO 0.00 0.00 0.00 1.67 -0.64 0.00 0.00 175.07 176.10 2jvw n GLN 7 N 0.00 -0.04 -2.09 -2.82 7.27 -1.26 -3.73 117.38 114.70 2jvw n GLN 7 Ca 0.00 0.77 -0.28 0.00 0.07 0.00 0.00 57.00 57.56 2jvw n GLN 7 Cb 0.00 -1.30 -0.05 0.00 2.41 0.00 0.00 30.24 31.30 2jvw n GLN 7 CO 0.00 0.00 0.00 -1.14 0.07 0.00 0.00 177.06 175.99 2jvw s GLN 8 N -5.13 2.60 0.01 3.69 -0.44 -1.26 -4.52 119.66 114.61 2jvw s GLN 8 Ca -0.06 -0.80 -0.00 0.00 -2.50 0.00 0.00 55.36 52.00 2jvw s GLN 8 Cb 0.17 -5.17 -0.00 0.00 -1.64 0.00 0.00 33.01 26.36 2jvw s GLN 8 CO 0.42 -3.60 -0.01 0.09 0.50 0.00 0.00 175.29 172.69 2jvw n ASN 9 N 13.84 0.18 -4.11 6.67 5.03 -1.24 -5.09 115.26 130.54 2jvw n ASN 9 Ca 0.42 0.02 -0.24 0.00 0.87 0.00 0.00 54.58 55.66 2jvw n ASN 9 Cb 0.47 -0.10 -0.16 0.00 -1.02 0.00 0.00 39.78 38.97 2jvw n ASN 9 CO 0.00 0.00 0.00 0.21 -1.83 0.00 0.00 177.26 175.64 2jvw s ASN 10 N -5.07 1.82 0.47 6.41 3.84 -1.26 -5.04 114.94 116.11 2jvw s ASN 10 Ca -0.00 -0.29 0.22 0.00 0.21 0.00 0.00 52.86 53.00 2jvw s ASN 10 Cb 0.00 -0.36 1.24 0.00 -0.55 0.00 0.00 41.25 41.58 2jvw s ASN 10 CO 0.01 0.15 1.91 1.55 -2.79 0.00 0.00 177.10 177.93 2jvw h PRO 11 N 6.04 0.21 0.02 0.43 0.13 -1.97 -2.95 132.00 133.90 2jvw h PRO 11 Ca -0.34 -0.01 -0.33 0.00 -0.87 0.00 0.00 66.00 64.44 2jvw h PRO 11 Cb 1.16 -0.05 -0.05 0.00 0.13 0.00 0.00 31.00 32.20 2jvw h PRO 11 CO 0.48 0.14 -1.85 1.28 -0.23 0.00 0.00 178.00 177.83 2jvw n LEU 12 N -4.42 2.07 -0.99 1.56 7.99 -1.26 -5.12 117.00 116.84 2jvw n LEU 12 Ca 0.16 0.33 0.00 0.00 -0.01 0.00 0.00 56.01 56.49 2jvw n LEU 12 Cb 0.70 -0.94 0.00 0.00 -0.11 0.00 0.00 43.42 43.08 2jvw n LEU 12 CO 0.34 0.49 -0.28 1.57 -1.51 0.00 0.00 177.39 178.00 2jvw n HIS 13 N -4.17 -2.74 0.00 -1.77 -0.00 -1.12 -4.89 115.22 100.53 2jvw n HIS 13 Ca -0.40 1.46 0.00 0.00 -0.00 0.00 0.00 57.72 58.78 2jvw n HIS 13 Cb 0.82 -2.58 0.00 0.00 -0.00 0.00 0.00 29.99 28.23 2jvw n HIS 13 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2jvw n GLY 14 N -0.91 2.03 3.64 1.57 0.00 -1.26 -4.99 105.19 105.26 2jvw n GLY 14 Ca 0.00 -0.67 -0.43 0.00 0.00 0.00 0.00 46.02 44.92 2jvw n GLY 14 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2jvw s ILE 15 N 0.00 3.66 0.74 -0.61 1.01 -1.26 -5.00 121.20 119.74 2jvw s ILE 15 Ca 0.00 0.76 -0.11 0.00 0.00 0.00 0.00 60.65 61.30 2jvw s ILE 15 Cb 0.00 -3.63 0.04 0.00 0.01 0.00 0.00 42.46 38.87 2jvw s ILE 15 CO 0.00 -0.23 1.07 0.42 0.00 0.00 0.00 174.94 176.21 2jvw s THR 16 N 5.00 3.64 0.56 2.92 -4.23 -1.26 -4.72 115.64 117.55 2jvw s THR 16 Ca 0.72 0.53 0.30 0.00 -1.18 0.00 