#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1d5v s LEU 2 N 0.00 2.27 0.00 -0.89 1.43 -1.26 -5.14 118.68 115.09 1d5v s LEU 2 Ca 0.00 -0.67 0.02 0.00 -1.03 0.00 0.00 54.13 52.45 1d5v s LEU 2 Cb 0.00 -1.05 -0.01 0.00 0.03 0.00 0.00 46.19 45.16 1d5v s LEU 2 CO 0.00 0.14 -0.05 0.68 0.23 0.00 0.00 176.35 177.35 1d5v s VAL 3 N -1.02 0.41 0.84 -1.59 -7.23 -1.26 -5.15 120.40 105.40 1d5v s VAL 3 Ca 0.10 -0.31 -0.12 0.00 -1.81 0.00 0.00 61.98 59.84 1d5v s VAL 3 Cb -0.10 -0.37 0.09 0.00 0.56 0.00 0.00 36.38 36.57 1d5v s VAL 3 CO 0.04 0.06 1.10 -0.54 -0.31 0.00 0.00 175.10 175.45 1d5v s LYS 4 N -0.28 1.77 -0.37 4.82 -0.14 -1.26 -4.95 119.74 119.33 1d5v s LYS 4 Ca 0.01 0.65 -0.26 0.00 -1.36 0.00 0.00 55.97 55.01 1d5v s LYS 4 Cb -0.03 -1.88 0.01 0.00 -1.68 0.00 0.00 37.83 34.26 1d5v s LYS 4 CO -0.00 -1.84 0.91 -1.25 -0.76 0.00 0.00 175.35 172.41 1d5v s PRO 5 N -5.11 3.82 0.00 -1.68 0.05 -1.26 -4.89 135.00 125.93 1d5v s PRO 5 Ca 0.62 0.54 0.00 0.00 0.05 0.00 0.00 61.00 62.21 1d5v s PRO 5 Cb -0.15 -3.81 0.00 0.00 0.05 0.00 0.00 34.50 30.59 1d5v s PRO 5 CO 0.55 -0.95 0.61 -2.30 0.05 0.00 0.00 177.00 174.96 1d5v n PRO 6 N 6.76 0.00 -2.20 0.56 -0.02 -1.26 -4.56 135.00 134.28 1d5v n PRO 6 Ca 0.07 0.17 -0.41 0.00 -2.02 0.00 0.00 63.50 61.31 1d5v n PRO 6 Cb 0.48 -1.73 -0.03 0.00 -0.02 0.00 0.00 33.50 32.20 1d5v n PRO 6 CO 0.00 0.00 0.00 0.71 1.98 0.00 0.00 175.50 178.19 1d5v s TYR 7 N -2.22 3.19 0.82 6.00 2.02 -1.26 -5.00 117.35 120.89 1d5v s TYR 7 Ca 0.00 1.42 -0.11 0.00 -0.37 0.00 0.00 57.07 58.01 1d5v s TYR 7 Cb 0.00 -3.59 0.08 0.00 -0.40 0.00 0.00 41.96 38.05 1d5v s TYR 7 CO 0.00 -1.64 1.10 0.45 -1.57 0.00 0.00 175.55 173.89 1d5v s SER 8 N -0.39 4.30 0.27 2.29 0.15 -1.26 -4.75 113.70 114.31 1d5v s SER 8 Ca 0.50 1.36 -0.04 0.00 0.70 0.00 0.00 55.95 58.47 1d5v s SER 8 Cb -0.38 -2.08 0.35 0.00 -1.71 0.00 0.00 66.02 62.20 1d5v s SER 8 CO 0.48 -2.10 1.95 1.88 1.20 0.00 0.00 173.24 176.65 1d5v h TYR 9 N -1.18 1.16 -0.63 3.44 0.05 -1.94 0.26 116.97 118.13 1d5v h TYR 9 Ca -0.47 0.03 -0.09 0.00 0.05 0.00 0.00 58.73 58.24 1d5v h TYR 9 Cb 1.27 -0.39 -0.02 0.00 1.01 0.00 0.00 36.73 38.59 1d5v h TYR 9 CO 0.46 0.73 0.03 0.82 -1.05 0.00 0.00 178.16 179.15 1d5v h ILE 10 N 1.25 1.27 -0.56 -2.88 1.08 -2.00 -2.18 117.51 113.48 1d5v h ILE 10 Ca 0.34 -1.13 -0.11 0.00 -0.39 0.00 0.00 64.86 63.57 1d5v h ILE 10 Cb -0.14 0.75 -0.02 0.00 -3.07 0.00 0.00 36.82 34.34 1d5v h ILE 10 CO -0.07 0.42 -0.07 0.00 -0.69 0.00 0.00 178.15 177.73 1d5v h ALA 11 N 1.01 0.76 -0.63 1.87 0.00 -1.66 -1.77 119.26 118.84 1d5v h ALA 11 Ca 0.18 -0.34 0.01 0.00 0.00 0.00 0.00 54.91 54.76 1d5v h ALA 11 Cb 0.54 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 18.09 1d5v h ALA 11 CO 0.03 0.65 0.41 -0.07 0.00 0.00 0.00 179.25 180.27 1d5v h LEU 12 N 0.92 0.72 -0.81 0.00 3.38 -0.76 0.27 115.31 119.03 1d5v h LEU 12 Ca 0.15 -0.02 0.01 0.00 0.09 0.00 0.00 57.88 58.11 1d5v h LEU 12 Cb 0.63 -0.18 -0.04 0.00 0.09 0.00 0.00 40.66 41.16 1d5v h LEU 12 CO 0.04 0.53 0.53 0.40 0.09 0.00 0.00 178.44 180.04 1d5v h ILE 13 N 0.85 1.21 -0.65 1.22 2.04 -1.15 