#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 4.24 0.16 4.03 1.43 -1.26 -5.11 118.68 122.17 1d5v s LEU 2 Ca 0.00 0.38 0.05 0.00 -1.03 0.00 0.00 54.13 53.54 1d5v s LEU 2 Cb 0.00 -2.13 -0.05 0.00 0.03 0.00 0.00 46.19 44.04 1d5v s LEU 2 CO 0.00 0.37 -0.11 0.68 0.23 0.00 0.00 176.35 177.52 1d5v s VAL 3 N -1.07 1.35 0.51 -1.59 -7.23 -1.26 -5.08 120.40 106.03 1d5v s VAL 3 Ca 0.17 -2.11 -0.21 0.00 -1.81 0.00 0.00 61.98 58.03 1d5v s VAL 3 Cb -0.12 -1.91 -0.07 0.00 0.56 0.00 0.00 36.38 34.84 1d5v s VAL 3 CO 0.07 -0.70 1.11 -0.54 -0.31 0.00 0.00 175.10 174.73 1d5v s LYS 4 N -3.72 3.58 0.22 4.82 1.02 -1.26 -4.99 119.74 119.41 1d5v s LYS 4 Ca 0.19 1.58 -0.30 0.00 0.02 0.00 0.00 55.97 57.46 1d5v s LYS 4 Cb 0.02 -2.13 -0.08 0.00 -0.52 0.00 0.00 37.83 35.11 1d5v s LYS 4 CO 0.02 -0.66 1.00 -1.25 -0.92 0.00 0.00 175.35 173.55 1d5v s PRO 5 N -3.11 4.75 0.62 -1.68 0.04 -1.26 -4.90 135.00 129.45 1d5v s PRO 5 Ca 0.69 1.58 0.17 0.00 0.04 0.00 0.00 61.00 63.48 1d5v s PRO 5 Cb -0.23 -3.28 0.58 0.00 0.04 0.00 0.00 34.50 31.61 1d5v s PRO 5 CO 0.27 0.34 1.18 -2.30 0.04 0.00 0.00 177.00 176.53 1d5v n PRO 6 N 1.78 0.02 -1.76 0.56 -0.02 -1.26 -4.57 135.00 129.75 1d5v n PRO 6 Ca -0.00 0.99 -0.41 0.00 -2.02 0.00 0.00 63.50 62.05 1d5v n PRO 6 Cb 0.47 -2.53 -0.01 0.00 -0.02 0.00 0.00 33.50 31.41 1d5v n PRO 6 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1d5v n TYR 7 N -2.96 2.96 -2.09 6.00 4.01 -1.26 -4.99 117.16 118.84 1d5v n TYR 7 Ca 0.15 0.34 -0.28 0.00 -0.16 0.00 0.00 57.90 57.95 1d5v n TYR 7 Cb 1.34 -2.57 0.12 0.00 -0.31 0.00 0.00 39.34 37.91 1d5v n TYR 7 CO 0.00 0.00 0.00 -1.54 -0.46 0.00 0.00 176.86 174.86 1d5v s SER 8 N 0.21 4.08 0.27 7.72 1.04 -1.26 -4.82 113.70 120.94 1d5v s SER 8 Ca 0.59 0.36 -0.03 0.00 0.48 0.00 0.00 55.95 57.35 1d5v s SER 8 Cb -0.48 -0.72 0.35 0.00 0.10 0.00 0.00 66.02 65.27 1d5v s SER 8 CO 0.56 -2.10 1.84 1.88 0.98 0.00 0.00 173.24 176.39 1d5v h TYR 9 N -1.06 0.98 -0.43 5.02 0.05 -1.96 -1.19 116.97 118.37 1d5v h TYR 9 Ca -0.44 -0.06 -0.12 0.00 0.05 0.00 0.00 58.73 58.16 1d5v h TYR 9 Cb 1.28 -0.30 -0.01 0.00 1.01 0.00 0.00 36.73 38.72 1d5v h TYR 9 CO -0.26 0.76 -0.19 0.82 -1.05 0.00 0.00 178.16 178.23 1d5v h ILE 10 N 0.95 1.28 -0.52 -2.88 1.08 -2.00 -2.90 117.51 112.51 1d5v h ILE 10 Ca 0.22 -1.33 -0.11 