0.00 61.69 62.07 2jvw s THR 16 Cb -0.27 -3.20 0.43 0.00 1.34 0.00 0.00 72.50 70.81 2jvw s THR 16 CO 0.29 -0.70 1.86 0.25 -0.54 0.00 0.00 174.62 175.79 2jvw h LEU 17 N -0.92 0.00 0.76 4.79 5.85 -1.98 0.10 115.31 123.92 2jvw h LEU 17 Ca -0.44 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.24 2jvw h LEU 17 Cb 1.23 0.00 0.01 0.00 0.37 0.00 0.00 40.66 42.27 2jvw h LEU 17 CO 0.56 0.00 -0.37 -0.61 -0.34 0.00 0.00 178.44 177.68 2jvw h GLN 18 N 0.00 -0.99 -0.04 1.25 4.15 -1.98 -0.44 115.11 117.06 2jvw h GLN 18 Ca 0.34 0.07 -0.12 0.00 0.77 0.00 0.00 58.65 59.70 2jvw h GLN 18 Cb 1.54 0.22 -0.01 0.00 0.21 0.00 0.00 27.48 29.44 2jvw h GLN 18 CO -0.00 -0.64 -0.54 -0.22 -1.93 0.00 0.00 178.83 175.49 2jvw h LYS 19 N -1.12 0.11 0.18 1.69 1.63 -1.68 -1.68 116.57 115.69 2jvw h LYS 19 Ca -0.10 -0.07 0.00 0.00 -0.85 0.00 0.00 60.65 59.63 2jvw h LYS 19 Cb 0.80 0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 32.43 2jvw h LYS 19 CO 0.17 0.63 -0.16 1.25 -3.45 0.00 0.00 179.45 177.89 2jvw h LEU 20 N 0.09 -0.42 -0.73 5.20 6.46 -0.81 0.14 115.31 125.23 2jvw h LEU 20 Ca -0.00 0.04 0.03 0.00 -0.12 0.00 0.00 57.88 57.83 2jvw h LEU 20 Cb 0.99 0.14 -0.05 0.00 -0.73 0.00 0.00 40.66 41.02 2jvw h LEU 20 CO 0.08 -0.25 0.46 0.25 -0.62 0.00 0.00 178.44 178.36 2jvw h LEU 21 N -0.36 0.75 -0.21 2.25 5.85 -1.00 -2.68 115.31 119.91 2jvw h LEU 21 Ca -0.00 0.00 0.04 0.00 0.84 0.00 0.00 57.88 58.76 2jvw h LEU 21 Cb 0.33 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 41.16 2jvw h LEU 21 CO -0.03 0.52 -0.05 0.74 -0.34 0.00 0.00 178.44 179.27 2jvw h THR 22 N 0.89 0.79 -0.72 1.05 2.02 -0.85 -1.04 112.91 115.05 2jvw h THR 22 Ca 0.30 -0.00 0.14 0.00 0.77 0.00 0.00 66.41 67.62 2jvw h THR 22 Cb 0.03 0.79 -0.10 0.00 -1.74 0.00 0.00 68.15 67.14 2jvw h THR 22 CO -0.12 0.00 0.25 -0.33 0.37 0.00 0.00 175.52 175.69 2jvw h GLU 23 N 0.00 0.37 -0.47 6.66 4.39 -0.46 0.20 114.58 125.27 2jvw h GLU 23 Ca 0.10 -0.02 -0.02 0.00 0.34 0.00 0.00 59.36 59.76 2jvw h GLU 23 Cb 0.15 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 28.70 2jvw h GLU 23 CO -0.22 0.24 0.20 -0.07 -1.16 0.00 0.00 179.01 178.01 2jvw h LEU 24 N 0.38 0.64 -0.98 1.33 3.38 -1.09 -1.52 115.31 117.45 2jvw h LEU 24 Ca 0.40 -0.16 -0.07 0.00 0.09 0.00 0.00 57.88 58.13 2jvw h LEU 24 Cb 0.61 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 41.18 2jvw h LEU 24 CO -0.42 0.62 -0.07 0.58 0.09 0.00 0.00 178.44 179.24 2jvw h VAL 25 N 0.61 1.24 -0.17 1.22 2.07 -0.14 0.47 116.25 121.55 2jvw h VAL 25 Ca 0.16 -1.03 -0.02 0.00 0.82 0.00 0.00 66.70 