#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 2.31 0.00 3.04 0.00 -1.26 -4.57 121.76 121.29 2jvw s ALA 2 Ca 0.00 -2.25 0.00 0.00 0.00 0.00 0.00 51.96 49.71 2jvw s ALA 2 Cb 0.00 -4.62 0.00 0.00 0.00 0.00 0.00 23.12 18.50 2jvw s ALA 2 CO 0.00 -4.40 0.80 1.28 0.00 0.00 0.00 175.76 173.43 2jvw n LEU 3 N 11.91 1.54 -4.45 0.00 4.32 -1.26 -4.91 117.00 124.15 2jvw n LEU 3 Ca 0.43 -1.54 -0.38 0.00 -0.02 0.00 0.00 56.01 54.50 2jvw n LEU 3 Cb 0.47 0.00 -0.02 0.00 -1.62 0.00 0.00 43.42 42.25 2jvw n LEU 3 CO 0.68 0.39 1.88 -0.38 -1.22 0.00 0.00 177.39 178.74 2jvw n ILE 4 N -0.31 3.07 -0.74 -0.08 5.41 -1.26 -4.30 119.36 121.15 2jvw n ILE 4 Ca 0.00 -3.13 0.00 0.00 1.00 0.00 0.00 62.75 60.62 2jvw n ILE 4 Cb 0.18 -2.31 0.00 0.00 -0.71 0.00 0.00 39.64 36.81 2jvw n ILE 4 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 176.55 176.78 2jvw n MET 5 N 8.07 0.53 -3.10 0.38 2.81 -1.26 -5.09 117.12 119.46 2jvw n MET 5 Ca 0.48 -0.61 -0.40 0.00 -1.81 0.00 0.00 57.70 55.36 2jvw n MET 5 Cb 0.45 -0.63 -0.05 0.00 -0.71 0.00 0.00 33.22 32.28 2jvw n MET 5 CO 0.00 0.00 0.00 0.99 1.51 0.00 0.00 175.97 178.47 2jvw s THR 6 N -0.20 5.05 -0.50 2.03 2.01 -1.26 -5.04 115.64 117.74 2jvw s THR 6 Ca 0.00 1.31 -0.22 0.00 0.31 0.00 0.00 61.69 63.08 2jvw s THR 6 Cb 0.00 -3.98 0.04 0.00 0.01 0.00 0.00 72.50 68.56 2jvw s THR 6 CO 0.00 0.21 0.79 -1.10 -0.69 0.00 0.00 174.62 173.83 2jvw s GLN 7 N 1.16 3.30 0.36 4.92 -1.52 -1.26 -5.05 119.66 121.56 2jvw s GLN 7 Ca 0.33 -0.37 -0.04 0.00 -1.95 0.00 0.00 55.36 53.33 2jvw s GLN 7 Cb -0.17 -4.02 -0.04 0.00 -0.22 0.00 0.00 33.01 28.56 2jvw s GLN 7 CO 0.14 -1.26 0.63 -0.65 -0.25 0.00 0.00 175.29 173.90 2jvw s GLN 8 N 3.32 3.59 0.20 2.91 -1.52 -1.26 -4.98 119.66 121.93 2jvw s GLN 8 Ca 0.26 0.01 0.00 0.00 -1.95 0.00 0.00 55.36 53.68 2jvw s GLN 8 Cb -0.14 -2.56 0.00 0.00 -0.22 0.00 0.00 33.01 30.09 2jvw s GLN 8 CO 0.19 0.08 0.00 -1.71 -0.25 0.00 0.00 175.29 173.59 2jvw n ASN 9 N -1.48 -4.04 -3.75 5.90 5.15 -1.26 -5.10 115.26 110.68 2jvw n ASN 9 Ca -0.02 0.49 -0.13 0.00 -0.60 0.00 0.00 54.58 54.32 2jvw n ASN 9 Cb 0.55 -1.28 -0.10 0.00 -0.53 0.00 0.00 39.78 38.42 2jvw n ASN 9 CO 0.00 0.00 0.00 0.20 1.40 0.00 0.00 177.26 178.86 2jvw s ASN 10 N -2.50 -0.30 0.54 1.20 0.01 -1.26 -5.06 114.94 107.56 2jvw s ASN 10 Ca 0.00 0.47 0.21 0.00 -0.71 0.00 0.00 52.86 52.83 2jvw s ASN 10 Cb 0.00 0.56 1.44 0.00 0.41 0.00 0.00 41.25 43.66 2jvw s ASN 10 CO 0.00 -0.25 2.16 1.55 -1.51 0.00 0.00 177.10 179.05 2jvw h PRO 11 N 4.90 0.00 -1.00 -0.60 0.13 -1.98 -2.16 132.00 131.28 2jvw h PRO 11 Ca -0.28 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.70 2jvw h PRO 11 Cb 1.18 0.00 -0.09 0.00 0.13 0.00 0.00 31.00 32.22 2jvw h PRO 