0.00 -0.39 0.00 0.00 64.86 63.24 1d5v h ILE 10 Cb 0.20 1.23 -0.02 0.00 -3.07 0.00 0.00 36.82 35.16 1d5v h ILE 10 CO -0.02 0.45 -0.13 0.00 -0.69 0.00 0.00 178.15 177.77 1d5v h ALA 11 N 0.83 0.79 -0.99 1.87 0.00 -1.83 -1.69 119.26 118.25 1d5v h ALA 11 Ca 0.10 -0.35 0.01 0.00 0.00 0.00 0.00 54.91 54.66 1d5v h ALA 11 Cb 0.75 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 18.30 1d5v h ALA 11 CO 0.06 0.66 0.65 -0.07 0.00 0.00 0.00 179.25 180.55 1d5v h LEU 12 N 0.88 1.14 -0.28 0.00 3.38 -1.18 0.14 115.31 119.39 1d5v h LEU 12 Ca 0.13 -0.03 -0.05 0.00 0.09 0.00 0.00 57.88 58.02 1d5v h LEU 12 Cb 0.68 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 41.14 1d5v h LEU 12 CO 0.05 0.83 -0.01 0.40 0.09 0.00 0.00 178.44 179.80 1d5v h ILE 13 N 1.34 1.26 -0.59 1.22 2.04 -1.29 -1.63 117.51 119.87 1d5v h ILE 13 Ca 0.36 -0.96 -0.03 0.00 1.00 0.00 0.00 64.86 65.24 1d5v h ILE 13 Cb -0.14 1.33 -0.03 0.00 -0.74 0.00 0.00 36.82 37.24 1d5v h ILE 13 CO -0.08 0.30 0.25 0.74 0.00 0.00 0.00 178.15 179.37 1d5v h THR 14 N 0.28 1.22 -0.37 -0.27 2.02 -0.55 -2.95 112.91 112.29 1d5v h THR 14 Ca 0.08 -0.66 -0.16 0.00 0.77 0.00 0.00 66.41 66.43 1d5v h THR 14 Cb 0.45 0.56 -0.00 0.00 -1.74 0.00 0.00 68.15 67.42 1d5v h THR 14 CO 0.02 0.26 -0.41 0.24 0.37 0.00 0.00 175.52 176.00 1d5v h MET 15 N 0.80 0.94 -0.76 6.66 2.86 -0.70 -3.05 114.93 121.67 1d5v h MET 15 Ca 0.20 -0.51 0.10 0.00 -2.06 0.00 0.00 59.70 57.43 1d5v h MET 15 Cb 0.17 0.03 -0.07 0.00 0.06 0.00 0.00 31.60 31.78 1d5v h MET 15 CO -0.02 1.16 0.40 0.00 1.06 0.00 0.00 176.91 179.52 1d5v h ALA 16 N 0.76 1.08 -0.41 6.32 0.00 -1.17 0.38 119.26 126.21 1d5v h ALA 16 Ca 0.05 0.05 0.01 0.00 0.00 0.00 0.00 54.91 55.02 1d5v h ALA 16 Cb 1.01 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.70 1d5v h ALA 16 CO 0.10 0.00 0.27 0.82 0.00 0.00 0.00 179.25 180.44 1d5v h ILE 17 N 0.67 1.10 -0.50 0.00 2.04 -1.46 0.22 117.51 119.58 1d5v h ILE 17 Ca 0.38 -0.19 0.00 0.00 1.00 0.00 0.00 64.86 66.05 1d5v h ILE 17 Cb 0.39 0.50 -0.02 0.00 -0.74 0.00 0.00 36.82 36.94 1d5v h ILE 17 CO -0.27 0.10 0.33 1.56 0.00 0.00 0.00 178.15 179.87 1d5v h GLN 18 N 0.55 0.66 -0.61 2.37 4.20 -1.02 -1.72 115.11 119.54 1d5v h GLN 18 Ca 0.15 -0.04 0.00 0.00 0.06 0.00 0.00 58.65 58.82 1d5v h GLN 18 Cb -0.06 -0.15 0.00 0.00 0.30 