0.08 117.51 121.11 1d5v h ILE 13 Ca 0.23 -0.38 -0.09 0.00 1.00 0.00 0.00 64.86 65.62 1d5v h ILE 13 Cb -0.09 0.02 -0.02 0.00 -0.74 0.00 0.00 36.82 35.98 1d5v h ILE 13 CO -0.05 0.20 0.07 0.74 0.00 0.00 0.00 178.15 179.11 1d5v h THR 14 N 1.10 1.27 -0.37 -0.27 2.02 -0.34 -3.00 112.91 113.31 1d5v h THR 14 Ca 0.30 -1.09 -0.17 0.00 0.77 0.00 0.00 66.41 66.22 1d5v h THR 14 Cb -0.13 0.69 -0.00 0.00 -1.74 0.00 0.00 68.15 66.97 1d5v h THR 14 CO -0.06 0.40 -0.41 0.24 0.37 0.00 0.00 175.52 176.06 1d5v h MET 15 N 1.02 0.94 -0.80 6.66 2.86 0.11 -3.02 114.93 122.69 1d5v h MET 15 Ca 0.19 -0.51 0.08 0.00 -2.06 0.00 0.00 59.70 57.41 1d5v h MET 15 Cb 0.49 0.03 -0.07 0.00 0.06 0.00 0.00 31.60 32.11 1d5v h MET 15 CO 0.02 1.16 0.46 0.00 1.06 0.00 0.00 176.91 179.61 1d5v h ALA 16 N 0.76 1.13 -0.71 6.32 0.00 -0.89 -0.07 119.26 125.80 1d5v h ALA 16 Ca 0.05 0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 1d5v h ALA 16 Cb 1.01 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.63 1d5v h ALA 16 CO 0.10 0.11 0.18 0.82 0.00 0.00 0.00 179.25 180.46 1d5v h ILE 17 N 0.79 1.26 -0.49 0.00 2.04 -1.48 0.57 117.51 120.21 1d5v h ILE 17 Ca 0.38 -0.95 -0.09 0.00 1.00 0.00 0.00 64.86 65.20 1d5v h ILE 17 Cb 0.31 0.53 -0.02 0.00 -0.74 0.00 0.00 36.82 36.91 1d5v h ILE 17 CO -0.23 0.37 -0.03 1.56 0.00 0.00 0.00 178.15 179.81 1d5v h GLN 18 N 1.06 0.88 -0.32 2.37 4.20 -1.09 -2.76 115.11 119.45 1d5v h GLN 18 Ca 0.22 -0.30 0.00 0.00 0.06 0.00 0.00 58.65 58.63 1d5v h GLN 18 Cb 0.36 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 28.07 1d5v h GLN 18 CO 0.00 0.94 0.00 0.27 -0.67 0.00 0.00 178.83 179.37 1d5v n ASN 19 N -4.30 2.04 -4.64 1.46 0.23 -0.17 -4.85 115.26 105.04 1d5v n ASN 19 Ca 0.01 -1.90 -0.43 0.00 -0.53 0.00 0.00 54.58 51.72 1d5v n ASN 19 Cb 0.34 -0.21 -0.02 0.00 -2.08 0.00 0.00 39.78 37.80 1d5v n ASN 19 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1d5v s ALA 20 N -1.57 3.49 0.59 -2.53 0.00 0.18 -4.87 121.76 117.05 1d5v s ALA 20 Ca 0.29 0.00 0.33 0.00 0.00 0.00 0.00 51.96 52.58 1d5v s ALA 20 Cb 0.15 -3.68 1.25 0.00 0.00 0.00 0.00 23.12 20.85 1d5v s ALA 20 CO 0.21 -1.49 1.51 -1.35 0.00 0.00 0.00 175.76 174.65 1d5v h PRO 21 N 8.23 0.00 -5.26 0.00 0.11 -1.88 -3.34 132.00 129.86 1d5v h PRO 21 Ca -0.21 0.00 -0.63 0.00 0.11 0.00 0.00 66.00 65.27 1d5v h PRO 21 Cb 1.07 0.00 -0.33 0.00 0.11 0.00 0.00 31.00 31.85 1d5v h PRO 21 CO 1.03 0.00 -0.86 -2.00 -0.21 0.00 0.00 178.00 175.96 1d5v s GLU 22 N -4.61 2.46 0.25 1.05 2.56 -1.26 -5.02 118.70 114.14 1d5v s GLU 22 Ca -0.04 -0.74 -0.06 0.00 0.00 0.00 0.00 54.97 54.14 1d5v s GLU 22 Cb 0.18 -1.96 0.26 0.00 2.00 0.00 0.00 34.13 34.61 1d5v s GLU 22 CO 0.61 0.19 1.93 0.87 -0.56 0.00 0.00 175.26 178.29 1d5v h LYS 23 N 6.59 1.33 -5.80 4.30 1.79 -1.86 -3.37 116.57 119.55 1d5v h LYS 23 Ca -0.26 -0.08 -0.60 0.00 -2.18 0.00 0.00 60.65 57.53 1d5v h LYS 23 Cb 1.21 -0.30 -0.10 0.00 -1.58 0.00 0.00 32.23 31.46 1d5v h LYS 23 CO 0.47 0.88 0.43 0.15 -1.08 0.00 0.00 179.45 180.31 1d5v s LYS 24 N -6.11 4.02 0.04 3.15 1.02 -1.26 -4.58 119.74 116.02 1d5v s LYS 24 Ca -0.13 0.68 0.05 