#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 1.97 -0.00 3.17 0.00 -1.26 -4.83 121.76 120.81 2jvw s ALA 2 Ca 0.00 -0.46 -0.24 0.00 0.00 0.00 0.00 51.96 51.26 2jvw s ALA 2 Cb 0.00 -4.33 -0.15 0.00 0.00 0.00 0.00 23.12 18.64 2jvw s ALA 2 CO 0.00 -4.12 1.10 1.25 0.00 0.00 0.00 175.76 173.99 2jvw h LEU 3 N 17.53 -0.45 -7.86 0.00 6.46 -2.12 -3.35 115.31 125.53 2jvw h LEU 3 Ca -0.24 -0.13 -0.73 0.00 -0.12 0.00 0.00 57.88 56.66 2jvw h LEU 3 Cb 1.19 0.12 -0.20 0.00 -0.73 0.00 0.00 40.66 41.04 2jvw h LEU 3 CO 1.20 -0.05 0.82 -0.63 -0.62 0.00 0.00 178.44 179.16 2jvw s ILE 4 N -4.38 5.03 -0.51 4.05 -1.09 -1.26 -5.00 121.20 118.04 2jvw s ILE 4 Ca -0.13 -2.11 -0.27 0.00 -2.23 0.00 0.00 60.65 55.90 2jvw s ILE 4 Cb 0.02 -4.75 -0.02 0.00 -1.58 0.00 0.00 42.46 36.12 2jvw s ILE 4 CO 0.48 -1.44 1.89 -0.32 -1.23 0.00 0.00 174.94 174.32 2jvw s MET 5 N 1.74 2.80 -0.29 2.79 -2.45 -1.26 -4.94 119.30 117.68 2jvw s MET 5 Ca 0.33 0.94 -0.02 0.00 -1.25 0.00 0.00 55.69 55.69 2jvw s MET 5 Cb -0.05 -4.35 0.10 0.00 1.25 0.00 0.00 34.83 31.78 2jvw s MET 5 CO -0.07 -2.51 0.10 -0.08 1.05 0.00 0.00 175.02 173.51 2jvw s THR 6 N 8.70 0.59 -0.19 10.11 -1.32 -1.26 -5.03 115.64 127.24 2jvw s THR 6 Ca 0.74 -1.15 -0.06 0.00 -1.21 0.00 0.00 61.69 60.00 2jvw s THR 6 Cb -0.16 -1.43 0.09 0.00 -1.51 0.00 0.00 72.50 69.49 2jvw s THR 6 CO 0.25 -0.65 0.39 -1.58 -2.21 0.00 0.00 174.62 170.82 2jvw s GLN 7 N 1.77 0.30 -1.57 7.08 0.74 -1.26 -4.89 119.66 121.83 2jvw s GLN 7 Ca 0.09 0.96 0.00 0.00 0.05 0.00 0.00 55.36 56.46 2jvw s GLN 7 Cb -0.17 0.22 0.00 0.00 1.10 0.00 0.00 33.01 34.16 2jvw s GLN 7 CO -0.27 -0.28 0.00 1.04 -0.55 0.00 0.00 175.29 175.23 2jvw n GLN 8 N 5.38 -1.64 -2.27 1.67 6.02 -1.26 -4.90 117.38 120.38 2jvw n GLN 8 Ca -0.08 0.88 -0.43 0.00 -0.01 0.00 0.00 57.00 57.37 2jvw n GLN 8 Cb 0.49 -5.34 -0.02 0.00 1.02 0.00 0.00 30.24 26.40 2jvw n GLN 8 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 2jvw s ASN 9 N -2.22 6.61 -0.40 1.08 4.22 -1.26 -4.99 114.94 117.98 2jvw s ASN 9 Ca 0.00 1.55 -0.21 0.00 -2.14 0.00 0.00 52.86 52.06 2jvw s ASN 9 Cb 0.00 -2.54 0.01 0.00 1.28 0.00 0.00 41.25 40.01 2jvw s ASN 9 CO 0.00 -1.07 0.69 0.20 -2.04 0.00 0.00 177.10 174.88 2jvw s ASN 10 N 3.23 6.41 0.18 3.54 0.01 -1.26 -4.96 114.94 122.08 2jvw s ASN 10 Ca 0.63 -0.02 -0.09 0.00 -0.71 0.00 0.00 52.86 52.66 2jvw s ASN 10 Cb -0.22 -2.35 0.06 0.00 0.41 0.00 0.00 41.25 39.15 2jvw s ASN 10 CO 0.24 -0.73 1.64 1.55 -1.51 0.00 0.00 177.10 178.28 2jvw h PRO 11 N 8.70 1.07 0.00 -0.60 0.13 -1.94 -3.41 132.00 135.94 2jvw h PRO 11 Ca -0.26 -0.34 0.00 0.00 -0.87 0.00 0.00 66.00 64.53 2jvw h PRO 11 Cb 1.10 -0.10 0.00 0.00 0.13 0.00 0.00 31.00 32.13 2jvw h PRO 