0.00 0.00 27.48 27.57 1d5v h GLN 18 CO -0.04 0.43 0.00 0.27 -0.67 0.00 0.00 178.83 178.83 1d5v n ASN 19 N -4.74 3.00 -4.71 1.46 0.23 -0.03 -4.89 115.26 105.59 1d5v n ASN 19 Ca 0.02 -2.28 -0.42 0.00 -0.53 0.00 0.00 54.58 51.37 1d5v n ASN 19 Cb 0.02 -0.46 -0.03 0.00 -2.08 0.00 0.00 39.78 37.23 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 -1.74 3.25 0.40 -2.53 0.00 0.74 -4.89 121.76 116.99 1d5v s ALA 20 Ca 0.29 0.61 0.26 0.00 0.00 0.00 0.00 51.96 53.12 1d5v s ALA 20 Cb 0.19 -3.38 1.40 0.00 0.00 0.00 0.00 23.12 21.33 1d5v s ALA 20 CO 0.13 -0.33 1.59 -1.35 0.00 0.00 0.00 175.76 175.81 1d5v h PRO 21 N 6.85 0.03 -6.04 0.00 0.11 -1.88 -3.38 132.00 127.69 1d5v h PRO 21 Ca -0.40 -0.00 -0.54 0.00 0.11 0.00 0.00 66.00 65.17 1d5v h PRO 21 Cb 1.21 -0.01 -0.19 0.00 0.11 0.00 0.00 31.00 32.13 1d5v h PRO 21 CO 0.78 0.02 -0.79 -1.21 -0.21 0.00 0.00 178.00 176.59 1d5v s GLU 22 N -5.41 1.27 0.25 1.05 8.01 -1.26 -5.03 118.70 117.58 1d5v s GLU 22 Ca -0.08 -1.38 -0.06 0.00 0.01 0.00 0.00 54.97 53.46 1d5v s GLU 22 Cb 0.32 -1.39 0.26 0.00 -4.31 0.00 0.00 34.13 29.01 1d5v s GLU 22 CO 0.80 0.29 1.93 -0.22 0.01 0.00 0.00 175.26 178.07 1d5v h LYS 23 N 3.38 1.33 -5.66 1.61 1.63 -1.85 -3.39 116.57 113.62 1d5v h LYS 23 Ca -0.43 -0.08 -0.59 0.00 -0.85 0.00 0.00 60.65 58.70 1d5v h LYS 23 Cb 1.20 -0.30 -0.09 0.00 -0.60 0.00 0.00 32.23 32.44 1d5v h LYS 23 CO 0.49 0.88 -0.01 0.15 -3.45 0.00 0.00 179.45 177.51 1d5v s LYS 24 N -6.12 4.25 0.12 1.90 1.02 -1.26 -4.81 119.74 114.85 1d5v s LYS 24 Ca -0.13 0.51 0.04 0.00 0.02 0.00 0.00 55.97 56.41 1d5v s LYS 24 Cb 0.18 -3.53 -0.04 0.00 -0.52 0.00 0.00 37.83 33.92 1d5v s LYS 24 CO 0.82 -0.08 -0.10 -1.50 -0.92 0.00 0.00 175.35 173.57 1d5v s ILE 25 N 1.40 1.04 0.56 2.17 2.07 -1.24 -4.94 121.20 122.26 1d5v s ILE 25 Ca 0.27 -1.89 -0.11 0.00 -1.41 0.00 0.00 60.65 57.51 1d5v s ILE 25 Cb -0.16 -1.65 -0.05 0.00 0.13 0.00 0.00 42.46 40.74 1d5v s ILE 25 CO 0.11 -0.68 0.95 0.42 -1.91 0.00 0.00 174.94 173.83 1d5v s THR 26 N -3.01 4.72 0.11 4.00 -4.23 -1.26 -2.01 115.64 113.96 1d5v s THR 26 Ca 0.12 0.79 -0.21 0.00 -1.18 0.00 0.00 61.69 61.21 1d5v s THR 26 Cb 0.01 -3.83 -0.11 0.00 1.34 0.00 0.00 72.50 69.91 1d5v s THR 26 CO -0.00 -0.95 1.76 0.25 -0.54 0.00 0.00 174.62 175.13 1d5v h LEU 27 N 0.15 0.11 -1.05 4.79 