0.00 0.02 0.00 0.00 55.97 56.59 1d5v s LYS 24 Cb 0.18 -3.71 -0.02 0.00 -0.52 0.00 0.00 37.83 33.76 1d5v s LYS 24 CO 0.82 -0.65 -0.14 -1.50 -0.92 0.00 0.00 175.35 172.95 1d5v s ILE 25 N 2.96 1.13 0.67 2.17 2.07 -1.22 -4.85 121.20 124.13 1d5v s ILE 25 Ca 0.33 -1.00 -0.11 0.00 -1.41 0.00 0.00 60.65 58.46 1d5v s ILE 25 Cb -0.14 -1.02 -0.01 0.00 0.13 0.00 0.00 42.46 41.42 1d5v s ILE 25 CO 0.12 0.01 1.07 0.42 -1.91 0.00 0.00 174.94 174.65 1d5v s THR 26 N -0.85 4.02 0.20 4.00 -4.23 -1.26 -1.47 115.64 116.05 1d5v s THR 26 Ca 0.02 0.66 -0.12 0.00 -1.18 0.00 0.00 61.69 61.07 1d5v s THR 26 Cb -0.08 -3.63 0.12 0.00 1.34 0.00 0.00 72.50 70.26 1d5v s THR 26 CO 0.01 -0.86 1.87 0.25 -0.54 0.00 0.00 174.62 175.35 1d5v h LEU 27 N -0.53 0.77 -0.79 4.79 5.85 -1.95 -1.95 115.31 121.51 1d5v h LEU 27 Ca -0.45 -0.02 -0.05 0.00 0.84 0.00 0.00 57.88 58.20 1d5v h LEU 27 Cb 1.22 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 42.03 1d5v h LEU 27 CO 0.63 0.56 0.30 0.78 -0.34 0.00 0.00 178.44 180.36 1d5v h ASN 28 N 0.91 1.10 -0.84 1.25 2.35 -1.95 -2.72 115.58 115.69 1d5v h ASN 28 Ca 0.25 -0.18 0.00 0.00 -0.55 0.00 0.00 56.30 55.82 1d5v h ASN 28 Cb -0.11 -0.29 -0.04 0.00 0.05 0.00 0.00 38.32 37.94 1d5v h ASN 28 CO -0.05 0.99 0.54 1.23 -1.65 0.00 0.00 177.43 178.49 1d5v h GLY 29 N 1.15 1.19 1.01 2.83 0.00 -1.74 -2.36 103.07 105.15 1d5v h GLY 29 Ca 0.26 -0.46 0.01 0.00 0.00 0.00 0.00 47.33 47.14 1d5v h GLY 29 CO -0.02 0.45 0.65 -2.22 0.00 0.00 0.00 176.54 175.40 1d5v h ILE 30 N 1.14 1.25 -0.71 2.60 2.04 -1.10 -2.06 117.51 120.67 1d5v h ILE 30 Ca 0.31 -0.46 0.00 0.00 1.00 0.00 0.00 64.86 65.71 1d5v h ILE 30 Cb -0.10 -0.20 -0.03 0.00 -0.74 0.00 0.00 36.82 35.74 1d5v h ILE 30 CO -0.06 0.24 0.46 1.88 0.00 0.00 0.00 178.15 180.67 1d5v h TYR 31 N 1.33 0.91 -0.88 1.37 0.05 -1.41 -2.56 116.97 115.78 1d5v h TYR 31 Ca 0.36 0.01 0.01 0.00 0.05 0.00 0.00 58.73 59.16 1d5v h TYR 31 Cb -0.15 -0.30 -0.04 0.00 1.01 0.00 0.00 36.73 37.24 1d5v h TYR 31 CO -0.00 0.59 0.58 0.37 -1.05 0.00 0.00 178.16 178.65 1d5v h GLN 32 N 0.97 1.15 -0.09 4.88 4.15 -1.29 -2.25 115.11 122.63 1d5v h GLN 32 Ca 0.26 -0.07 0.00 0.00 0.77 0.00 0.00 58.65 59.61 1d5v h GLN 32 Cb -0.08 -0.26 -0.00 0.00 0.21 0.00 0.00 27.48 27.34 1d5v h GLN 32 CO -0.05 0.76 0.06 0.35 -1.93 0.00 0.00 178.83 178.02 1d5v h PHE 33 N 1.19 0.12 -1.01 3.99 3.57 -1.09 -2.53 116.94 121.17 1d5v h PHE 33 Ca 0.32 0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.83 1d5v h PHE 33 Cb -0.14 -0.04 -0.05 0.00 2.79 0.00 0.00 35.95 38.51 1d5v h PHE 33 CO -0.01 0.07 0.67 0.82 -2.23 0.00 0.00 178.31 177.63 1d5v h ILE 34 N 0.13 1.26 -0.57 1.41 2.04 -1.25 0.23 117.51 120.76 1d5v h ILE 34 Ca 0.03 -0.47 -0.00 0.00 1.00 0.00 0.00 64.86 65.42 1d5v h ILE 34 Cb -0.01 -0.23 -0.03 0.00 -0.74 0.00 0.00 36.82 35.81 1d5v h ILE 34 CO -0.01 0.25 0.35 0.24 0.00 0.00 0.00 178.15 178.98 1d5v h MET 35 N 1.37 0.77 0.06 2.37 2.86 -1.11 0.25 114.93 121.50 1d5v h MET 35 Ca 0.37 -0.07 -0.00 0.00 -2.06 0.00 0.00 59.70 57.94 1d5v h MET 35 Cb -0.16 -0.16 0.00 0.00 0.06 0.00 0.00 31.60 31.34 1d5v h MET 35 CO -0.08 