66.62 2jvw h VAL 25 Cb 0.17 1.02 -0.01 0.00 -1.52 0.00 0.00 31.29 30.95 2jvw h VAL 25 CO -0.01 0.35 0.01 -0.33 0.02 0.00 0.00 177.57 177.61 2jvw h GLU 26 N 0.61 0.29 0.04 1.57 5.08 -0.36 -2.88 114.58 118.93 2jvw h GLU 26 Ca 0.12 -0.09 -0.26 0.00 -1.00 0.00 0.00 59.36 58.13 2jvw h GLU 26 Cb 0.49 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.68 2jvw h GLU 26 CO 0.03 0.48 -1.42 1.25 -1.00 0.00 0.00 179.01 178.35 2jvw h HIS 27 N 0.06 0.15 0.00 4.33 2.76 -1.24 -3.44 115.15 117.77 2jvw h HIS 27 Ca 0.05 -0.11 0.00 0.00 -2.20 0.00 0.00 60.37 58.11 2jvw h HIS 27 Cb 0.34 -0.01 0.00 0.00 1.55 0.00 0.00 27.41 29.30 2jvw h HIS 27 CO 0.03 1.56 0.00 0.66 -1.30 0.00 0.00 177.93 178.87 2jvw n TYR 28 N -4.17 0.00 0.00 5.26 4.01 0.16 -5.09 117.16 117.32 2jvw n TYR 28 Ca -0.31 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.43 2jvw n TYR 28 Cb 0.78 -0.36 0.00 0.00 -0.31 0.00 0.00 39.34 39.45 2jvw n TYR 28 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2jvw n GLY 29 N 1.93 2.66 0.16 2.72 0.00 -0.78 -4.72 105.19 107.17 2jvw n GLY 29 Ca 0.00 -2.10 -0.12 0.00 0.00 0.00 0.00 46.02 43.80 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 0.54 -0.27 1.61 4.06 -1.90 -2.17 115.95 117.82 2jvw h TRP 30 Ca 0.00 -0.12 -0.10 0.00 2.06 0.00 0.00 58.89 60.74 2jvw h TRP 30 Cb 0.00 -0.13 -0.01 0.00 -1.00 0.00 0.00 29.16 28.01 2jvw h TRP 30 CO 0.00 0.71 -0.24 1.05 -3.56 0.00 0.00 178.44 176.40 2jvw h GLU 31 N 0.22 0.51 -0.32 0.49 4.11 -1.91 -0.48 114.58 117.20 2jvw h GLU 31 Ca 0.06 -0.19 0.03 0.00 0.07 0.00 0.00 59.36 59.33 2jvw h GLU 31 Cb 0.54 -0.03 -0.03 0.00 0.50 0.00 0.00 28.75 29.72 2jvw h GLU 31 CO 0.03 0.72 0.12 0.93 0.07 0.00 0.00 179.01 180.87 2jvw h GLU 32 N 0.45 0.26 -0.55 1.06 3.07 -1.83 0.83 114.58 117.87 2jvw h GLU 32 Ca 0.07 -0.02 -0.06 0.00 -0.50 0.00 0.00 59.36 58.85 2jvw h GLU 32 Cb 0.66 -0.06 -0.02 0.00 -0.84 0.00 0.00 28.75 28.49 2jvw h GLU 32 CO 0.05 0.17 0.11 -0.07 -1.40 0.00 0.00 179.01 177.87 2jvw h LEU 33 N 0.27 0.81 -0.98 1.33 3.38 -0.92 -0.74 115.31 118.46 2jvw h LEU 33 Ca 0.14 -0.16 -0.09 0.00 0.09 0.00 0.00 57.88 57.87 2jvw h LEU 33 Cb 0.10 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 2jvw h LEU 33 CO -0.14 0.81 -0.23 -1.28 0.09 0.00 0.00 178.44 177.68 2jvw h SER 34 N 0.83 0.46 -0.21 -0.43 0.87 -0.77 0.28 113.55 114.58 2jvw h SER 34 Ca 0.18 -0.15 -0.05 0.00 -1.23 0.00 0.00 61.79 60.54 2jvw h SER 34 Cb 0.33 -0.12 -0.01 0.00 -0.44 0.00 0.00 62.40 62.16 2jvw h SER 34 CO 0.00 0.70 -0.08 0.22 -0.53 0.00 0.00 176.83 177.14 2jvw h TYR 35 