5.85 -1.89 -2.25 115.31 121.03 1d5v h LEU 27 Ca -0.45 -0.00 0.01 0.00 0.84 0.00 0.00 57.88 58.27 1d5v h LEU 27 Cb 1.19 -0.03 -0.05 0.00 0.37 0.00 0.00 40.66 42.15 1d5v h LEU 27 CO 0.62 0.08 0.64 0.78 -0.34 0.00 0.00 178.44 180.22 1d5v h ASN 28 N 0.14 1.11 -0.99 1.25 2.35 -1.93 -2.52 115.58 114.97 1d5v h ASN 28 Ca 0.04 -0.03 0.02 0.00 -0.55 0.00 0.00 56.30 55.78 1d5v h ASN 28 Cb -0.01 -0.28 -0.05 0.00 0.05 0.00 0.00 38.32 38.03 1d5v h ASN 28 CO -0.01 0.80 0.66 1.23 -1.65 0.00 0.00 177.43 178.46 1d5v h GLY 29 N 1.31 1.41 1.01 2.83 0.00 -1.80 -2.36 103.07 105.48 1d5v h GLY 29 Ca 0.36 -0.51 -0.00 0.00 0.00 0.00 0.00 47.33 47.17 1d5v h GLY 29 CO -0.08 0.48 0.45 -2.22 0.00 0.00 0.00 176.54 175.17 1d5v h ILE 30 N 1.32 1.20 -0.86 2.60 2.04 -1.00 -2.60 117.51 120.21 1d5v h ILE 30 Ca 0.37 -0.44 -0.01 0.00 1.00 0.00 0.00 64.86 65.79 1d5v h ILE 30 Cb -0.11 0.18 -0.04 0.00 -0.74 0.00 0.00 36.82 36.11 1d5v h ILE 30 CO -0.09 0.21 0.52 1.88 0.00 0.00 0.00 178.15 180.66 1d5v h TYR 31 N 0.99 1.14 -1.00 1.37 0.05 -1.38 -2.39 116.97 115.75 1d5v h TYR 31 Ca 0.26 -0.01 0.01 0.00 0.05 0.00 0.00 58.73 59.05 1d5v h TYR 31 Cb -0.05 -0.37 -0.05 0.00 1.01 0.00 0.00 36.73 37.27 1d5v h TYR 31 CO -0.01 0.76 0.67 1.96 -1.05 0.00 0.00 178.16 180.48 1d5v h GLN 32 N 1.19 1.32 -0.23 4.88 1.08 -1.19 -1.83 115.11 120.33 1d5v h GLN 32 Ca 0.31 -0.08 0.00 0.00 -1.45 0.00 0.00 58.65 57.43 1d5v h GLN 32 Cb -0.04 -0.30 -0.01 0.00 -0.05 0.00 0.00 27.48 27.08 1d5v h GLN 32 CO -0.06 0.87 0.15 0.35 -0.95 0.00 0.00 178.83 179.19 1d5v h PHE 33 N 1.36 0.28 0.01 2.96 3.57 -1.23 0.71 116.94 124.60 1d5v h PHE 33 Ca 0.37 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.88 1d5v h PHE 33 Cb -0.16 -0.09 -0.00 0.00 2.79 0.00 0.00 35.95 38.49 1d5v h PHE 33 CO -0.00 0.17 -0.00 0.82 -2.23 0.00 0.00 178.31 177.07 1d5v h ILE 34 N 0.30 0.99 -0.76 1.41 2.04 -1.21 0.92 117.51 121.20 1d5v h ILE 34 Ca 0.08 0.00 -0.06 0.00 1.00 0.00 0.00 64.86 65.89 1d5v h ILE 34 Cb -0.03 0.99 -0.03 0.00 -0.74 0.00 0.00 36.82 37.01 1d5v h ILE 34 CO -0.02 0.00 0.25 0.24 0.00 0.00 0.00 178.15 178.62 1d5v h MET 35 N -0.01 1.17 -0.62 2.37 2.86 -1.18 -0.01 114.93 119.51 1d5v h MET 35 Ca -0.00 -0.24 -0.10 0.00 -2.06 0.00 0.00 59.70 57.30 1d5v h MET 35 Cb 0.01 -0.17 -0.02 0.00 0.06 0.00 0.00 31.60 