0.55 -0.03 -0.44 1.06 0.00 0.00 176.91 177.97 1d5v h ASP 36 N 0.77 -0.07 -0.33 1.22 3.32 -1.04 -3.11 116.42 117.17 1d5v h ASP 36 Ca 0.20 -0.55 0.00 0.00 0.02 0.00 0.00 57.03 56.71 1d5v h ASP 36 Cb -0.02 0.02 -0.02 0.00 0.22 0.00 0.00 39.33 39.53 1d5v h ASP 36 CO -0.04 0.57 0.22 -0.09 -1.72 0.00 0.00 179.24 178.18 1d5v h ARG 37 N -0.79 0.44 -4.61 3.56 9.65 -0.96 -3.38 114.38 118.29 1d5v h ARG 37 Ca -0.01 -0.03 -0.64 0.00 -1.10 0.00 0.00 59.98 58.20 1d5v h ARG 37 Cb 0.62 -0.10 -0.38 0.00 -1.39 0.00 0.00 29.97 28.73 1d5v h ARG 37 CO 0.01 0.29 -0.79 -0.06 2.80 0.00 0.00 179.97 182.23 1d5v s PHE 38 N -6.16 2.86 -1.27 2.20 0.08 0.87 -4.99 117.98 111.58 1d5v s PHE 38 Ca -0.13 -2.08 0.29 0.00 0.12 0.00 0.00 56.93 55.13 1d5v s PHE 38 Cb 0.10 -1.80 1.26 0.00 -0.57 0.00 0.00 43.02 42.01 1d5v s PHE 38 CO 0.71 -0.83 1.91 -0.35 -0.10 0.00 0.00 175.22 176.56 1d5v n PRO 39 N 4.54 0.28 -0.02 0.24 -0.04 -1.18 -3.76 135.00 135.06 1d5v n PRO 39 Ca -0.12 -0.04 0.04 0.00 -0.04 0.00 0.00 63.50 63.33 1d5v n PRO 39 Cb 0.43 -1.50 0.41 0.00 -0.04 0.00 0.00 33.50 32.80 1d5v n PRO 39 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 1d5v h PHE 40 N 0.11 0.55 0.00 0.54 0.04 -1.90 -1.23 116.94 115.04 1d5v h PHE 40 Ca 0.00 0.01 -0.05 0.00 2.80 0.00 0.00 57.97 60.74 1d5v h PHE 40 Cb 0.40 -0.19 -0.01 0.00 2.20 0.00 0.00 35.95 38.36 1d5v h PHE 40 CO 0.00 0.34 -0.21 1.88 -0.60 0.00 0.00 178.31 179.72 1d5v h TYR 41 N 0.59 0.00 -0.90 -0.55 -1.99 -1.84 -2.73 116.97 109.55 1d5v h TYR 41 Ca 0.16 0.00 0.01 0.00 2.00 0.00 0.00 58.73 60.90 1d5v h TYR 41 Cb -0.06 0.00 -0.04 0.00 2.00 0.00 0.00 36.73 38.63 1d5v h TYR 41 CO -0.00 0.21 0.60 0.00 -0.00 0.00 0.00 178.16 178.97 1d5v h ARG 42 N 0.00 1.19 -0.99 4.88 3.08 -1.46 -1.18 114.38 119.91 1d5v h ARG 42 Ca -0.00 -0.07 0.01 0.00 0.07 0.00 0.00 59.98 59.98 1d5v h ARG 42 Cb 0.48 -0.27 -0.05 0.00 0.08 0.00 0.00 29.97 30.21 1d5v h ARG 42 CO 0.03 0.79 0.65 0.93 -1.07 0.00 0.00 179.97 181.30 1d5v h GLU 43 N 1.22 1.30 -4.73 0.04 5.08 -1.58 -3.36 114.58 112.56 1d5v h GLU 43 Ca 0.33 -0.08 -0.67 0.00 -1.00 0.00 0.00 59.36 57.94 1d5v h GLU 43 Cb -0.14 -0.29 -0.37 0.00 0.50 0.00 0.00 28.75 28.45 1d5v h GLU 43 CO -0.07 0.86 -0.72 -0.80 -1.00 0.00 0.00 179.01 177.28 1d5v s ASN 44 N -6.14 4.76 -0.14 1.42 0.01 -0.45 -4.99 114.94 109.40 1d5v s ASN 44 Ca -0.13 -1.74 -0.10 0.00 -0.71 0.00 0.00 52.86 50.19 1d5v s ASN 44 Cb 0.18 -1.65 -0.03 0.00 0.41 0.00 0.00 41.25 40.16 1d5v s ASN 44 CO 0.82 -0.32 -0.19 0.29 -1.51 0.00 0.00 177.10 176.19 1d5v n LYS 45 N 4.42 0.46 -2.25 -0.60 5.02 -1.20 -4.70 118.16 119.32 1d5v n LYS 45 Ca -0.06 0.51 -0.41 0.00 -2.02 0.00 0.00 58.31 56.33 1d5v n LYS 45 Cb 0.42 -1.68 -0.03 0.00 -0.02 0.00 0.00 35.03 33.73 1d5v n LYS 45 CO 0.00 0.00 0.00 -0.65 -0.52 0.00 0.00 177.40 176.23 1d5v s GLN 46 N -2.29 4.46 0.00 1.97 -0.21 -1.26 -3.64 119.66 118.69 1d5v s GLN 46 Ca -0.16 2.06 0.00 0.00 0.02 0.00 0.00 55.36 57.28 1d5v s GLN 46 Cb 0.02 -3.11 0.00 0.00 1.00 0.00 0.00 33.01 30.92 1d5v s GLN 46 CO 0.24 -0.04 0.00 0.41 -2.12 0.00 0.00 175.29 173.78 1d5v n GLY 47 N 0.94 