11 CO 0.33 0.00 0.19 1.28 -0.23 0.00 0.00 178.00 179.57 2jvw n LEU 12 N -4.32 4.07 -4.57 1.56 4.77 -1.26 -4.79 117.00 112.47 2jvw n LEU 12 Ca -0.02 -2.10 -0.24 0.00 -0.03 0.00 0.00 56.01 53.62 2jvw n LEU 12 Cb 0.13 -0.60 -0.06 0.00 -2.33 0.00 0.00 43.42 40.56 2jvw n LEU 12 CO 0.32 0.66 1.34 -2.28 -1.33 0.00 0.00 177.39 176.10 2jvw s HIS 13 N -0.99 1.68 -1.46 -1.77 2.46 -0.82 -3.70 115.29 110.69 2jvw s HIS 13 Ca 0.17 1.00 0.00 0.00 0.47 0.00 0.00 55.06 56.69 2jvw s HIS 13 Cb 0.14 -3.85 0.00 0.00 -0.13 0.00 0.00 32.58 28.74 2jvw s HIS 13 CO 0.03 -1.42 0.00 0.41 -2.47 0.00 0.00 174.74 171.29 2jvw n GLY 14 N 6.44 1.33 3.09 1.59 0.00 -1.26 -4.94 105.19 111.44 2jvw n GLY 14 Ca 0.43 -0.04 -0.12 0.00 0.00 0.00 0.00 46.02 46.29 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 -2.22 0.05 0.38 -0.61 1.01 -1.24 -5.12 121.20 113.45 2jvw s ILE 15 Ca 0.00 -0.41 0.08 0.00 0.00 0.00 0.00 60.65 60.32 2jvw s ILE 15 Cb 0.00 -0.36 -0.01 0.00 0.01 0.00 0.00 42.46 42.09 2jvw s ILE 15 CO 0.00 -0.22 0.41 0.42 0.00 0.00 0.00 174.94 175.55 2jvw s THR 16 N -0.78 3.18 0.31 2.92 -4.23 -1.26 -4.56 115.64 111.21 2jvw s THR 16 Ca -0.09 -1.22 0.08 0.00 -1.18 0.00 0.00 61.69 59.28 2jvw s THR 16 Cb -0.05 -3.11 0.31 0.00 1.34 0.00 0.00 72.50 70.99 2jvw s THR 16 CO 0.01 -0.07 1.70 0.25 -0.54 0.00 0.00 174.62 175.97 2jvw h LEU 17 N 0.98 0.49 0.82 4.79 5.85 -1.98 0.19 115.31 126.45 2jvw h LEU 17 Ca -0.43 0.16 -0.04 0.00 0.84 0.00 0.00 57.88 58.41 2jvw h LEU 17 Cb 1.26 0.10 0.01 0.00 0.37 0.00 0.00 40.66 42.40 2jvw h LEU 17 CO 0.54 0.01 -0.41 -0.61 -0.34 0.00 0.00 178.44 177.62 2jvw h GLN 18 N 0.45 -1.09 -0.32 1.25 4.15 -1.96 -0.42 115.11 117.17 2jvw h GLN 18 Ca 0.63 0.07 -0.04 0.00 0.77 0.00 0.00 58.65 60.08 2jvw h GLN 18 Cb 1.25 0.25 -0.02 0.00 0.21 0.00 0.00 27.48 29.17 2jvw h GLN 18 CO -0.53 -0.72 0.01 -0.22 -1.93 0.00 0.00 178.83 175.44 2jvw h LYS 19 N -1.13 0.48 0.63 1.69 1.63 -1.80 0.06 116.57 118.12 2jvw h LYS 19 Ca -0.11 -0.09 -0.03 0.00 -0.85 0.00 0.00 60.65 59.57 2jvw h LYS 19 Cb 0.87 -0.08 0.00 0.00 -0.60 0.00 0.00 32.23 32.43 2jvw h LYS 19 CO 0.17 0.50 -0.33 1.25 -3.45 0.00 0.00 179.45 177.59 2jvw h LEU 20 N 0.47 -0.80 -1.18 5.20 6.46 -0.59 -0.34 115.31 124.53 2jvw h LEU 20 Ca 0.10 0.04 0.03 0.00 -0.12 0.00 0.00 57.88 57.93 2jvw h LEU 20 Cb 0.28 0.22 -0.05 0.00 -0.73 0.00 0.00 40.66 40.38 2jvw h LEU 20 CO 0.01 -0.54 0.56 0.25 -0.62 0.00 0.00 178.44 178.10 2jvw h LEU 21 N -0.88 0.93 -0.24 2.25 5.85 -0.83 -1.88 115.31 120.49 2jvw h LEU 21 Ca -0.08 -0.01 0.03 0.00 0.84 0.00 0.00 57.88 58.65 2jvw h LEU 21 Cb 0.69 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.48 2jvw h LEU 21 CO 0.12 0.64 0.07 0.74 -0.34 0.00 0.00 178.44 179.67 