31.47 1d5v h MET 35 CO -0.00 0.98 0.01 -0.44 1.06 0.00 0.00 176.91 178.52 1d5v h ASP 36 N 1.12 1.06 0.22 1.22 3.32 -0.58 -3.23 116.42 119.56 1d5v h ASP 36 Ca 0.25 -0.30 -0.01 0.00 0.02 0.00 0.00 57.03 56.98 1d5v h ASP 36 Cb 0.29 -0.28 0.00 0.00 0.22 0.00 0.00 39.33 39.56 1d5v h ASP 36 CO -0.01 1.10 -0.11 -0.09 -1.72 0.00 0.00 179.24 178.41 1d5v h ARG 37 N 0.98 -0.29 -5.10 3.56 2.43 -0.49 -3.43 114.38 112.04 1d5v h ARG 37 Ca 0.18 0.02 -0.65 0.00 -0.81 0.00 0.00 59.98 58.71 1d5v h ARG 37 Cb 0.55 0.07 -0.25 0.00 -0.42 0.00 0.00 29.97 29.91 1d5v h ARG 37 CO 0.03 0.08 -0.70 -0.06 -1.51 0.00 0.00 179.97 177.81 1d5v s PHE 38 N -4.21 2.97 -1.37 2.20 0.08 -0.05 -4.98 117.98 112.63 1d5v s PHE 38 Ca -0.14 -0.68 0.27 0.00 0.12 0.00 0.00 56.93 56.50 1d5v s PHE 38 Cb 0.02 -2.06 1.32 0.00 -0.57 0.00 0.00 43.02 41.73 1d5v s PHE 38 CO 0.53 -0.36 1.91 -0.35 -0.10 0.00 0.00 175.22 176.85 1d5v n PRO 39 N 4.36 0.33 -0.19 0.24 -0.04 -1.25 -3.58 135.00 134.86 1d5v n PRO 39 Ca -0.18 0.03 -0.07 0.00 -0.04 0.00 0.00 63.50 63.25 1d5v n PRO 39 Cb 0.52 -1.50 0.03 0.00 -0.04 0.00 0.00 33.50 32.50 1d5v n PRO 39 CO 0.00 0.00 0.00 0.35 -0.04 0.00 0.00 175.50 175.81 1d5v h PHE 40 N 0.00 0.69 0.00 0.54 3.57 -1.93 -2.17 116.94 117.64 1d5v h PHE 40 Ca 0.00 0.02 -0.08 0.00 3.53 0.00 0.00 57.97 61.44 1d5v h PHE 40 Cb 0.28 -0.23 -0.01 0.00 2.79 0.00 0.00 35.95 38.78 1d5v h PHE 40 CO 0.00 0.44 -0.36 1.88 -2.23 0.00 0.00 178.31 178.03 1d5v h TYR 41 N 0.74 0.00 -0.99 0.41 0.05 -1.83 -2.91 116.97 112.44 1d5v h TYR 41 Ca 0.20 0.00 0.01 0.00 0.05 0.00 0.00 58.73 58.99 1d5v h TYR 41 Cb -0.08 0.00 -0.05 0.00 1.01 0.00 0.00 36.73 37.61 1d5v h TYR 41 CO -0.04 0.36 0.65 0.00 -1.05 0.00 0.00 178.16 178.09 1d5v h ARG 42 N 0.00 1.30 0.00 4.88 3.08 -1.57 0.25 114.38 122.31 1d5v h ARG 42 Ca -0.00 -0.08 0.00 0.00 0.07 0.00 0.00 59.98 59.97 1d5v h ARG 42 Cb 0.78 -0.29 0.00 0.00 0.08 0.00 0.00 29.97 30.54 1d5v h ARG 42 CO 0.05 0.86 0.00 0.39 -1.07 0.00 0.00 179.97 180.20 1d5v n GLU 43 N -4.38 0.56 -3.45 0.04 1.02 -1.10 -4.34 120.64 108.99 1d5v n GLU 43 Ca 0.12 0.03 -0.22 0.00 -0.02 0.00 0.00 57.16 57.07 1d5v n GLU 43 Cb 0.01 -1.50 -0.11 0.00 -0.02 0.00 0.00 31.44 29.82 1d5v n GLU 43 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 1d5v s ASN 44 N -2.27 2.32 -0.19 1.62 