11 CO 0.89 1.04 -0.11 1.47 -0.23 0.00 0.00 178.00 181.06 2jvw n LEU 12 N -4.19 0.01 -4.58 1.56 -0.00 -1.26 -4.89 117.00 103.66 2jvw n LEU 12 Ca 0.03 0.00 -0.16 0.00 -0.00 0.00 0.00 56.01 55.87 2jvw n LEU 12 Cb 0.35 0.00 -0.10 0.00 -0.00 0.00 0.00 43.42 43.67 2jvw n LEU 12 CO 0.44 0.00 1.16 -2.28 -0.00 0.00 0.00 177.39 176.72 2jvw s HIS 13 N -1.11 1.30 0.00 1.47 2.46 -1.26 -3.00 115.29 115.14 2jvw s HIS 13 Ca 0.00 2.02 0.00 0.00 0.47 0.00 0.00 55.06 57.55 2jvw s HIS 13 Cb 0.00 -3.43 0.00 0.00 -0.13 0.00 0.00 32.58 29.02 2jvw s HIS 13 CO 0.00 -0.89 0.00 0.41 -2.47 0.00 0.00 174.74 171.79 2jvw n GLY 14 N 6.24 0.47 3.60 1.59 0.00 -1.26 -4.78 105.19 111.05 2jvw n GLY 14 Ca 0.43 -0.57 -0.43 0.00 0.00 0.00 0.00 46.02 45.45 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 -1.71 3.59 0.81 -0.61 1.01 -1.16 -4.92 121.20 118.20 2jvw s ILE 15 Ca 0.00 0.60 -0.12 0.00 0.00 0.00 0.00 60.65 61.13 2jvw s ILE 15 Cb 0.00 -3.79 0.08 0.00 0.01 0.00 0.00 42.46 38.76 2jvw s ILE 15 CO 0.00 -0.50 1.18 0.42 0.00 0.00 0.00 174.94 176.04 2jvw s THR 16 N 6.47 2.01 0.44 2.92 -4.23 -1.26 -4.78 115.64 117.20 2jvw s THR 16 Ca 0.75 0.00 0.16 0.00 -1.18 0.00 0.00 61.69 61.43 2jvw s THR 16 Cb -0.20 -3.00 0.36 0.00 1.34 0.00 0.00 72.50 70.99 2jvw s THR 16 CO 0.34 -0.00 1.94 0.25 -0.54 0.00 0.00 174.62 176.60 2jvw h LEU 17 N -1.06 0.35 -0.12 4.79 5.85 -1.98 0.11 115.31 123.24 2jvw h LEU 17 Ca -0.46 0.02 -0.01 0.00 0.84 0.00 0.00 57.88 58.27 2jvw h LEU 17 Cb 1.33 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 42.30 2jvw h LEU 17 CO 0.66 0.19 0.04 -0.61 -0.34 0.00 0.00 178.44 178.38 2jvw h GLN 18 N 0.38 0.19 -0.28 1.25 4.15 -2.00 -0.74 115.11 118.06 2jvw h GLN 18 Ca 0.35 -0.04 -0.13 0.00 0.77 0.00 0.00 58.65 59.60 2jvw h GLN 18 Cb 0.82 -0.03 -0.01 0.00 0.21 0.00 0.00 27.48 28.47 2jvw h GLN 18 CO -0.10 0.32 -0.34 -0.22 -1.93 0.00 0.00 178.83 176.55 2jvw h LYS 19 N 0.03 0.63 0.11 1.69 1.63 -1.71 -2.28 116.57 116.65 2jvw h LYS 19 Ca 0.04 -0.29 0.02 0.00 -0.85 0.00 0.00 60.65 59.56 2jvw h LYS 19 Cb 0.20 -0.01 -0.03 0.00 -0.60 0.00 0.00 32.23 31.79 2jvw h LYS 19 CO -0.00 0.88 -0.22 1.25 -3.45 0.00 0.00 179.45 177.91 2jvw h LEU 20 N 0.53 -0.63 -0.37 5.20 6.46 -0.64 -0.32 115.31 125.54 2jvw h LEU 20 Ca 0.06 0.07 0.02 0.00 -0.12 0.00 0.00 57.88 57.91 2jvw h LEU 20 Cb 0.84 0.24 -0.03 0.00 -0.73 0.00 0.00 40.66 40.98 2jvw h LEU 20 CO 0.07 -0.31 0.21 0.25 -0.62 0.00 0.00 178.44 178.04 2jvw h LEU 21 N -0.41 0.32 -0.29 2.25 5.85 -1.13 -2.66 115.31 119.24 2jvw h LEU 21 Ca 0.03 0.01 0.06 0.00 0.84 0.00 0.00 57.88 58.82 2jvw h LEU 21 Cb 0.44 -0.06 -0.07 0.00 0.37 0.00 0.00 40.66 41.34 2jvw h LEU 21 CO -0.13 0.23 -0.14 0.74 -0.34 0.00 0.00 