N 0.41 0.48 0.01 2.24 3.20 -0.28 -3.23 116.97 119.81 2jvw h TYR 35 Ca 0.06 -0.11 -0.00 0.00 3.14 0.00 0.00 58.73 61.82 2jvw h TYR 35 Cb 0.64 -0.11 0.00 0.00 1.54 0.00 0.00 36.73 38.79 2jvw h TYR 35 CO 0.02 0.69 -0.00 0.52 -1.64 0.00 0.00 178.16 177.75 2jvw h MET 36 N 0.14 -0.01 -4.23 1.82 2.86 -1.10 -3.41 114.93 111.00 2jvw h MET 36 Ca 0.05 0.00 -0.71 0.00 -2.06 0.00 0.00 59.70 56.98 2jvw h MET 36 Cb 0.55 0.00 -0.32 0.00 0.06 0.00 0.00 31.60 31.89 2jvw h MET 36 CO 0.03 0.76 -0.43 0.08 1.06 0.00 0.00 176.91 178.41 2jvw s VAL 37 N -2.91 3.81 -1.24 -2.22 1.01 0.99 -5.03 120.40 114.81 2jvw s VAL 37 Ca -0.17 -2.12 -0.21 0.00 0.00 0.00 0.00 61.98 59.48 2jvw s VAL 37 Cb -0.01 -3.53 -0.02 0.00 0.00 0.00 0.00 36.38 32.81 2jvw s VAL 37 CO 0.65 -0.77 1.85 0.59 0.00 0.00 0.00 175.10 177.42 2jvw n ASN 38 N 4.50 3.88 -4.24 3.32 3.02 -1.22 -4.20 115.26 120.32 2jvw n ASN 38 Ca -0.02 -2.79 -0.17 0.00 -0.03 0.00 0.00 54.58 51.56 2jvw n ASN 38 Cb 0.41 -1.74 -0.11 0.00 -0.61 0.00 0.00 39.78 37.72 2jvw n ASN 38 CO 0.00 0.00 0.00 0.27 -2.62 0.00 0.00 177.26 174.91 2jvw s ILE 39 N 8.11 1.28 0.56 2.41 -4.36 -1.26 -5.04 121.20 122.90 2jvw s ILE 39 Ca 0.62 -1.76 0.34 0.00 -0.26 0.00 0.00 60.65 59.59 2jvw s ILE 39 Cb 0.01 -1.56 0.37 0.00 1.25 0.00 0.00 42.46 42.54 2jvw s ILE 39 CO 0.11 -0.48 2.25 -1.13 0.24 0.00 0.00 174.94 175.94 2jvw h ASN 40 N 3.41 0.00 -0.74 4.36 -1.24 -1.97 -3.12 115.58 116.28 2jvw h ASN 40 Ca -0.39 0.00 0.17 0.00 0.71 0.00 0.00 56.30 56.79 2jvw h ASN 40 Cb 1.20 0.00 -0.12 0.00 0.73 0.00 0.00 38.32 40.13 2jvw h ASN 40 CO 0.53 0.02 0.10 0.00 -1.29 0.00 0.00 177.43 176.79 2jvw n PHE 42 N -5.24 0.09 -0.05 0.00 3.72 -1.18 -3.90 117.46 110.89 2jvw n PHE 42 Ca 0.14 -0.04 -0.02 0.00 -0.05 0.00 0.00 57.45 57.47 2jvw n PHE 42 Cb 0.47 0.00 -0.12 0.00 -0.94 0.00 0.00 39.48 38.89 2jvw n PHE 42 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 2jvw n LYS 43 N 0.61 1.18 -3.64 -1.08 5.02 0.04 -4.78 118.16 115.50 2jvw n LYS 43 Ca 0.17 -0.06 -0.26 0.00 -2.02 0.00 0.00 58.31 56.15 2jvw n LYS 43 Cb 0.43 -1.39 -0.17 0.00 -0.02 0.00 0.00 35.03 33.88 2jvw n LYS 43 CO 0.00 0.00 0.00 0.21 -0.52 0.00 0.00 177.40 177.09 2jvw s LYS 44 N -2.63 0.18 -0.48 1.97 2.20 -0.16 -4.94 119.74 115.89 2jvw s LYS 44 Ca -0.07 -0.10 -0.09 0.00 -0.36 0.00 0.00 55.97 55.35 2jvw s LYS 44 Cb 0.06 -1.75 0.01 0.00 -1.51 0.00 0.00 37.83 34.65 2jvw s LYS 44 CO 0.64 -0.62 0.56 -3.47 -0.36 0.00 0.00 175.35 172.10 2jvw n ASP 45 N 5.23 -7.22 -4.53 1.43 2.03 -1.26 -4.73 116.55 107.50 2jvw n ASP 45 Ca -0.07 0.28 -0.43 0.00 0.52 0.00 0.00 54.79 55.09 2jvw n ASP 45 Cb 0.49 -4.87 -0.05 0.00 -0.72 0.00 0.00 41.12 35.97 2jvw n ASP 45 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 2jvw s PRO 46 N -2.63 3.38 0.05 -0.67 0.04 -1.25 -4.83 135.00 129.09 2jvw s PRO 46 Ca 0.14 -0.16 -0.15 0.00 0.04 0.00 0.00 61.00 60.87 2jvw s PRO 46 Cb -0.04 -3.95 0.03 0.00 0.04 0.00 0.00 34.50 30.57 2jvw s PRO 46 CO 0.67 -1.15 0.35 -1.12 0.04 0.00 0.00 177.00 175.79 2jvw s SER 47 N 2.21 -0.19 0.04 6.66 0.01 -1.26 -5.05 113.70 116.13 2jvw s SER 47 Ca 0.29 -0.14 -0.14 0.00 1.31 0.00 0.00 55.95 57.28 2jvw s SER 47 Cb -0.12 0.39 -0.06 0.00 0.21 0.00 0.00 66.02 66.44 2jvw s SER 47 CO 0.22 -0.65 1.22 0.40 0.41 0.00 0.00 173.24 174.84 2jvw h ILE 48 N 3.08 0.00 -0.04 1.44 1.08 -1.98 0.93 117.51 122.01 2jvw h ILE 48 Ca -0.32 0.00 -0.05 0.00 -0.39 0.00 0.00 64.86 64.10 2jvw h ILE 48 Cb 1.20 0.00 -0.01 0.00 -3.07 0.00 0.00 36.82 34.95 2jvw h ILE 48 CO 0.45 0.00 -0.22 0.50 -0.69 0.00 0.00 178.15 178.19 2jvw h LYS 49 N -0.30 0.07 0.00 2.37 3.64 -1.98 0.09 116.57 120.46 2jvw h LYS 49 Ca -0.00 -0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.33 2jvw h LYS 49 Cb 0.30 -0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.11 2jvw h LYS 49 CO -0.12 0.29 -0.15 0.77 -2.27 0.00 0.00 179.45 177.97 2jvw h SER 50 N 0.06 0.00 0.09 4.20 0.02 -1.79 -2.18 113.55 113.95 2jvw h SER 50 Ca 0.01 0.00 -0.34 0.00 -0.84 0.00 0.00 61.79 60.62 2jvw h SER 50 Cb 0.43 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.94 2jvw h SER 50 CO 0.03 0.15 -1.91 -1.20 -1.14 0.00 0.00 176.83 172.76 2jvw n SER 51 N -3.56 2.06 -0.33 3.07 7.64 0.27 -4.36 113.62 118.42 2jvw n SER 51 Ca -0.01 0.23 0.10 0.00 1.01 0.00 0.00 58.87 60.20 2jvw n SER 51 Cb 0.29 -0.85 0.30 0.00 -1.01 0.00 0.00 64.21 62.94 2jvw n SER 51 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 2jvw h LEU 52 N -0.18 0.81 -1.75 -3.43 3.38 -0.86 -0.50 115.31 112.78 2jvw h LEU 52 Ca -0.43 0.05 0.14 0.00 0.09 0.00 0.00 57.88 57.74 2jvw h LEU 52 Cb 1.87 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 42.48 2jvw h LEU 52 CO 0.00 0.40 0.44 0.07 0.09 0.00 0.00 178.44 179.43 2jvw h LYS 53 N 0.85 0.25 0.13 1.13 2.10 -1.59 -0.89 116.57 118.55 2jvw h LYS 53 Ca 0.50 -0.01 -0.28 0.00 -2.00 0.00 0.00 60.65 58.85 2jvw h LYS 53 Cb 0.65 -0.06 0.00 0.00 -0.90 0.00 0.00 32.23 31.93 2jvw h LYS 53 CO -0.27 0.16 -1.44 0.35 -2.00 0.00 0.00 179.45 176.26 2jvw h PHE 54 N 0.26 0.50 -0.96 0.07 3.57 -1.35 -3.35 116.94 115.67 2jvw h PHE 54 Ca 0.31 -0.36 0.02 0.00 3.53 0.00 0.00 57.97 