2jvw h THR 22 N 1.08 0.92 -0.51 1.05 2.02 -0.70 -0.31 112.91 116.46 2jvw h THR 22 Ca 0.34 -0.06 -0.01 0.00 0.77 0.00 0.00 66.41 67.44 2jvw h THR 22 Cb 0.00 0.73 -0.02 0.00 -1.74 0.00 0.00 68.15 67.12 2jvw h THR 22 CO -0.10 0.03 0.26 -0.33 0.37 0.00 0.00 175.52 175.75 2jvw h GLU 23 N 0.18 0.70 -0.60 6.66 4.39 -0.63 -0.75 114.58 124.52 2jvw h GLU 23 Ca 0.11 -0.08 -0.10 0.00 0.34 0.00 0.00 59.36 59.63 2jvw h GLU 23 Cb 0.09 -0.14 -0.02 0.00 -0.10 0.00 0.00 28.75 28.57 2jvw h GLU 23 CO -0.12 0.53 -0.01 -0.07 -1.16 0.00 0.00 179.01 178.18 2jvw h LEU 24 N 0.70 1.04 -0.76 1.33 3.38 -0.58 0.15 115.31 120.58 2jvw h LEU 24 Ca 0.18 -0.30 -0.08 0.00 0.09 0.00 0.00 57.88 57.77 2jvw h LEU 24 Cb 0.05 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.50 2jvw h LEU 24 CO -0.03 1.10 0.05 0.58 0.09 0.00 0.00 178.44 180.22 2jvw h VAL 25 N 0.97 1.26 0.44 1.22 2.07 -0.55 0.28 116.25 121.94 2jvw h VAL 25 Ca 0.17 -1.06 -0.02 0.00 0.82 0.00 0.00 66.70 66.61 2jvw h VAL 25 Cb 0.57 0.75 0.00 0.00 -1.52 0.00 0.00 31.29 31.09 2jvw h VAL 25 CO 0.03 0.39 -0.21 -0.08 0.02 0.00 0.00 177.57 177.72 2jvw h GLU 26 N 0.92 -0.57 0.13 1.57 4.22 -0.86 -2.88 114.58 117.12 2jvw h GLU 26 Ca 0.18 0.04 -0.21 0.00 0.08 0.00 0.00 59.36 59.44 2jvw h GLU 26 Cb 0.47 0.13 0.02 0.00 0.50 0.00 0.00 28.75 29.88 2jvw h GLU 26 CO 0.02 -0.27 -0.91 0.45 -2.18 0.00 0.00 179.01 176.12 2jvw h HIS 27 N -0.91 0.66 0.00 0.92 3.86 -0.75 -3.42 115.15 115.52 2jvw h HIS 27 Ca -0.06 -0.46 0.00 0.00 -1.16 0.00 0.00 60.37 58.69 2jvw h HIS 27 Cb 0.57 -0.04 0.00 0.00 1.06 0.00 0.00 27.41 29.00 2jvw h HIS 27 CO 0.01 1.34 0.00 0.66 0.86 0.00 0.00 177.93 180.80 2jvw n TYR 28 N -4.05 0.00 0.00 2.45 4.01 0.83 -5.07 117.16 115.32 2jvw n TYR 28 Ca -0.14 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.60 2jvw n TYR 28 Cb 0.85 -0.14 0.00 0.00 -0.31 0.00 0.00 39.34 39.74 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 1.74 3.37 0.21 2.72 0.00 -0.31 -4.73 105.19 108.19 2jvw n GLY 29 Ca 0.00 -1.80 -0.01 0.00 0.00 0.00 0.00 46.02 44.20 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 0.07 -0.35 1.61 4.06 -1.87 -0.47 115.95 119.00 2jvw h TRP 30 Ca 0.00 0.04 0.00 0.00 2.06 0.00 0.00 58.89 60.99 2jvw h TRP 30 Cb 0.00 0.05 -0.02 0.00 -1.00 0.00 0.00 29.16 28.20 2jvw h TRP 30 CO 0.00 -0.08 0.22 0.93 -3.56 0.00 0.00 178.44 175.96 2jvw h GLU 31 N 0.17 0.46 -0.51 0.49 5.08 -1.93 -1.15 114.58 117.19 2jvw h GLU 31 Ca 0.27 -0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 58.57 2jvw h GLU 31 Cb 0.40 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 29.53 2jvw h GLU 31 CO -0.40 0.32 0.18 0.93 -1.00 0.00 0.00 179.01 179.04 2jvw h GLU 32 N 0.46 0.75 -0.11 2.33 3.07 -1.67 -0.38 