178.44 178.80 2jvw h THR 22 N 0.42 0.56 -0.73 1.05 2.02 -1.09 -0.33 112.91 114.81 2jvw h THR 22 Ca 0.15 0.00 0.13 0.00 0.77 0.00 0.00 66.41 67.46 2jvw h THR 22 Cb 0.03 0.56 -0.09 0.00 -1.74 0.00 0.00 68.15 66.91 2jvw h THR 22 CO -0.08 0.00 0.29 -0.33 0.37 0.00 0.00 175.52 175.77 2jvw h GLU 23 N -0.10 0.43 -0.38 6.66 4.39 -0.87 0.20 114.58 124.91 2jvw h GLU 23 Ca 0.15 -0.03 -0.05 0.00 0.34 0.00 0.00 59.36 59.77 2jvw h GLU 23 Cb 0.33 -0.10 -0.01 0.00 -0.10 0.00 0.00 28.75 28.87 2jvw h GLU 23 CO -0.36 0.29 0.03 -0.07 -1.16 0.00 0.00 179.01 177.74 2jvw h LEU 24 N 0.44 0.64 -1.06 1.33 3.38 -0.98 -0.76 115.31 118.30 2jvw h LEU 24 Ca 0.40 -0.29 -0.04 0.00 0.09 0.00 0.00 57.88 58.04 2jvw h LEU 24 Cb 0.58 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 41.13 2jvw h LEU 24 CO -0.39 0.77 0.19 0.58 0.09 0.00 0.00 178.44 179.68 2jvw h VAL 25 N 0.48 1.22 -0.03 1.22 2.07 -0.36 0.45 116.25 121.30 2jvw h VAL 25 Ca 0.11 -0.74 -0.26 0.00 0.82 0.00 0.00 66.70 66.63 2jvw h VAL 25 Cb 0.42 0.57 0.02 0.00 -1.52 0.00 0.00 31.29 30.78 2jvw h VAL 25 CO 0.01 0.29 -0.99 -0.33 0.02 0.00 0.00 177.57 176.57 2jvw h GLU 26 N 0.85 0.73 0.00 1.57 4.39 -0.87 -2.64 114.58 118.60 2jvw h GLU 26 Ca 0.19 -0.73 0.00 0.00 0.34 0.00 0.00 59.36 59.16 2jvw h GLU 26 Cb 0.23 0.20 0.00 0.00 -0.10 0.00 0.00 28.75 29.08 2jvw h GLU 26 CO -0.01 1.31 -1.14 0.72 -1.16 0.00 0.00 179.01 178.74 2jvw n HIS 27 N -3.87 0.06 0.07 4.33 8.25 -0.30 -4.74 115.22 119.02 2jvw n HIS 27 Ca -0.10 0.02 0.00 0.00 -0.26 0.00 0.00 57.72 57.38 2jvw n HIS 27 Cb 0.85 -0.20 0.00 0.00 1.12 0.00 0.00 29.99 31.76 2jvw n HIS 27 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 2jvw n TYR 28 N -1.73 -0.89 0.00 4.41 4.02 0.14 -5.05 117.16 118.06 2jvw n TYR 28 Ca 0.02 0.16 0.00 0.00 -0.01 0.00 0.00 57.90 58.07 2jvw n TYR 28 Cb 0.40 0.25 0.00 0.00 -0.02 0.00 0.00 39.34 39.97 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 2.57 2.51 0.30 2.72 0.00 -0.40 -4.63 105.19 108.26 2jvw n GLY 29 Ca 0.00 -1.84 0.07 0.00 0.00 0.00 0.00 46.02 44.24 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 0.31 0.58 1.61 4.06 -1.88 -2.62 115.95 118.02 2jvw h TRP 30 Ca 0.00 0.01 -0.02 0.00 2.06 0.00 0.00 58.89 60.94 2jvw h TRP 30 Cb 0.00 -0.11 -0.01 0.00 -1.00 0.00 0.00 29.16 28.04 2jvw h TRP 30 CO 0.00 0.19 -0.46 0.93 -3.56 0.00 0.00 178.44 175.54 2jvw h GLU 31 N 0.33 -0.97 -0.80 0.49 4.39 -1.90 0.06 114.58 116.18 2jvw h GLU 31 Ca 0.11 0.07 -0.02 0.00 0.34 0.00 0.00 59.36 59.86 2jvw h GLU 31 Cb 0.05 0.22 -0.04 0.00 -0.10 0.00 0.00 28.75 28.88 2jvw h GLU 31 CO -0.02 -0.65 0.41 0.93 -1.16 0.00 0.00 179.01 178.52 2jvw h GLU 32 N -1.01 1.13 -0.20 2.33 4.39 -1.79 0.13 114.58 119.56 2jvw