3.84 0.86 -5.00 114.94 116.13 1d5v s ASN 44 Ca 0.30 -1.09 0.12 0.00 0.21 0.00 0.00 52.86 52.40 1d5v s ASN 44 Cb 0.16 0.18 -0.23 0.00 -0.55 0.00 0.00 41.25 40.81 1d5v s ASN 44 CO 0.32 -0.39 0.10 0.29 -2.79 0.00 0.00 177.10 174.63 1d5v n LYS 45 N 5.12 0.68 -3.21 0.43 5.02 -1.21 -4.67 118.16 120.31 1d5v n LYS 45 Ca -0.01 0.09 -0.37 0.00 -2.02 0.00 0.00 58.31 56.00 1d5v n LYS 45 Cb 0.44 -1.57 -0.06 0.00 -0.02 0.00 0.00 35.03 33.82 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 -2.52 4.18 0.00 1.97 -0.21 -1.26 -3.50 119.66 118.32 1d5v s GLN 46 Ca -0.16 0.75 0.00 0.00 0.02 0.00 0.00 55.36 55.97 1d5v s GLN 46 Cb 0.07 -3.02 0.00 0.00 1.00 0.00 0.00 33.01 31.06 1d5v s GLN 46 CO 0.77 0.50 0.00 0.41 -2.12 0.00 0.00 175.29 174.85 1d5v n GLY 47 N 1.07 1.94 0.26 3.09 0.00 -1.26 -4.69 105.19 105.61 1d5v n GLY 47 Ca -0.06 -0.65 -0.13 0.00 0.00 0.00 0.00 46.02 45.19 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 1.06 0.01 1.61 5.08 -1.87 -1.69 115.95 120.15 1d5v h TRP 48 Ca 0.00 -0.33 -0.00 0.00 1.08 0.00 0.00 58.89 59.64 1d5v h TRP 48 Cb 0.00 -0.22 0.00 0.00 -3.00 0.00 0.00 29.16 25.94 1d5v h TRP 48 CO 0.00 1.14 -0.00 0.37 -1.28 0.00 0.00 178.44 178.67 1d5v h GLN 49 N 0.71 -0.01 -0.03 0.12 4.15 -1.83 -2.47 115.11 115.75 1d5v h GLN 49 Ca 0.05 0.00 -0.16 0.00 0.77 0.00 0.00 58.65 59.32 1d5v h GLN 49 Cb 1.00 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.67 1d5v h GLN 49 CO 0.10 -0.01 -0.69 -0.91 -1.93 0.00 0.00 178.83 175.39 1d5v h ASN 50 N -0.01 0.16 -0.99 -0.69 -0.26 -1.82 -3.14 115.58 108.84 1d5v h ASN 50 Ca -0.00 -0.11 0.01 0.00 -0.56 0.00 0.00 56.30 55.64 1d5v h ASN 50 Cb 0.01 -0.05 -0.05 0.00 -1.06 0.00 0.00 38.32 37.17 1d5v h ASN 50 CO 0.00 0.80 0.66 0.28 -1.06 0.00 0.00 177.43 178.11 1d5v h SER 51 N 0.09 1.13 -0.24 5.81 0.02 -1.05 0.49 113.55 119.80 1d5v h SER 51 Ca -0.01 -0.03 -0.10 0.00 -0.84 0.00 0.00 61.79 60.80 1d5v h SER 51 Cb 1.23 -0.28 -0.00 0.00 0.14 0.00 0.00 62.40 63.49 1d5v h SER 51 CO 0.10 0.82 -0.25 0.40 -1.14 0.00 0.00 176.83 176.76 1d5v h ILE 52 N 1.34 1.32 -0.29 3.27 2.04 -1.44 0.19 117.51 123.94 1d5v h ILE 52 Ca 0.36 -1.42 0.00 0.00 1.00 0.00 0.00 64.86 64.80 1d5v h ILE 52 Cb -0.15 1.68 -0.01 0.00 -0.74 0.00 0.00 36.82 37.60 1d5v h ILE 52 CO -0.08 0.44 0.19 0.03 0.00 0.00 0.00 178.15 