61.46 2jvw h PHE 54 Cb 0.85 -0.02 -0.05 0.00 2.79 0.00 0.00 35.95 39.52 2jvw h PHE 54 CO -0.00 1.56 0.63 -0.07 -2.23 0.00 0.00 178.31 178.20 2jvw h LEU 55 N -0.24 1.07 -1.68 0.59 3.38 -0.70 0.10 115.31 117.84 2jvw h LEU 55 Ca -0.30 -0.02 -0.04 0.00 0.09 0.00 0.00 57.88 57.61 2jvw h LEU 55 Cb 1.81 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 42.30 2jvw h LEU 55 CO 0.09 0.75 -0.19 0.08 0.09 0.00 0.00 178.44 179.26 2jvw h ARG 56 N 1.25 0.00 0.12 1.13 0.11 -1.36 -3.18 114.38 112.45 2jvw h ARG 56 Ca 0.37 0.00 -0.36 0.00 0.10 0.00 0.00 59.98 60.09 2jvw h ARG 56 Cb -0.07 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 30.99 2jvw h ARG 56 CO -0.10 0.19 -1.97 1.63 0.10 0.00 0.00 179.97 179.82 2jvw n LYS 57 N -4.06 0.75 -3.47 0.08 5.02 -0.68 -4.76 118.16 111.04 2jvw n LYS 57 Ca -0.02 0.27 -0.43 0.00 -2.02 0.00 0.00 58.31 56.11 2jvw n LYS 57 Cb 0.27 -1.72 -0.08 0.00 -0.02 0.00 0.00 35.03 33.48 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 -2.56 4.68 0.13 -0.18 2.01 0.27 -4.98 115.64 115.02 2jvw s THR 58 Ca -0.21 -1.47 -0.15 0.00 0.31 0.00 0.00 61.69 60.16 2jvw s THR 58 Cb 0.07 -3.94 -0.00 0.00 0.01 0.00 0.00 72.50 68.63 2jvw s THR 58 CO 0.78 -0.69 1.67 0.44 -0.69 0.00 0.00 174.62 176.12 2jvw h ASP 59 N 8.61 0.59 0.19 3.53 3.32 -1.86 -2.08 116.42 128.73 2jvw h ASP 59 Ca -0.25 -0.19 -0.03 0.00 0.02 0.00 0.00 57.03 56.58 2jvw h ASP 59 Cb 1.09 -0.15 -0.00 0.00 0.22 0.00 0.00 39.33 40.48 2jvw h ASP 59 CO 0.89 0.63 -0.12 4.11 -1.72 0.00 0.00 179.24 183.02 2jvw h TRP 60 N 0.53 0.00 -0.05 4.55 5.08 -1.93 -0.79 115.95 123.34 2jvw h TRP 60 Ca 0.14 0.00 -0.18 0.00 1.08 0.00 0.00 58.89 59.92 2jvw h TRP 60 Cb 0.23 0.00 0.01 0.00 -3.00 0.00 0.00 29.16 26.41 2jvw h TRP 60 CO 0.01 0.12 -0.69 0.00 -1.28 0.00 0.00 178.44 176.60 2jvw h ALA 61 N 1.88 0.15 0.57 0.11 0.00 -1.81 -3.02 119.26 117.14 2jvw h ALA 61 Ca -0.00 -0.58 -0.02 0.00 0.00 0.00 0.00 54.91 54.31 2jvw h ALA 61 Cb 0.25 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 2jvw h ALA 61 CO 0.02 0.47 -0.43 -0.09 0.00 0.00 0.00 179.25 179.22 2jvw h ARG 62 N 0.16 -0.94 0.00 0.00 2.43 -0.63 -2.55 114.38 112.85 2jvw h ARG 62 Ca -0.07 0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 59.15 2jvw h ARG 62 Cb 1.36 0.21 -0.00 0.00 -0.42 0.00 0.00 29.97 31.12 2jvw h ARG 62 CO 0.14 -0.63 -0.06 1.05 -1.51 0.00 0.00 179.97 178.96 2jvw h GLU 63 N -0.97 0.00 -0.01 0.20 -0.00 -1.31 0.75 114.58 113.24 2jvw h GLU 63 Ca -0.07 0.00 -0.00 0.00 -0.00 0.00 0.00 59.36 59.29 2jvw h GLU 63 Cb 0.82 0.00 -0.00 0.00 -0.00 0.00 