h GLU 32 Ca -0.08 -0.15 0.03 0.00 0.34 0.00 0.00 59.36 59.50 2jvw h GLU 32 Cb 0.84 -0.21 -0.03 0.00 -0.10 0.00 0.00 28.75 29.26 2jvw h GLU 32 CO 0.01 0.86 0.04 -0.07 -1.16 0.00 0.00 179.01 178.68 2jvw h LEU 33 N 1.12 0.00 -0.54 1.33 3.38 -1.37 -0.46 115.31 118.78 2jvw h LEU 33 Ca 0.28 0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.28 2jvw h LEU 33 Cb 0.07 0.04 -0.00 0.00 0.09 0.00 0.00 40.66 40.87 2jvw h LEU 33 CO -0.04 0.03 -0.01 -1.28 0.09 0.00 0.00 178.44 177.23 2jvw h SER 34 N 0.11 0.00 1.07 -0.43 0.87 -0.76 0.08 113.55 114.50 2jvw h SER 34 Ca 0.09 0.00 -0.13 0.00 -1.23 0.00 0.00 61.79 60.51 2jvw h SER 34 Cb 0.09 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.03 2jvw h SER 34 CO -0.12 0.01 -0.64 0.22 -0.53 0.00 0.00 176.83 175.76 2jvw h TYR 35 N 0.00 0.00 0.12 2.24 3.20 -0.18 -3.28 116.97 119.07 2jvw h TYR 35 Ca -0.00 0.00 -0.34 0.00 3.14 0.00 0.00 58.73 61.53 2jvw h TYR 35 Cb 0.82 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 39.08 2jvw h TYR 35 CO 0.00 0.64 -1.81 0.52 -1.64 0.00 0.00 178.16 175.87 2jvw h MET 36 N 0.00 0.26 -4.63 1.82 2.86 -0.93 -3.44 114.93 110.87 2jvw h MET 36 Ca -0.01 -0.44 -0.70 0.00 -2.06 0.00 0.00 59.70 56.49 2jvw h MET 36 Cb 1.35 0.16 -0.28 0.00 0.06 0.00 0.00 31.60 32.89 2jvw h MET 36 CO 0.08 1.13 -0.58 0.08 1.06 0.00 0.00 176.91 178.68 2jvw s VAL 37 N -2.58 3.93 0.00 -2.22 1.01 0.00 -5.01 120.40 115.53 2jvw s VAL 37 Ca -0.16 -1.16 -0.02 0.00 0.00 0.00 0.00 61.98 60.65 2jvw s VAL 37 Cb 0.07 -3.26 -0.07 0.00 0.00 0.00 0.00 36.38 33.12 2jvw s VAL 37 CO 0.81 -0.24 1.99 0.59 0.00 0.00 0.00 175.10 178.25 2jvw n ASN 38 N 4.84 4.10 -4.53 3.32 4.13 -1.24 -4.29 115.26 121.58 2jvw n ASN 38 Ca -0.12 -2.14 -0.35 0.00 1.68 0.00 0.00 54.58 53.65 2jvw n ASN 38 Cb 0.44 -0.94 -0.11 0.00 -1.54 0.00 0.00 39.78 37.63 2jvw n ASN 38 CO 0.00 0.00 0.00 0.27 0.28 0.00 0.00 177.26 177.81 2jvw s ILE 39 N 0.78 4.39 -0.09 2.41 -4.36 -1.26 -4.99 121.20 118.08 2jvw s ILE 39 Ca 0.17 -0.16 0.29 0.00 -0.26 0.00 0.00 60.65 60.69 2jvw s ILE 39 Cb 0.08 -2.99 0.32 0.00 1.25 0.00 0.00 42.46 41.11 2jvw s ILE 39 CO 0.00 0.42 1.88 -1.13 0.24 0.00 0.00 174.94 176.35 2jvw h ASN 40 N 7.26 0.00 -0.16 4.36 -0.00 -1.94 -3.07 115.58 122.03 2jvw h ASN 40 Ca -0.36 0.00 0.05 0.00 -0.00 0.00 0.00 56.30 55.99 2jvw h ASN 40 Cb 1.18 0.00 -0.01 0.00 -0.00 0.00 0.00 38.32 39.49 2jvw h ASN 40 CO 0.64 0.00 0.17 0.00 -0.00 0.00 0.00 177.43 178.24 2jvw h PHE 42 N 0.00 0.00 0.01 0.00 0.04 -1.87 -3.37 116.94 111.75 2jvw h PHE 42 Ca 0.08 0.00 -0.25 0.00 2.80 0.00 0.00 57.97 60.60 2jvw h PHE 42 Cb 0.42 0.00 -0.03 0.00 2.20 0.00 0.00 35.95 38.54 2jvw h PHE 42 CO 0.00 0.07 -1.36 1.63 -0.60 0.00 0.00 178.31 