2.89 0.08 3.09 0.00 -1.26 -4.81 105.19 106.12 1d5v n GLY 47 Ca -0.00 -0.82 -0.05 0.00 0.00 0.00 0.00 46.02 45.15 1d5v n GLY 47 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 173.32 173.43 1d5v h TRP 48 N 0.00 0.00 -0.62 1.61 5.08 -1.87 -3.22 115.95 116.93 1d5v h TRP 48 Ca 0.00 0.00 -0.07 0.00 1.08 0.00 0.00 58.89 59.90 1d5v h TRP 48 Cb 0.00 0.00 -0.02 0.00 -3.00 0.00 0.00 29.16 26.14 1d5v h TRP 48 CO 0.00 0.89 0.13 1.96 -1.28 0.00 0.00 178.44 180.14 1d5v h GLN 49 N 0.00 1.01 -0.35 0.12 4.20 -1.87 -3.02 115.11 115.20 1d5v h GLN 49 Ca -0.06 -0.26 -0.16 0.00 0.06 0.00 0.00 58.65 58.22 1d5v h GLN 49 Cb 1.74 -0.13 -0.01 0.00 0.30 0.00 0.00 27.48 29.39 1d5v h GLN 49 CO 0.11 0.93 -0.42 -0.91 -0.67 0.00 0.00 178.83 177.87 1d5v h ASN 50 N 0.93 0.96 -1.01 1.46 2.35 -1.89 -3.19 115.58 115.19 1d5v h ASN 50 Ca 0.19 -0.46 0.01 0.00 -0.55 0.00 0.00 56.30 55.50 1d5v h ASN 50 Cb 0.39 -0.27 -0.05 0.00 0.05 0.00 0.00 38.32 38.44 1d5v h ASN 50 CO 0.01 1.25 0.67 0.28 -1.65 0.00 0.00 177.43 177.98 1d5v h SER 51 N 0.72 1.16 -1.00 5.81 0.02 -1.55 -1.91 113.55 116.80 1d5v h SER 51 Ca 0.05 -0.03 0.01 0.00 -0.84 0.00 0.00 61.79 60.98 1d5v h SER 51 Cb 1.01 -0.29 -0.05 0.00 0.14 0.00 0.00 62.40 63.21 1d5v h SER 51 CO 0.10 0.84 0.66 0.40 -1.14 0.00 0.00 176.83 177.69 1d5v h ILE 52 N 1.36 1.26 -0.40 3.27 1.08 -1.52 -1.99 117.51 120.57 1d5v h ILE 52 Ca 0.37 -0.47 -0.11 0.00 -0.39 0.00 0.00 64.86 64.26 1d5v h ILE 52 Cb -0.16 -0.22 -0.02 0.00 -3.07 0.00 0.00 36.82 33.36 1d5v h ILE 52 CO -0.08 0.25 -0.18 0.03 -0.69 0.00 0.00 178.15 177.48 1d5v h ARG 53 N 1.36 0.76 -0.59 2.37 3.08 -1.40 -1.93 114.38 118.04 1d5v h ARG 53 Ca 0.37 -0.29 0.01 0.00 0.07 0.00 0.00 59.98 60.14 1d5v h ARG 53 Cb -0.16 -0.05 -0.03 0.00 0.08 0.00 0.00 29.97 29.82 1d5v h ARG 53 CO -0.08 0.89 0.39 1.25 -1.07 0.00 0.00 179.97 181.35 1d5v h HIS 54 N 0.68 0.74 -0.39 3.04 2.76 -0.66 -2.33 115.15 118.98 1d5v h HIS 54 Ca 0.10 0.02 -0.14 0.00 -2.20 0.00 0.00 60.37 58.15 1d5v h HIS 54 Cb 0.67 -0.25 -0.01 0.00 1.55 0.00 0.00 27.41 29.37 1d5v h HIS 54 CO 0.03 0.47 -0.30 -0.91 -1.30 0.00 0.00 177.93 175.92 1d5v h ASN 55 N 0.80 0.89 0.00 3.26 4.21 -1.30 -3.30 115.58 120.14 1d5v h ASN 55 Ca 0.22 -0.36 -0.30 0.00 1.21 0.00 0.00 56.30 57.06 1d5v h ASN 55 Cb -0.09 -0.25 0.01 0.00 -1.12 0.00 0.00 38.32 36.87 1d5v h ASN 55 CO -0.05 1.12 2.14 0.18 -1.29 0.00 0.00 177.43 179.54 1d5v n LEU 56 N -4.08 4.04 0.05 1.61 4.77 -0.74 -2.76 117.00 119.90 1d5v n LEU 56 Ca -0.01 -2.53 0.00 0.00 -0.03 0.00 0.00 56.01 53.44 1d5v n LEU 56 Cb 0.49 -0.98 0.00 0.00 -2.33 0.00 0.00 43.42 40.60 1d5v n LEU 56 CO 0.46 0.37 0.00 -1.54 -1.33 0.00 0.00 177.39 175.35 1d5v n SER 57 N 4.16 -0.94 -0.18 -1.43 3.41 -1.24 -4.94 113.62 112.46 1d5v n SER 57 Ca 0.36 0.38 -0.11 0.00 -0.26 0.00 0.00 58.87 59.24 1d5v n SER 57 Cb 0.14 1.13 0.01 0.00 -0.26 0.00 0.00 64.21 65.23 1d5v n SER 57 CO 0.00 0.00 0.00 -0.07 -0.16 0.00 0.00 175.04 174.81 1d5v h LEU 58 N 0.00 1.04 -9.31 1.04 3.38 -1.62 -3.41 115.31 106.43 1d5v h LEU 58 Ca 0.00 -0.37 -0.55 0.00 0.09 0.00 0.00 57.88 57.05 1d5v h LEU 58 Cb 0.00 