114.58 119.04 2jvw h GLU 32 Ca 0.13 -0.12 -0.01 0.00 -0.50 0.00 0.00 59.36 58.86 2jvw h GLU 32 Cb -0.04 -0.13 -0.00 0.00 -0.84 0.00 0.00 28.75 27.74 2jvw h GLU 32 CO -0.03 0.63 0.04 -0.07 -1.40 0.00 0.00 179.01 178.18 2jvw h LEU 33 N 0.74 0.15 -0.58 1.33 3.38 -0.58 -0.89 115.31 118.86 2jvw h LEU 33 Ca 0.17 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 57.96 2jvw h LEU 33 Cb 0.18 -0.04 0.00 0.00 0.09 0.00 0.00 40.66 40.89 2jvw h LEU 33 CO -0.01 0.30 0.00 -1.54 0.09 0.00 0.00 178.44 177.27 2jvw n SER 34 N -4.90 0.52 -0.07 -0.43 3.41 -0.48 -0.76 113.62 110.90 2jvw n SER 34 Ca -0.06 0.63 -0.16 0.00 -0.26 0.00 0.00 58.87 59.03 2jvw n SER 34 Cb 0.13 -0.74 -0.13 0.00 -0.26 0.00 0.00 64.21 63.21 2jvw n SER 34 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 175.04 175.10 2jvw h TYR 35 N 0.00 0.02 -0.42 7.33 3.20 -0.57 -3.32 116.97 123.21 2jvw h TYR 35 Ca 0.00 -0.01 -0.12 0.00 3.14 0.00 0.00 58.73 61.74 2jvw h TYR 35 Cb 0.32 -0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.57 2jvw h TYR 35 CO 0.00 1.14 -0.22 0.52 -1.64 0.00 0.00 178.16 177.96 2jvw h MET 36 N -0.98 0.84 -4.59 1.82 2.86 -1.03 -3.38 114.93 110.48 2jvw h MET 36 Ca -0.09 -0.35 -0.69 0.00 -2.06 0.00 0.00 59.70 56.51 2jvw h MET 36 Cb 1.10 -0.04 -0.32 0.00 0.06 0.00 0.00 31.60 32.40 2jvw h MET 36 CO -0.05 0.98 -0.59 0.08 1.06 0.00 0.00 176.91 178.39 2jvw s VAL 37 N -4.62 3.38 -1.10 -2.22 1.01 0.06 -5.03 120.40 111.88 2jvw s VAL 37 Ca -0.10 -1.66 -0.19 0.00 0.00 0.00 0.00 61.98 60.02 2jvw s VAL 37 Cb 0.13 -3.13 -0.06 0.00 0.00 0.00 0.00 36.38 33.31 2jvw s VAL 37 CO 0.85 -0.44 1.99 -3.20 0.00 0.00 0.00 175.10 174.30 2jvw n ASN 38 N 4.67 3.29 -3.98 3.32 5.15 -1.25 -4.22 115.26 122.24 2jvw n ASN 38 Ca -0.08 -2.76 -0.18 0.00 -0.60 0.00 0.00 54.58 50.97 2jvw n ASN 38 Cb 0.43 -1.45 -0.15 0.00 -0.53 0.00 0.00 39.78 38.08 2jvw n ASN 38 CO 0.00 0.00 0.00 0.27 1.40 0.00 0.00 177.26 178.93 2jvw s ILE 39 N 5.41 0.57 -2.00 -1.44 -4.36 -1.26 -5.03 121.20 113.09 2jvw s ILE 39 Ca 0.56 -0.29 0.18 0.00 -0.26 0.00 0.00 60.65 60.84 2jvw s ILE 39 Cb 0.11 -0.50 0.51 0.00 1.25 0.00 0.00 42.46 43.83 2jvw s ILE 39 CO 0.06 0.17 1.52 -3.20 0.24 0.00 0.00 174.94 173.73 2jvw n ASN 40 N 3.05 0.00 -0.10 4.36 2.85 -1.26 -3.87 115.26 120.28 2jvw n ASN 40 Ca -0.15 -0.86 -0.06 0.00 -0.11 0.00 0.00 54.58 53.40 2jvw n ASN 40 Cb 0.57 0.00 0.01 0.00 1.24 0.00 0.00 39.78 41.59 2jvw n ASN 40 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2jvw n PHE 42 N -5.25 0.00 -0.06 0.00 3.72 -1.25 -2.19 117.46 112.43 2jvw n PHE 42 Ca 0.01 0.00 -0.04 0.00 -0.05 0.00 0.00 57.45 57.37 2jvw n PHE 42 Cb 0.19 -0.26 -0.12 0.00 -0.94 0.00 0.00 39.48 38.36 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 -1.26 1.36 -0.06 -1.08 4.76 0.13 -4.23 118.16 117.78 2jvw n LYS 43 Ca 0.08 -0.04 -0.13 0.00 -2.87 0.00 0.00 58.31 55.35 2jvw n LYS 43 Cb 0.12 -1.37 -0.12 0.00 -1.84 0.00 0.00 35.03 31.82 2jvw n LYS 43 CO 0.00 0.00 0.00 -0.22 -1.37 0.00 0.00 177.40 175.81 2jvw h LYS 44 N 0.00 -0.01 -2.09 1.97 3.64 0.13 -3.43 116.57 116.78 2jvw h LYS 44 Ca -0.31 0.00 -0.50 0.00 -1.27 0.00 0.00 60.65 58.57 2jvw h LYS 44 Cb 1.63 0.00 -0.34 0.00 -0.41 0.00 0.00 32.23 33.12 2jvw h LYS 44 CO 0.02 0.84 -0.88 0.34 -2.27 0.00 0.00 179.45 177.50 2jvw s ASP 45 N -6.08 0.85 -1.12 4.20 -1.08 -0.93 -5.09 116.67 107.41 2jvw s ASP 45 Ca -0.17 -2.78 -0.21 0.00 -0.52 0.00 0.00 52.55 48.86 2jvw s ASP 45 Cb -0.02 0.04 0.04 0.00 -1.46 0.00 0.00 42.92 41.52 2jvw s ASP 45 CO 0.64 -0.15 1.62 -2.16 0.52 0.00 0.00 175.17 175.64 2jvw s PRO 46 N 0.25 3.60 0.02 4.34 0.04 -1.26 -4.30 135.00 137.67 2jvw s PRO 46 Ca 0.32 -1.38 -0.20 0.00 0.04 0.00 0.00 61.00 59.78 2jvw s PRO 46 Cb 0.03 -5.40 0.04 0.00 0.04 0.00 0.00 34.50 29.21 2jvw s PRO 46 CO -0.17 -2.42 0.46 0.45 0.04 0.00 0.00 177.00 175.36 2jvw s SER 47 N 5.02 -0.36 0.14 6.66 0.15 -1.26 -5.00 113.70 119.06 2jvw s SER 47 Ca 0.52 0.18 -0.22 0.00 0.70 0.00 0.00 55.95 57.13 2jvw s SER 47 Cb 0.01 0.43 0.01 0.00 -1.71 0.00 0.00 66.02 64.76 2jvw s SER 47 CO -0.01 -0.62 1.65 0.40 1.20 0.00 0.00 173.24 175.86 2jvw h ILE 48 N 3.15 0.52 -0.55 6.45 1.08 -1.99 0.45 117.51 126.63 2jvw h ILE 48 Ca -0.30 0.00 -0.10 0.00 -0.39 0.00 0.00 64.86 64.07 2jvw h ILE 48 Cb 1.19 0.52 -0.02 0.00 -3.07 0.00 0.00 36.82 35.44 2jvw h ILE 48 CO 0.41 0.00 -0.06 0.11 -0.69 0.00 0.00 178.15 177.93 2jvw h LYS 49 N -0.19 1.00 0.00 2.37 1.57 -1.97 -1.39 116.57 117.96 2jvw h LYS 49 Ca 0.12 -0.34 0.00 0.00 -1.87 0.00 0.00 60.65 58.56 2jvw h LYS 49 Cb 0.37 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.60 2jvw h LYS 49 CO -0.31 1.02 0.00 0.77 -0.57 0.00 0.00 179.45 180.35 2jvw h SER 50 N 0.90 0.00 0.14 0.86 0.02 -1.64 -2.33 113.55 111.50 2jvw h SER 50 Ca 0.15 0.00 -0.36 0.00 -0.84 0.00 0.00 61.79 60.75 2jvw h SER 50 Cb 0.61 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 63.14 2jvw h SER 50 CO 0.04 0.00 -1.88 0.28 -1.14 0.00 0.00 176.83 174.13 2jvw h SER 51 N 0.00 0.47 -0.93 3.07 0.02 0.35 -3.38 113.55 113.15 2jvw h SER 51 Ca 0.00 -0.94 0.13 0.00 -0.84 0.00 0.00 61.79 60.14 2jvw h SER 51 Cb 0.35 -0.15 -0.08 0.00 0.14 0.00 0.00 62.40 62.66 2jvw h SER 51 CO 0.00 1.82 0.60 -0.07 -1.14 0.00 0.00 176.83 178.04 2jvw h LEU 52 N 0.05 0.79 -1.57 5.07 3.38 -0.74 0.11 115.31 122.40 2jvw h LEU 52 Ca -0.39 0.04 0.12 0.00 0.09 0.00 0.00 57.88 57.73 2jvw h LEU 52 Cb 2.03 -0.12 -0.04 0.00 0.09 0.00 0.00 40.66 42.62 2jvw h LEU 52 