0.00 28.75 29.57 2jvw h GLU 63 CO 0.01 0.06 0.01 0.00 -0.00 0.00 0.00 179.01 179.09 2jvw h ARG 64 N 0.00 0.02 0.01 1.06 2.47 -1.38 -0.21 114.38 116.35 2jvw h ARG 64 Ca -0.00 -0.00 0.01 0.00 -1.26 0.00 0.00 59.98 58.72 2jvw h ARG 64 Cb 0.26 -0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.56 2jvw h ARG 64 CO 0.01 0.16 -0.05 0.28 0.56 0.00 0.00 179.97 180.92 2jvw h VAL 65 N -0.12 0.86 -0.59 2.04 2.07 -0.49 -0.34 116.25 119.68 2jvw h VAL 65 Ca 0.00 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 2jvw h VAL 65 Cb 0.14 0.86 -0.03 0.00 -1.52 0.00 0.00 31.29 30.75 2jvw h VAL 65 CO -0.00 0.00 0.31 -0.33 0.02 0.00 0.00 177.57 177.57 2jvw h GLU 66 N -0.10 0.81 -0.79 1.57 5.08 -1.22 -1.70 114.58 118.23 2jvw h GLU 66 Ca 0.02 -0.09 -0.03 0.00 -1.00 0.00 0.00 59.36 58.26 2jvw h GLU 66 Cb 0.12 -0.16 -0.04 0.00 0.50 0.00 0.00 28.75 29.17 2jvw h GLU 66 CO -0.05 0.60 0.36 -0.97 -1.00 0.00 0.00 179.01 177.95 2jvw h ASN 67 N 0.82 1.05 -0.91 1.42 -1.24 -0.57 -1.91 115.58 114.24 2jvw h ASN 67 Ca 0.21 -0.15 0.02 0.00 0.71 0.00 0.00 56.30 57.09 2jvw h ASN 67 Cb 0.04 -0.27 -0.05 0.00 0.73 0.00 0.00 38.32 38.77 2jvw h ASN 67 CO -0.03 0.91 0.60 0.40 -1.29 0.00 0.00 177.43 178.02 2jvw h ILE 68 N 1.13 1.21 -0.62 2.57 2.04 -0.19 -1.15 117.51 122.49 2jvw h ILE 68 Ca 0.27 -0.41 -0.03 0.00 1.00 0.00 0.00 64.86 65.69 2jvw h ILE 68 Cb 0.15 -0.10 -0.03 0.00 -0.74 0.00 0.00 36.82 36.10 2jvw h ILE 68 CO -0.03 0.22 0.26 0.22 0.00 0.00 0.00 178.15 178.82 2jvw h TYR 69 N 1.20 0.90 -0.31 1.37 3.20 -0.86 0.27 116.97 122.74 2jvw h TYR 69 Ca 0.34 -0.04 0.00 0.00 3.14 0.00 0.00 58.73 62.17 2jvw h TYR 69 Cb -0.09 -0.28 -0.02 0.00 1.54 0.00 0.00 36.73 37.89 2jvw h TYR 69 CO -0.00 0.68 0.20 -0.07 -1.64 0.00 0.00 178.16 177.33 2jvw h LEU 70 N 0.89 0.36 -1.73 2.82 3.38 -0.51 0.35 115.31 120.87 2jvw h LEU 70 Ca 0.21 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.14 2jvw h LEU 70 Cb 0.15 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 40.80 2jvw h LEU 70 CO -0.02 0.27 -0.14 0.11 0.09 0.00 0.00 178.44 178.75 2jvw h LYS 71 N 0.41 0.00 -0.42 1.13 6.56 -0.65 -1.27 116.57 122.34 2jvw h LYS 71 Ca 0.11 0.00 -0.07 0.00 -1.06 0.00 0.00 60.65 59.63 2jvw h LYS 71 Cb -0.04 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 31.61 2jvw h LYS 71 CO -0.02 0.14 -0.01 1.25 -2.06 0.00 0.00 179.45 178.74 2jvw h LEU 72 N 0.00 0.74 -1.01 2.94 5.85 0.40 0.27 115.31 124.50 2jvw h LEU 72 Ca -0.00 -0.31 -0.04 0.00 0.84 0.00 0.00 57.88 58.37 2jvw h LEU 72 Cb 0.24 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 