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.45 1d5v h LEU 58 CO 0.00 1.17 0.87 0.20 0.09 0.00 0.00 178.44 180.77 1d5v s ASN 59 N -6.68 6.86 0.00 -0.43 0.01 -1.11 -4.86 114.94 108.72 1d5v s ASN 59 Ca -0.11 2.02 0.28 0.00 -0.71 0.00 0.00 52.86 54.34 1d5v s ASN 59 Cb 0.13 -2.55 1.04 0.00 0.41 0.00 0.00 41.25 40.28 1d5v s ASN 59 CO 0.87 -0.75 1.74 -0.62 -1.51 0.00 0.00 177.10 176.83 1d5v n GLU 60 N 5.87 1.67 -0.25 -0.60 1.02 -1.26 -4.03 120.64 123.06 1d5v n GLU 60 Ca 0.14 -0.97 -0.08 0.00 -0.02 0.00 0.00 57.16 56.23 1d5v n GLU 60 Cb 0.44 -1.48 0.04 0.00 -0.02 0.00 0.00 31.44 30.42 1d5v n GLU 60 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1d5v s PHE 62 N -5.27 3.26 -0.13 0.00 0.08 -1.26 -4.16 117.98 110.50 1d5v s PHE 62 Ca -0.12 1.59 0.02 0.00 0.12 0.00 0.00 56.93 58.55 1d5v s PHE 62 Cb 0.15 -2.89 0.00 0.00 -0.57 0.00 0.00 43.02 39.71 1d5v s PHE 62 CO 0.85 -0.27 -0.20 0.08 -0.10 0.00 0.00 175.22 175.58 1d5v s VAL 63 N -2.18 2.28 -0.19 -0.44 1.01 -0.53 -4.91 120.40 115.43 1d5v s VAL 63 Ca 0.63 -0.92 -0.18 0.00 0.00 0.00 0.00 61.98 61.51 1d5v s VAL 63 Cb -0.10 -1.91 -0.03 0.00 0.00 0.00 0.00 36.38 34.33 1d5v s VAL 63 CO 0.16 0.54 0.48 -0.75 0.00 0.00 0.00 175.10 175.53 1d5v s LYS 64 N 0.60 4.20 -0.56 2.72 2.20 -1.26 -2.85 119.74 124.79 1d5v s LYS 64 Ca -0.11 0.36 0.05 0.00 -0.36 0.00 0.00 55.97 55.90 1d5v s LYS 64 Cb -0.16 -3.54 0.17 0.00 -1.51 0.00 0.00 37.83 32.79 1d5v s LYS 64 CO 0.03 -0.09 0.43 1.33 -0.36 0.00 0.00 175.35 176.69 1d5v n VAL 65 N 4.41 0.24 -1.71 4.02 0.24 -1.18 -4.98 118.33 119.38 1d5v n VAL 65 Ca -0.06 -4.17 -0.35 0.00 -2.04 0.00 0.00 64.34 57.71 1d5v n VAL 65 Cb 0.51 -1.92 0.07 0.00 -1.47 0.00 0.00 33.84 31.02 1d5v n VAL 65 CO 0.00 0.00 0.00 -2.84 -2.14 0.00 0.00 176.83 171.85 1d5v s PRO 66 N -0.78 2.54 0.00 7.34 0.02 -1.26 -4.03 135.00 138.82 1d5v s PRO 66 Ca 0.30 1.85 0.00 0.00 0.02 0.00 0.00 61.00 63.17 1d5v s PRO 66 Cb 0.01 -1.87 0.00 0.00 0.02 0.00 0.00 34.50 32.66 1d5v s PRO 66 CO -0.18 -1.55 0.00 2.89 -0.33 0.00 0.00 177.00 177.83 1d5v n ARG 67 N -2.13 -0.53 -2.28 5.54 1.85 -1.26 -4.96 116.66 112.89 1d5v n ARG 67 Ca 0.14 0.00 -0.36 0.00 -1.00 0.00 0.00 57.85 56.63 1d5v n ARG 67 Cb 0.49 0.00 -0.00 0.00 -1.05 0.00 0.00 32.46 31.90 1d5v n ARG 67 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 1d5v s ASP 68 N -1.39 5.93 0.54 2.89 1.01 -1.26 -4.90 116.67 119.49 1d5v s ASP 68 Ca 0.00 2.20 0.32 0.00 0.71 0.00 0.00 52.55 55.79 1d5v s ASP 68 Cb 0.00 -2.59 1.33 0.00 1.01 0.00 0.00 42.92 42.68 1d5v s ASP 68 CO 0.00 -1.08 1.97 0.44 0.21 0.00 0.00 175.17 176.72 1d5v h ASP 69 N 1.53 0.00 -1.00 0.27 3.32 -1.99 -2.98 116.42 115.57 1d5v h ASP 69 Ca -0.50 0.00 0.01 0.00 0.02 0.00 0.00 57.03 56.56 1d5v h ASP 69 Cb 1.25 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 40.75 1d5v h ASP 69 CO 0.58 0.04 0.65 0.11 -1.72 0.00 0.00 179.24 178.90 1d5v h LYS 70 N 0.00 1.32 -6.11 3.56 1.57 -2.02 -3.39 116.57 111.50 1d5v h LYS 70 Ca -0.00 -0.08 -0.57 0.00 -1.87 0.00 0.00 60.65 58.12 1d5v h LYS 70 Cb 0.53 -0.29 -0.05 0.00 0.08 0.00 0.00 32.23 32.49 1d5v h LYS 