CO 0.11 0.42 0.46 0.07 0.09 0.00 0.00 178.44 179.59 2jvw h LYS 53 N 0.84 0.45 0.08 1.13 2.10 -1.65 -1.57 116.57 117.96 2jvw h LYS 53 Ca 0.46 -0.03 -0.34 0.00 -2.00 0.00 0.00 60.65 58.74 2jvw h LYS 53 Cb 0.57 -0.10 -0.03 0.00 -0.90 0.00 0.00 32.23 31.77 2jvw h LYS 53 CO -0.23 0.30 -1.90 0.34 -2.00 0.00 0.00 179.45 175.97 2jvw n PHE 54 N -4.48 1.01 -0.15 0.07 7.35 -0.14 -3.99 117.46 117.13 2jvw n PHE 54 Ca 0.12 0.27 -0.06 0.00 -0.76 0.00 0.00 57.45 57.02 2jvw n PHE 54 Cb 0.42 -1.12 0.11 0.00 0.35 0.00 0.00 39.48 39.25 2jvw n PHE 54 CO 0.00 0.00 0.00 -0.07 -0.76 0.00 0.00 176.76 175.93 2jvw h LEU 55 N -0.26 0.87 -1.08 -2.13 3.38 -0.75 0.20 115.31 115.54 2jvw h LEU 55 Ca -0.44 -0.22 -0.08 0.00 0.09 0.00 0.00 57.88 57.24 2jvw h LEU 55 Cb 1.82 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 42.33 2jvw h LEU 55 CO -0.03 0.92 -0.38 0.03 0.09 0.00 0.00 178.44 179.07 2jvw h ARG 56 N 0.84 0.00 0.00 1.13 3.08 -1.49 -3.31 114.38 114.64 2jvw h ARG 56 Ca 0.16 0.00 -0.01 0.00 0.07 0.00 0.00 59.98 60.20 2jvw h ARG 56 Cb 0.47 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.52 2jvw h ARG 56 CO 0.02 0.38 -0.23 0.87 -1.07 0.00 0.00 179.97 179.94 2jvw h LYS 57 N 0.00 0.00 -6.02 0.04 1.57 -1.61 -3.43 116.57 107.13 2jvw h LYS 57 Ca -0.00 0.00 -0.58 0.00 -1.87 0.00 0.00 60.65 58.20 2jvw h LYS 57 Cb 0.82 0.00 -0.10 0.00 0.08 0.00 0.00 32.23 33.02 2jvw h LYS 57 CO 0.05 0.14 0.96 0.99 -0.57 0.00 0.00 179.45 181.02 2jvw s THR 58 N -1.87 3.96 0.09 -0.16 2.01 0.67 -4.93 115.64 115.41 2jvw s THR 58 Ca -0.08 -0.04 -0.33 0.00 0.31 0.00 0.00 61.69 61.56 2jvw s THR 58 Cb 0.01 -4.87 -0.14 0.00 0.01 0.00 0.00 72.50 67.51 2jvw s THR 58 CO 0.16 -1.74 1.60 0.44 -0.69 0.00 0.00 174.62 174.38 2jvw h ASP 59 N 9.82 -1.11 -1.00 3.53 5.19 -1.85 -2.38 116.42 128.62 2jvw h ASP 59 Ca -0.20 0.09 0.11 0.00 -0.62 0.00 0.00 57.03 56.41 2jvw h ASP 59 Cb 1.05 0.37 -0.08 0.00 0.18 0.00 0.00 39.33 40.85 2jvw h ASP 59 CO 1.26 -0.56 0.63 4.11 -3.12 0.00 0.00 179.24 181.57 2jvw h TRP 60 N -0.83 1.14 -0.46 4.55 5.08 -1.91 0.05 115.95 123.57 2jvw h TRP 60 Ca -0.03 0.03 0.01 0.00 1.08 0.00 0.00 58.89 59.98 2jvw h TRP 60 Cb 0.74 -0.36 -0.03 0.00 -3.00 0.00 0.00 29.16 26.51 2jvw h TRP 60 CO -0.22 0.48 0.29 0.00 -1.28 0.00 0.00 178.44 177.71 2jvw h ALA 61 N 1.52 0.58 -0.16 0.11 0.00 -1.85 0.71 119.26 120.17 2jvw h ALA 61 Ca 0.48 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 55.40 2jvw h ALA 61 Cb 0.42 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 2jvw h ALA 61 CO -0.25 0.01 -0.04 -0.09 0.00 0.00 0.00 179.25 178.88 2jvw h ARG 62 N 0.60 -0.01 0.00 0.00 2.43 -0.67 -2.18 114.38 114.55 2jvw h ARG 62 Ca 0.17 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.33 