41.04 2jvw h LEU 72 CO 0.02 0.87 0.24 1.56 -0.34 0.00 0.00 178.44 180.80 2jvw h GLN 73 N 0.59 0.95 -0.47 1.25 1.08 -0.39 -1.21 115.11 116.90 2jvw h GLN 73 Ca 0.12 -0.16 -0.11 0.00 -1.45 0.00 0.00 58.65 57.04 2jvw h GLN 73 Cb 0.50 -0.16 -0.02 0.00 -0.05 0.00 0.00 27.48 27.75 2jvw h GLN 73 CO 0.02 0.79 -0.16 0.00 -0.95 0.00 0.00 178.83 178.53 2jvw h ARG 74 N 0.93 0.91 0.00 1.46 2.47 -1.04 -2.92 114.38 116.18 2jvw h ARG 74 Ca 0.22 -0.35 -0.02 0.00 -1.26 0.00 0.00 59.98 58.57 2jvw h ARG 74 Cb 0.20 -0.05 -0.00 0.00 -1.65 0.00 0.00 29.97 28.47 2jvw h ARG 74 CO -0.02 1.00 -0.09 1.25 0.56 0.00 0.00 179.97 182.67 2jvw h HIS 75 N 0.80 0.00 -1.60 3.04 2.76 0.18 -3.39 115.15 116.94 2jvw h HIS 75 Ca 0.12 0.00 -0.45 0.00 -2.20 0.00 0.00 60.37 57.84 2jvw h HIS 75 Cb 0.70 0.00 -0.05 0.00 1.55 0.00 0.00 27.41 29.62 2jvw h HIS 75 CO 0.04 0.09 1.15 0.21 -1.30 0.00 0.00 177.93 178.12 2jvw s LYS 76 N -3.95 2.71 0.65 5.26 2.47 -0.52 -4.99 119.74 121.37 2jvw s LYS 76 Ca -0.01 0.18 -0.11 0.00 -1.56 0.00 0.00 55.97 54.46 2jvw s LYS 76 Cb 0.11 -4.61 -0.02 0.00 -1.46 0.00 0.00 37.83 31.85 2jvw s LYS 76 CO 0.56 -2.84 1.04 -1.83 0.16 0.00 0.00 175.35 172.44 2jvw s GLU 77 N 6.81 3.37 -0.63 4.03 -1.05 -1.26 -4.97 118.70 125.01 2jvw s GLU 77 Ca 0.64 0.80 -0.27 0.00 -0.15 0.00 0.00 54.97 55.99 2jvw s GLU 77 Cb -0.10 -2.05 0.00 0.00 -0.44 0.00 0.00 34.13 31.55 2jvw s GLU 77 CO 0.12 -0.75 1.56 0.50 0.95 0.00 0.00 175.26 177.65 2jvw s ARG 78 N -5.14 3.01 -0.04 -4.83 6.06 -1.26 -4.95 118.95 111.78 2jvw s ARG 78 Ca 0.56 0.34 -0.29 0.00 -2.50 0.00 0.00 55.73 53.84 2jvw s ARG 78 Cb -0.12 -4.25 -0.08 0.00 0.06 0.00 0.00 34.95 30.57 2jvw s ARG 78 CO 0.54 -2.31 2.06 -0.80 -2.50 0.00 0.00 175.30 172.29 2jvw s ASN 79 N 5.72 6.12 -0.10 -2.12 -0.87 -1.26 -4.95 114.94 117.48 2jvw s ASN 79 Ca 0.54 2.43 -0.28 0.00 -1.57 0.00 0.00 52.86 53.98 2jvw s ASN 79 Cb -0.11 -2.52 -0.02 0.00 -0.02 0.00 0.00 41.25 38.58 2jvw s ASN 79 CO 0.21 -1.35 0.94 -1.58 -2.57 0.00 0.00 177.10 172.74 2jvw s GLN 80 N 5.09 4.42 0.00 -0.60 0.74 -1.26 -4.94 119.66 123.11 2jvw s GLN 80 Ca 0.93 1.27 0.28 0.00 0.05 0.00 0.00 55.36 57.89 2jvw s GLN 80 Cb -0.40 -3.53 1.16 0.00 1.10 0.00 0.00 33.01 31.34 2jvw s GLN 80 CO 0.40 -0.24 1.84 1.47 -0.55 0.00 0.00 175.29 178.21 2jvw n LEU 81 N 4.77 0.21 0.00 3.68 -0.00 -1.26 -5.34 117.00 119.06 2jvw n LEU 81 Ca 0.07 0.25 0.00 0.00 -0.00 0.00 0.00 56.01 56.32 2jvw n LEU 81 Cb 0.49 -0.34 0.00 0.00 -0.00 0.00 0.00 43.42 43.58 2jvw n LEU 81 CO 0.51 0.04 0.14 -1.84 -0.00 0.00 0.00 177.39 176.24