70 CO 0.00 0.88 0.57 0.21 -0.57 0.00 0.00 179.45 180.54 1d5v s LYS 71 N -6.10 4.34 0.00 3.15 2.20 -1.13 -5.04 119.74 117.16 1d5v s LYS 71 Ca -0.13 1.26 0.00 0.00 -0.36 0.00 0.00 55.97 56.74 1d5v s LYS 71 Cb 0.18 -3.58 0.00 0.00 -1.51 0.00 0.00 37.83 32.92 1d5v s LYS 71 CO 0.82 -0.40 0.00 -0.35 -0.36 0.00 0.00 175.35 175.06 1d5v n PRO 72 N 5.41 1.64 0.00 4.03 -0.04 -1.26 -4.85 135.00 139.93 1d5v n PRO 72 Ca 0.08 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.54 1d5v n PRO 72 Cb 0.48 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.94 1d5v n PRO 72 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1d5v n GLY 73 N 5.00 3.12 3.77 0.55 0.00 -1.26 -4.73 105.19 111.64 1d5v n GLY 73 Ca 0.00 -0.17 -0.40 0.00 0.00 0.00 0.00 46.02 45.45 1d5v n GLY 73 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1d5v s LYS 74 N 0.00 3.99 -0.21 1.61 1.02 -1.26 -4.93 119.74 119.96 1d5v s LYS 74 Ca 0.00 2.38 0.16 0.00 0.02 0.00 0.00 55.97 58.52 1d5v s LYS 74 Cb 0.00 -2.84 0.38 0.00 -0.52 0.00 0.00 37.83 34.85 1d5v s LYS 74 CO 0.00 -0.56 1.26 0.41 -0.92 0.00 0.00 175.35 175.55 1d5v n GLY 75 N 0.59 1.56 3.49 -3.33 0.00 -1.26 -4.86 105.19 101.39 1d5v n GLY 75 Ca 0.03 -0.52 -0.11 0.00 0.00 0.00 0.00 46.02 45.41 1d5v n GLY 75 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1d5v s SER 76 N -2.09 -0.70 0.10 1.61 0.01 -1.26 -4.57 113.70 106.80 1d5v s SER 76 Ca 0.17 1.23 0.04 0.00 1.31 0.00 0.00 55.95 58.69 1d5v s SER 76 Cb 0.33 1.17 -0.04 0.00 0.21 0.00 0.00 66.02 67.69 1d5v s SER 76 CO -0.09 -0.21 -0.11 -0.31 0.41 0.00 0.00 173.24 172.94 1d5v s TYR 77 N 0.96 1.12 -0.04 2.43 2.02 -1.26 -4.10 117.35 118.47 1d5v s TYR 77 Ca -0.05 -0.65 0.04 0.00 -0.37 0.00 0.00 57.07 56.04 1d5v s TYR 77 Cb -0.05 -0.60 -0.00 0.00 -0.40 0.00 0.00 41.96 40.90 1d5v s TYR 77 CO -0.09 0.02 -0.16 -1.58 -1.57 0.00 0.00 175.55 172.18 1d5v s TRP 78 N -2.47 1.65 0.21 2.71 0.52 -0.54 -3.08 118.94 117.94 1d5v s TRP 78 Ca 0.07 -0.49 -0.21 0.00 0.02 0.00 0.00 56.10 55.49 1d5v s TRP 78 Cb -0.03 -1.12 0.04 0.00 -1.15 0.00 0.00 33.47 31.21 1d5v s TRP 78 CO 0.00 -0.17 0.62 -0.08 0.02 0.00 0.00 176.95 177.34 1d5v s THR 79 N 0.10 0.01 -0.23 2.01 -1.32 -1.13 -3.46 115.64 111.62 1d5v s THR 79 Ca -0.05 -0.51 -0.18 0.00 -1.21 0.00 0.00 61.69 59.74 1d5v s THR 79 Cb -0.12 -1.46 -0.03 0.00 -1.51 0.00 0.00 72.50 69.38 1d5v s THR 79 CO 0.02 -0.03 0.52 -0.76 -2.21 0.00 0.00 174.62 172.16 1d5v s LEU 80 N -2.83 4.10 0.02 9.08 1.43 -1.26 -1.46 118.68 127.75 1d5v s LEU 80 Ca 0.06 0.60 -0.28 0.00 -1.03 0.00 0.00 54.13 53.48 1d5v s LEU 80 Cb -0.03 -2.68 0.09 0.00 0.03 0.00 0.00 46.19 43.60 1d5v s LEU 80 CO -0.04 -0.23 0.80 -1.81 0.23 0.00 0.00 176.35 175.29 1d5v s ASP 81 N 1.34 -0.46 0.19 2.29 1.01 -1.26 -4.95 116.67 114.84 1d5v s ASP 81 Ca 0.23 0.13 0.00 0.00 0.71 0.00 0.00 52.55 53.62 1d5v s ASP 81 Cb -0.15 0.45 0.00 0.00 1.01 0.00 0.00 42.92 44.23 1d5v s ASP 81 CO 0.09 -0.68 0.00 -0.81 0.21 0.00 0.00 175.17 173.98 1d5v n PRO 82 N -0.03 1.06 -1.11 8.23 -0.04 -1.26 -4.58 135.00 137.27 1d5v n PRO 82 Ca -0.12 0.00 -0.32 0.00 -0.04 0.00 0.00 63.50 