2jvw h ARG 62 Cb -0.04 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 29.51 2jvw h ARG 62 CO -0.05 -0.00 -0.06 0.93 -1.51 0.00 0.00 179.97 179.27 2jvw h GLU 63 N -0.01 0.00 -0.44 0.20 4.39 -0.49 0.44 114.58 118.68 2jvw h GLU 63 Ca 0.08 0.00 -0.09 0.00 0.34 0.00 0.00 59.36 59.69 2jvw h GLU 63 Cb 0.13 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.76 2jvw h GLU 63 CO -0.17 0.06 -0.07 0.00 -1.16 0.00 0.00 179.01 177.67 2jvw h ARG 64 N 0.00 0.82 -0.16 2.33 2.47 -0.43 -0.62 114.38 118.79 2jvw h ARG 64 Ca -0.00 -0.30 -0.00 0.00 -1.26 0.00 0.00 59.98 58.42 2jvw h ARG 64 Cb 0.11 -0.06 -0.01 0.00 -1.65 0.00 0.00 29.97 28.37 2jvw h ARG 64 CO 0.01 0.92 0.10 0.28 0.56 0.00 0.00 179.97 181.84 2jvw h VAL 65 N 0.66 1.08 -0.61 2.04 2.07 -0.47 -0.66 116.25 120.35 2jvw h VAL 65 Ca 0.12 -0.20 0.12 0.00 0.82 0.00 0.00 66.70 67.56 2jvw h VAL 65 Cb 0.60 0.92 -0.09 0.00 -1.52 0.00 0.00 31.29 31.19 2jvw h VAL 65 CO 0.04 0.07 0.10 -0.33 0.02 0.00 0.00 177.57 177.47 2jvw h GLU 66 N 0.18 0.21 -0.90 1.57 4.39 -0.94 -1.45 114.58 117.64 2jvw h GLU 66 Ca 0.06 -0.01 0.01 0.00 0.34 0.00 0.00 59.36 59.76 2jvw h GLU 66 Cb 0.03 -0.05 -0.05 0.00 -0.10 0.00 0.00 28.75 28.59 2jvw h GLU 66 CO -0.01 0.14 0.60 -0.97 -1.16 0.00 0.00 179.01 177.61 2jvw h ASN 67 N 0.22 1.03 -0.84 1.42 -1.24 -0.63 -1.62 115.58 113.93 2jvw h ASN 67 Ca 0.32 -0.03 0.05 0.00 0.71 0.00 0.00 56.30 57.36 2jvw h ASN 67 Cb 0.50 -0.26 -0.06 0.00 0.73 0.00 0.00 38.32 39.24 2jvw h ASN 67 CO -0.44 0.74 0.52 0.40 -1.29 0.00 0.00 177.43 177.37 2jvw h ILE 68 N 1.21 1.07 -0.39 2.57 2.04 -0.05 0.33 117.51 124.31 2jvw h ILE 68 Ca 0.33 -0.34 -0.10 0.00 1.00 0.00 0.00 64.86 65.76 2jvw h ILE 68 Cb -0.13 0.01 -0.02 0.00 -0.74 0.00 0.00 36.82 35.94 2jvw h ILE 68 CO -0.07 0.18 -0.17 0.22 0.00 0.00 0.00 178.15 178.31 2jvw h TYR 69 N 0.98 0.80 -0.18 1.37 3.20 -1.03 -2.21 116.97 119.90 2jvw h TYR 69 Ca 0.35 -0.16 -0.02 0.00 3.14 0.00 0.00 58.73 62.05 2jvw h TYR 69 Cb 0.10 -0.20 -0.01 0.00 1.54 0.00 0.00 36.73 38.16 2jvw h TYR 69 CO -0.03 0.83 0.04 -0.07 -1.64 0.00 0.00 178.16 177.29 2jvw h LEU 70 N 0.64 0.22 -1.54 2.82 3.38 -0.34 0.05 115.31 120.55 2jvw h LEU 70 Ca 0.10 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.04 2jvw h LEU 70 Cb 0.64 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.32 2jvw h LEU 70 CO 0.04 0.24 0.14 0.11 0.09 0.00 0.00 178.44 179.06 2jvw h LYS 71 N 0.25 0.45 -0.07 1.13 1.57 -0.34 0.14 116.57 119.69 2jvw h LYS 71 Ca 0.06 -0.05 -0.24 0.00 -1.87 0.00 0.00 60.65 58.56 2jvw h LYS 71 Cb 0.11 -0.09 0.02 0.00 0.08 0.00 0.00 32.23 32.35 2jvw h LYS 71 CO -0.00 0.36 -0.89 1.25 -0.57 0.00 0.00 179.45 179.60 2jvw h LEU 72 N 0.45 0.90 -0.39 2.94 