178.06 2jvw n LYS 43 N -3.09 0.58 -2.86 1.51 4.76 0.57 -4.32 118.16 115.30 2jvw n LYS 43 Ca 0.03 0.55 -0.43 0.00 -2.87 0.00 0.00 58.31 55.60 2jvw n LYS 43 Cb 0.56 -1.74 -0.04 0.00 -1.84 0.00 0.00 35.03 31.97 2jvw n LYS 43 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 2jvw s LYS 44 N -2.38 3.72 -0.61 1.97 2.47 -0.10 -4.20 119.74 120.60 2jvw s LYS 44 Ca -0.29 0.37 -0.06 0.00 -1.56 0.00 0.00 55.97 54.43 2jvw s LYS 44 Cb 0.06 -3.84 0.01 0.00 -1.46 0.00 0.00 37.83 32.60 2jvw s LYS 44 CO 0.60 -0.99 0.65 -3.47 0.16 0.00 0.00 175.35 172.30 2jvw n ASP 45 N 6.76 -7.81 -3.16 1.43 2.03 -1.26 -4.76 116.55 109.78 2jvw n ASP 45 Ca 0.05 0.17 -0.26 0.00 0.52 0.00 0.00 54.79 55.27 2jvw n ASP 45 Cb 0.48 -5.31 -0.02 0.00 -0.72 0.00 0.00 41.12 35.55 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 -1.19 2.48 -3.84 -0.67 -0.02 -1.26 -4.78 135.00 125.71 2jvw n PRO 46 Ca 0.05 -1.62 -0.35 0.00 -2.02 0.00 0.00 63.50 59.56 2jvw n PRO 46 Cb 0.48 -2.51 -0.05 0.00 -0.02 0.00 0.00 33.50 31.39 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 3.03 6.43 0.06 2.55 0.01 -1.26 -5.04 113.70 119.48 2jvw s SER 47 Ca 0.48 0.46 -0.38 0.00 1.31 0.00 0.00 55.95 57.82 2jvw s SER 47 Cb 0.13 -2.05 -0.21 0.00 0.21 0.00 0.00 66.02 64.10 2jvw s SER 47 CO -0.04 0.30 1.57 0.40 0.41 0.00 0.00 173.24 175.88 2jvw h ILE 48 N 3.21 0.01 -0.99 1.44 1.08 -1.99 -1.52 117.51 118.75 2jvw h ILE 48 Ca -0.51 0.00 0.09 0.00 -0.39 0.00 0.00 64.86 64.05 2jvw h ILE 48 Cb 1.20 0.01 -0.07 0.00 -3.07 0.00 0.00 36.82 34.89 2jvw h ILE 48 CO 0.65 0.00 0.63 0.11 -0.69 0.00 0.00 178.15 178.85 2jvw h LYS 49 N -1.32 1.04 -0.04 2.37 1.57 -1.98 0.30 116.57 118.50 2jvw h LYS 49 Ca -0.13 -0.06 -0.00 0.00 -1.87 0.00 0.00 60.65 58.58 2jvw h LYS 49 Cb 1.03 -0.23 -0.00 0.00 0.08 0.00 0.00 32.23 33.10 2jvw h LYS 49 CO 0.20 0.69 0.02 0.77 -0.57 0.00 0.00 179.45 180.56 2jvw h SER 50 N 1.07 0.05 -0.46 0.86 0.02 -1.90 -1.85 113.55 111.34 2jvw h SER 50 Ca 0.45 -0.11 -0.13 0.00 -0.84 0.00 0.00 61.79 61.17 2jvw h SER 50 Cb 0.31 -0.01 -0.01 0.00 0.14 0.00 0.00 62.40 62.82 2jvw h SER 50 CO -0.22 0.14 -0.22 0.77 -1.14 0.00 0.00 176.83 176.17 2jvw h SER 51 N -0.05 0.99 -0.90 3.07 4.64 -0.88 -2.85 113.55 117.57 2jvw h SER 51 Ca 0.01 -0.40 0.11 0.00 -0.47 0.00 0.00 61.79 61.04 2jvw h SER 51 Cb 0.11 -0.27 -0.08 0.00 -0.31 0.00 0.00 62.40 61.84 2jvw h SER 51 CO -0.00 1.17 0.54 -0.07 -0.87 0.00 0.00 176.83 177.60 2jvw h LEU 52 N 0.81 0.78 -0.85 5.97 3.38 -0.89 -0.17 115.31 124.34 2jvw h LEU 52 Ca 0.10 0.05 0.06 0.00 0.09 0.00 0.00 57.88 58.18 2jvw h LEU 52 Cb 0.80 -0.10 -0.06 0.00 0.09 0.00 0.00 40.66 41.39 2jvw h LEU 52 CO 0.07 0.43 0.53 0.50 0.09 0.00 0.00 178.44 180.05 2jvw h LYS 