63.02 1d5v n PRO 82 Cb 0.62 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 34.04 1d5v n PRO 82 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1d5v n ASP 83 N -0.69 7.36 -2.11 3.54 8.00 -1.26 -4.68 116.55 126.71 1d5v n ASP 83 Ca 0.00 -2.48 -0.16 0.00 0.71 0.00 0.00 54.79 52.86 1d5v n ASP 83 Cb 0.00 -1.40 -0.12 0.00 -0.02 0.00 0.00 41.12 39.58 1d5v n ASP 83 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1d5v n SER 84 N 3.70 5.66 0.19 -2.24 3.41 -1.26 -4.54 113.62 118.53 1d5v n SER 84 Ca 0.66 -2.71 -0.12 0.00 -0.26 0.00 0.00 58.87 56.44 1d5v n SER 84 Cb 0.24 -1.33 -0.07 0.00 -0.26 0.00 0.00 64.21 62.79 1d5v n SER 84 CO 0.00 0.00 0.00 0.22 -0.16 0.00 0.00 175.04 175.10 1d5v h TYR 85 N 2.82 -0.49 -0.29 7.33 5.03 -2.02 -3.34 116.97 126.01 1d5v h TYR 85 Ca 0.24 -0.01 0.00 0.00 2.58 0.00 0.00 58.73 61.54 1d5v h TYR 85 Cb 1.23 0.16 0.00 0.00 1.55 0.00 0.00 36.73 39.67 1d5v h TYR 85 CO 1.56 -0.17 0.00 0.09 -1.32 0.00 0.00 178.16 178.32 1d5v n ASN 86 N -5.15 4.07 0.00 -2.11 4.13 -1.26 -4.57 115.26 110.37 1d5v n ASN 86 Ca -0.09 -3.01 0.03 0.00 1.68 0.00 0.00 54.58 53.19 1d5v n ASN 86 Cb 0.27 -0.56 0.17 0.00 -1.54 0.00 0.00 39.78 38.12 1d5v n ASN 86 CO 0.00 0.00 0.00 0.23 0.28 0.00 0.00 177.26 177.77 1d5v n MET 87 N -0.41 0.45 -0.38 3.52 2.81 -1.25 -3.05 117.12 118.81 1d5v n MET 87 Ca 0.22 0.00 -0.02 0.00 -1.81 0.00 0.00 57.70 56.09 1d5v n MET 87 Cb 0.92 -1.19 0.11 0.00 -0.71 0.00 0.00 33.22 32.35 1d5v n MET 87 CO 0.00 0.00 0.00 0.74 1.51 0.00 0.00 175.97 178.22 1d5v h PHE 88 N 0.00 1.26 -2.92 2.03 -1.00 -1.85 -3.41 116.94 111.06 1d5v h PHE 88 Ca 0.00 0.03 -0.67 0.00 2.81 0.00 0.00 57.97 60.14 1d5v h PHE 88 Cb 0.00 -0.43 -0.10 0.00 3.61 0.00 0.00 35.95 39.03 1d5v h PHE 88 CO 0.00 0.80 -0.53 -1.21 -1.61 0.00 0.00 178.31 175.75 1d5v s GLU 89 N -6.12 3.29 0.10 1.51 8.01 -1.17 -5.11 118.70 119.21 1d5v s GLU 89 Ca -0.13 -0.24 0.06 0.00 0.01 0.00 0.00 54.97 54.67 1d5v s GLU 89 Cb 0.18 -3.05 -0.03 0.00 -4.31 0.00 0.00 34.13 26.92 1d5v s GLU 89 CO 0.82 0.73 -0.15 -0.80 0.01 0.00 0.00 175.26 175.87 1d5v s ASN 90 N -0.93 1.95 0.00 -0.19 0.02 -1.26 -4.69 114.94 109.84 1d5v s ASN 90 Ca 0.14 -0.71 0.00 0.00 -1.02 0.00 0.00 52.86 51.27 1d5v s ASN 90 Cb -0.12 -0.07 0.00 0.00 0.02 0.00 0.00 41.25 41.08 1d5v s ASN 90 CO 0.03 -0.08 0.00 0.61 0.02 0.00 0.00 177.10 177.68 1d5v n GLY 91 N 0.95 2.21 0.23 0.66 0.00 -1.26 -4.83 105.19 103.15 1d5v n GLY 91 Ca -0.19 0.00 0.13 0.00 0.00 0.00 0.00 46.02 45.97 1d5v n GLY 91 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1d5v h SER 92 N 0.00 0.00 -4.40 1.61 4.64 -2.03 -3.44 113.55 109.94 1d5v h SER 92 Ca 0.00 0.00 -0.30 0.00 -0.47 0.00 0.00 61.79 61.02 1d5v h SER 92 Cb 0.00 0.00 -0.24 0.00 -0.31 0.00 0.00 62.40 61.85 1d5v h SER 92 CO 0.00 0.00 -0.74 0.72 -0.87 0.00 0.00 176.83 175.94 1d5v s PHE 93 N -3.31 0.60 -0.34 4.77 -0.12 -1.26 -5.24 117.98 113.08 1d5v s PHE 93 Ca 0.06 -0.32 0.03 0.00 -0.05 0.00 0.00 56.93 56.64 1d5v s PHE 93 Cb 0.06 -0.37 0.02 0.00 -0.63 0.00 0.00 43.02 42.10 1d5v s PHE 93 CO 0.64 -0.05 0.59 1.28 -0.05 0.00 0.00 175.22 177.63