5.85 -0.92 -3.16 115.31 120.99 2jvw h LEU 72 Ca 0.11 -0.69 -0.02 0.00 0.84 0.00 0.00 57.88 58.12 2jvw h LEU 72 Cb 0.08 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 40.82 2jvw h LEU 72 CO -0.01 1.46 0.17 1.56 -0.34 0.00 0.00 178.44 181.27 2jvw h GLN 73 N 0.43 0.58 0.00 1.25 1.08 -0.47 0.22 115.11 118.19 2jvw h GLN 73 Ca -0.09 -0.10 -0.02 0.00 -1.45 0.00 0.00 58.65 56.99 2jvw h GLN 73 Cb 1.54 -0.10 -0.00 0.00 -0.05 0.00 0.00 27.48 28.87 2jvw h GLN 73 CO 0.18 0.54 -0.07 0.07 -0.95 0.00 0.00 178.83 178.59 2jvw h ARG 74 N 0.49 0.00 0.01 1.46 0.11 -1.10 -0.44 114.38 114.90 2jvw h ARG 74 Ca 0.13 0.00 -0.20 0.00 0.10 0.00 0.00 59.98 60.01 2jvw h ARG 74 Cb 0.17 0.00 -0.03 0.00 1.11 0.00 0.00 29.97 31.22 2jvw h ARG 74 CO -0.01 0.07 -0.97 1.25 0.10 0.00 0.00 179.97 180.41 2jvw h HIS 75 N 0.00 0.03 -3.17 4.08 2.76 -1.34 -3.46 115.15 114.04 2jvw h HIS 75 Ca -0.00 -0.02 -0.53 0.00 -2.20 0.00 0.00 60.37 57.62 2jvw h HIS 75 Cb 0.19 -0.00 0.06 0.00 1.55 0.00 0.00 27.41 29.21 2jvw h HIS 75 CO 0.00 0.97 0.85 0.15 -1.30 0.00 0.00 177.93 178.60 2jvw s LYS 76 N -2.82 4.20 0.43 5.26 3.01 0.00 -4.99 119.74 124.83 2jvw s LYS 76 Ca 0.00 2.43 -0.23 0.00 -1.01 0.00 0.00 55.97 57.16 2jvw s LYS 76 Cb 0.10 -3.09 -0.08 0.00 -1.01 0.00 0.00 37.83 33.75 2jvw s LYS 76 CO 0.82 -0.56 1.09 -1.83 0.51 0.00 0.00 175.35 175.38 2jvw s GLU 77 N 0.07 3.97 -0.60 1.68 -1.05 -1.26 -4.97 118.70 116.53 2jvw s GLU 77 Ca 0.64 1.60 -0.21 0.00 -0.15 0.00 0.00 54.97 56.84 2jvw s GLU 77 Cb -0.45 -2.44 0.07 0.00 -0.44 0.00 0.00 34.13 30.87 2jvw s GLU 77 CO 0.41 -0.33 0.85 1.03 0.95 0.00 0.00 175.26 178.17 2jvw s ARG 78 N -2.65 3.13 -0.16 -4.83 3.00 -1.26 -4.86 118.95 111.31 2jvw s ARG 78 Ca 0.61 -0.87 0.12 0.00 0.00 0.00 0.00 55.73 55.59 2jvw s ARG 78 Cb -0.24 -4.19 -0.23 0.00 0.00 0.00 0.00 34.95 30.29 2jvw s ARG 78 CO 0.29 -1.61 0.20 -1.71 0.00 0.00 0.00 175.30 172.47 2jvw n ASN 79 N 7.12 0.76 -3.99 0.23 5.15 -1.26 -5.03 115.26 118.25 2jvw n ASN 79 Ca -0.05 0.10 -0.10 0.00 -0.60 0.00 0.00 54.58 53.94 2jvw n ASN 79 Cb 0.45 0.31 -0.07 0.00 -0.53 0.00 0.00 39.78 39.94 2jvw n ASN 79 CO 0.00 0.00 0.00 -1.58 1.40 0.00 0.00 177.26 177.08 2jvw s GLN 80 N -2.53 1.28 0.00 1.20 0.74 -1.26 -5.18 119.66 113.91 2jvw s GLN 80 Ca -0.14 -1.23 0.00 0.00 0.05 0.00 0.00 55.36 54.04 2jvw s GLN 80 Cb 0.07 0.40 0.00 0.00 1.10 0.00 0.00 33.01 34.58 2jvw s GLN 80 CO 0.78 -0.49 0.00 1.28 -0.55 0.00 0.00 175.29 176.31 2jvw n LEU 81 N -0.27 0.00 0.00 3.68 4.77 -1.26 -5.22 117.00 118.70 2jvw n LEU 81 Ca -0.05 0.00 0.06 0.00 -0.03 0.00 0.00 56.01 55.99 2jvw n LEU 81 Cb 0.63 0.00 0.33 0.00 -2.33 0.00 0.00 43.42 42.05 2jvw n LEU 81 CO 0.24 -0.64 0.55 -1.84 -1.33 0.00 0.00 177.39 174.38