53 N 0.88 0.93 -0.67 1.13 3.64 -1.11 -0.65 116.57 120.72 2jvw h LYS 53 Ca 0.44 -0.06 -0.07 0.00 -1.27 0.00 0.00 60.65 59.69 2jvw h LYS 53 Cb 0.42 -0.21 -0.03 0.00 -0.41 0.00 0.00 32.23 32.00 2jvw h LYS 53 CO -0.26 0.62 0.14 0.35 -2.27 0.00 0.00 179.45 178.03 2jvw h PHE 54 N 0.96 1.15 0.00 1.91 3.57 -1.00 -2.23 116.94 121.30 2jvw h PHE 54 Ca 0.37 -0.15 0.00 0.00 3.53 0.00 0.00 57.97 61.72 2jvw h PHE 54 Cb 0.17 -0.32 0.00 0.00 2.79 0.00 0.00 35.95 38.58 2jvw h PHE 54 CO -0.03 0.95 0.00 -0.07 -2.23 0.00 0.00 178.31 176.93 2jvw h LEU 55 N 1.02 0.00 0.04 0.59 3.38 -0.19 -1.81 115.31 118.34 2jvw h LEU 55 Ca 0.21 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.12 2jvw h LEU 55 Cb 0.40 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.15 2jvw h LEU 55 CO 0.01 0.00 -0.28 0.03 0.09 0.00 0.00 178.44 178.29 2jvw h ARG 56 N 0.00 0.08 0.00 1.13 3.08 -0.56 -3.36 114.38 114.76 2jvw h ARG 56 Ca 0.00 -0.14 -0.06 0.00 0.07 0.00 0.00 59.98 59.85 2jvw h ARG 56 Cb 0.33 0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.43 2jvw h ARG 56 CO 0.00 1.07 -0.28 1.57 -1.07 0.00 0.00 179.97 181.26 2jvw h LYS 57 N -0.82 0.00 -6.09 0.04 2.10 -1.27 -3.44 116.57 107.10 2jvw h LYS 57 Ca -0.05 0.00 -0.68 0.00 -2.00 0.00 0.00 60.65 57.91 2jvw h LYS 57 Cb 1.20 0.00 -0.24 0.00 -0.90 0.00 0.00 32.23 32.29 2jvw h LYS 57 CO 0.04 0.28 -0.76 0.95 -2.00 0.00 0.00 179.45 177.96 2jvw s THR 58 N -3.79 3.13 -0.17 0.07 -4.23 -0.70 -5.02 115.64 104.93 2jvw s THR 58 Ca -0.01 -0.68 -0.20 0.00 -1.18 0.00 0.00 61.69 59.62 2jvw s THR 58 Cb 0.12 -2.25 -0.22 0.00 1.34 0.00 0.00 72.50 71.48 2jvw s THR 58 CO 0.66 0.58 0.36 0.44 -0.54 0.00 0.00 174.62 176.11 2jvw h ASP 59 N 5.63 0.12 -0.62 3.99 3.32 -1.85 -3.35 116.42 123.67 2jvw h ASP 59 Ca -0.42 -0.68 0.02 0.00 0.02 0.00 0.00 57.03 55.97 2jvw h ASP 59 Cb 1.17 -0.04 -0.03 0.00 0.22 0.00 0.00 39.33 40.64 2jvw h ASP 59 CO 0.52 1.50 0.40 4.11 -1.72 0.00 0.00 179.24 184.04 2jvw h TRP 60 N -0.75 0.75 -0.04 4.55 5.08 -1.95 0.14 115.95 123.72 2jvw h TRP 60 Ca -0.31 0.02 -0.00 0.00 1.08 0.00 0.00 58.89 59.68 2jvw h TRP 60 Cb 1.44 -0.25 -0.00 0.00 -3.00 0.00 0.00 29.16 27.34 2jvw h TRP 60 CO 0.12 0.45 0.01 0.00 -1.28 0.00 0.00 178.44 177.74 2jvw h ALA 61 N 1.25 0.05 -0.45 0.11 0.00 -1.95 -2.87 119.26 115.40 2jvw h ALA 61 Ca 0.24 -0.11 0.03 0.00 0.00 0.00 0.00 54.91 55.07 2jvw h ALA 61 Cb -0.04 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 2jvw h ALA 61 CO -0.07 -0.35 0.24 -0.09 0.00 0.00 0.00 179.25 178.98 2jvw h ARG 62 N -0.14 0.47 -0.40 0.00 2.43 -1.63 -2.49 114.38 112.62 2jvw h ARG 62 Ca 0.01 -0.03 0.07 0.00 -0.81 0.00 0.00 59.98 59.23 2jvw h ARG 62 Cb 0.21 -0.11 -0.09 0.00 -0.42 0.00 0.00 29.97 29.56 2jvw h ARG 62 CO -0.00 0.31 -0.41 0.93 -1.51 0.00 0.00 179.97 179.30 2jvw h GLU 63 N 0.49 -0.30 -0.95 0.20 4.39 -0.90 0.45 114.58 117.96 2jvw h GLU 63 Ca 0.19 0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.91 2jvw h GLU 63 Cb 0.06 0.07 -0.05 0.00 -0.10 0.00 0.00 28.75 28.74 2jvw h GLU 63 CO -0.11 -0.20 0.61 0.00 -1.16 0.00 0.00 179.01 178.15 2jvw h ARG 64 N -0.31 1.27 -0.02 2.33 3.08 -1.36 0.05 114.38 119.42 2jvw h ARG 64 Ca 0.15 -0.09 -0.00 0.00 0.07 0.00 0.00 59.98 60.11 2jvw h ARG 64 Cb 0.58 -0.28 -0.00 0.00 0.08 0.00 0.00 29.97 30.35 2jvw h ARG 64 CO -0.57 0.85 0.01 0.28 -1.07 0.00 0.00 179.97 179.48 2jvw h VAL 65 N 1.30 1.05 -0.46 2.04 2.07 -0.84 -0.90 116.25 120.51 2jvw h VAL 65 Ca 0.35 -0.13 -0.09 0.00 0.82 0.00 0.00 66.70 67.64 2jvw h VAL 65 Cb -0.12 1.10 -0.02 0.00 -1.52 0.00 0.00 31.29 30.74 2jvw h VAL 65 CO -0.07 0.04 -0.10 -0.33 0.02 0.00 0.00 177.57 177.13 2jvw h GLU 66 N -0.03 0.82 -0.36 1.57 5.08 -0.64 -2.08 114.58 118.94 2jvw h GLU 66 Ca 0.01 -0.27 -0.05 0.00 -1.00 0.00 0.00 59.36 58.05 2jvw h GLU 66 Cb 0.05 -0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.21 2jvw h GLU 66 CO -0.00 0.88 0.01 -0.91 -1.00 0.00 0.00 179.01 177.99 2jvw h ASN 67 N 0.74 0.52 -0.79 1.42 2.35 -0.86 -0.10 115.58 118.87 2jvw h ASN 67 Ca 0.13 -0.10 -0.05 0.00 -0.55 0.00 0.00 56.30 55.73 2jvw h ASN 67 Cb 0.59 -0.14 -0.03 0.00 0.05 0.00 0.00 38.32 38.78 2jvw h ASN 67 CO 0.04 0.59 0.30 0.40 -1.65 0.00 0.00 177.43 177.11 2jvw h ILE 68 N 0.54 1.26 -0.65 2.81 2.04 -0.76 -1.54 117.51 121.22 2jvw h ILE 68 Ca 0.12 -0.84 -0.04 0.00 1.00 0.00 0.00 64.86 65.09 2jvw h ILE 68 Cb 0.33 0.33 -0.03 0.00 -0.74 0.00 0.00 36.82 36.71 2jvw h ILE 68 CO 0.01 0.34 0.23 0.22 0.00 0.00 0.00 178.15 178.95 2jvw h TYR 69 N 1.15 0.98 -0.86 1.37 3.20 -0.65 -2.03 116.97 120.14 2jvw h TYR 69 Ca 0.26 -0.07 -0.01 0.00 3.14 0.00 0.00 58.73 62.05 2jvw h TYR 69 Cb 0.23 -0.29 -0.04 0.00 1.54 0.00 0.00 36.73 38.17 2jvw h TYR 69 CO 0.02 0.77 0.51 -0.07 -1.64 0.00 0.00 178.16 177.75 2jvw h LEU 70 N 0.94 1.03 -0.80 2.82 3.38 -0.67 -0.66 115.31 121.36 2jvw h LEU 70 Ca 0.22 -0.07 0.05 0.00 0.09 0.00 0.00 57.88 58.17 2jvw h LEU 70 Cb 0.23 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 40.66 2jvw h LEU 70 CO -0.01 0.80 0.49 0.50 0.09 0.00 0.00 178.44 180.31 2jvw h LYS 71 N 1.18 0.90 -0.72 1.13 3.64 -0.64 0.48 116.57 122.55 2jvw h LYS 71 Ca 0.31 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.62 2jvw h LYS 71 Cb -0.04 -0.20 -0.03 0.00 -0.41 0.00 0.00 32.23 31.55 2jvw h LYS 71 CO -0.06 0.60 0.40 1.25 -2.27 0.00 0.00 179.45 179.37 2jvw h LEU 72 N 0.93 0.89 0.00 5.20 5.85 -0.70 -1.69 115.31 125.80 2jvw h LEU 72 Ca 0.34 -0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.97 2jvw h LEU 72 Cb 0.10 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 40.91 2jvw h LEU 72 CO -0.15 0.73 0.00 0.00 -0.34 0.00 0.00 178.44 178.68 2jvw n GLN 73 N -4.49 0.13 0.01 1.25 1.13 -0.32 -1.01 117.38 114.08 2jvw n GLN 73 Ca 0.06 0.07 0.13 0.00 -1.94 0.00 0.00 57.00 55.32 2jvw n GLN 73 Cb 0.09 -1.50 0.34 0.00 0.11 0.00 0.00 30.24 29.27 2jvw n GLN 73 CO 0.00 0.00 0.00 -2.13 -1.44 0.00 0.00 177.06 173.49 2jvw n ARG 74 N -1.42 0.03 -0.07 -1.09 0.00 0.16 -3.81 116.66 110.46 2jvw n ARG 74 Ca 0.08 0.01 -0.17 0.00 -0.00 0.00 0.00 57.85 57.77 2jvw n ARG 74 Cb 0.25 -1.52 -0.13 0.00 0.00 0.00 0.00 32.46 31.06 2jvw n ARG 74 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.63 179.21 2jvw n HIS 75 N -1.57 0.49 -3.77 -0.14 -0.00 -0.18 -4.80 115.22 105.26 2jvw n HIS 75 Ca 0.06 0.12 -0.36 0.00 0.46 0.00 0.00 57.72 57.99 2jvw n HIS 75 Cb 0.35 -1.07 -0.12 0.00 -0.12 0.00 0.00 29.99 29.03 2jvw n HIS 75 CO 0.00 0.00 0.00 -1.59 0.46 0.00 0.00 176.34 175.21 2jvw s LYS 76 N -2.54 2.13 -0.43 1.57 -2.85 -0.26 -5.06 119.74 112.30 2jvw s LYS 76 Ca -0.24 -1.71 -0.26 0.00 -1.00 0.00 0.00 55.97 52.76 2jvw s LYS 76 Cb 0.08 -3.55 -0.07 0.00 -2.06 0.00 0.00 37.83 32.23 2jvw s LYS 76 CO 0.71 -1.00 2.38 0.39 0.10 0.00 0.00 175.35 177.93 2jvw n GLU 77 N 4.63 1.25 -4.05 1.78 -0.58 -1.25 -4.52 120.64 117.90 2jvw n GLU 77 Ca -0.05 0.11 -0.32 0.00 -0.42 0.00 0.00 57.16 56.49 2jvw n GLU 77 Cb 0.42 -3.41 -0.15 0.00 -0.57 0.00 0.00 31.44 27.72 2jvw n GLU 77 CO 0.00 0.00 0.00 1.03 -0.48 0.00 0.00 177.13 177.68 2jvw s ARG 78 N 7.87 2.27 0.02 3.49 0.52 -1.26 -5.09 118.95 126.78 2jvw s ARG 78 Ca 0.99 -1.09 -0.10 0.00 -0.52 0.00 0.00 55.73 55.01 2jvw s ARG 78 Cb -0.21 -2.68 0.03 0.00 0.52 0.00 0.00 34.95 32.62 2jvw s ARG 78 CO 0.28 -0.47 0.48 0.27 0.02 0.00 0.00 175.30 175.88 2jvw n ASN 79 N 4.55 -0.57 -3.01 0.23 2.04 -1.26 -5.02 115.26 112.22 2jvw n ASN 79 Ca -0.15 -1.21 -0.22 0.00 -0.44 0.00 0.00 54.58 52.56 2jvw n ASN 79 Cb 0.45 0.91 0.04 0.00 -2.53 0.00 0.00 39.78 38.65 2jvw n ASN 79 CO 0.00 0.00 0.00 1.67 -0.44 0.00 0.00 177.26 178.49 2jvw n GLN 80 N -0.34 -5.38 -2.75 -3.83 7.27 -1.26 -3.96 117.38 107.13 2jvw n GLN 80 Ca 0.01 0.85 -0.01 0.00 0.07 0.00 0.00 57.00 57.92 2jvw n GLN 80 Cb 0.23 -5.66 -0.01 0.00 2.41 0.00 0.00 30.24 27.21 2jvw n GLN 80 CO 0.00 0.00 0.00 1.28 0.07 0.00 0.00 177.06 178.41 2jvw n LEU 81 N -4.08 -7.22 -0.15 1.69 4.32 -1.26 -5.36 117.00 104.95 2jvw n LEU 81 Ca -0.08 1.50 0.15 0.00 -0.02 0.00 0.00 56.01 57.56 2jvw n LEU 81 Cb 0.60 -3.14 0.82 0.00 -1.62 0.00 0.00 43.42 40.08 2jvw n LEU 81 CO 0.49 -3.21 1.04 -1.84 -1.22 0.00 0.00 177.39 172.64