178.73 1d5v h ARG 53 N 0.31 0.38 -0.96 2.37 3.08 -1.41 0.34 114.38 118.49 1d5v h ARG 53 Ca 0.04 -0.02 -0.00 0.00 0.07 0.00 0.00 59.98 60.06 1d5v h ARG 53 Cb 0.81 -0.08 -0.05 0.00 0.08 0.00 0.00 29.97 30.73 1d5v h ARG 53 CO 0.06 0.25 0.58 1.25 -1.07 0.00 0.00 179.97 181.04 1d5v h HIS 54 N 0.39 1.26 -0.75 3.04 2.76 -0.85 -1.53 115.15 119.46 1d5v h HIS 54 Ca 0.10 -0.00 -0.06 0.00 -2.20 0.00 0.00 60.37 58.21 1d5v h HIS 54 Cb -0.04 -0.41 -0.03 0.00 1.55 0.00 0.00 27.41 28.47 1d5v h HIS 54 CO -0.06 0.83 0.23 -0.91 -1.30 0.00 0.00 177.93 176.72 1d5v h ASN 55 N 1.32 1.09 -0.42 3.26 2.35 -0.01 -2.28 115.58 120.89 1d5v h ASN 55 Ca 0.34 -0.21 0.00 0.00 -0.55 0.00 0.00 56.30 55.89 1d5v h ASN 55 Cb -0.07 -0.29 -0.02 0.00 0.05 0.00 0.00 38.32 38.00 1d5v h ASN 55 CO -0.07 1.01 0.28 -0.07 -1.65 0.00 0.00 177.43 176.94 1d5v h LEU 56 N 1.12 0.48 -0.65 1.61 3.38 0.61 0.78 115.31 122.64 1d5v h LEU 56 Ca 0.24 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.17 1d5v h LEU 56 Cb 0.32 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.92 1d5v h LEU 56 CO -0.01 0.35 0.31 0.28 0.09 0.00 0.00 178.44 179.46 1d5v h SER 57 N 0.57 0.85 -0.13 -0.43 0.02 -1.15 -2.58 113.55 110.69 1d5v h SER 57 Ca 0.15 -0.13 -0.15 0.00 -0.84 0.00 0.00 61.79 60.82 1d5v h SER 57 Cb -0.07 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.25 1d5v h SER 57 CO -0.03 0.74 -0.44 -0.07 -1.14 0.00 0.00 176.83 175.89 1d5v h LEU 58 N 0.90 0.73 -9.15 5.07 3.38 -0.92 -3.42 115.31 111.90 1d5v h LEU 58 Ca 0.22 -0.34 -0.56 0.00 0.09 0.00 0.00 57.88 57.29 1d5v h LEU 58 Cb 0.12 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 1d5v h LEU 58 CO -0.03 1.06 1.08 0.20 0.09 0.00 0.00 178.44 180.85 1d5v s ASN 59 N -6.87 6.58 0.02 -0.43 0.02 0.27 -4.84 114.94 109.68 1d5v s ASN 59 Ca -0.08 1.90 0.25 0.00 -1.02 0.00 0.00 52.86 53.90 1d5v s ASN 59 Cb 0.12 -2.53 0.41 0.00 0.02 0.00 0.00 41.25 39.26 1d5v s ASN 59 CO 0.85 -1.05 1.34 -0.62 0.02 0.00 0.00 177.10 177.64 1d5v n GLU 60 N 7.29 0.06 -0.38 -0.60 1.02 -1.26 -4.05 120.64 122.72 1d5v n GLU 60 Ca 0.17 0.01 -0.02 0.00 -0.02 0.00 0.00 57.16 57.31 1d5v n GLU 60 Cb 0.44 -1.53 0.11 0.00 -0.02 0.00 0.00 31.44 30.44 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 -6.12 3.53 -0.19 0.00 0.08 -1.26 -4.10 117.98 109.93 1d5v s PHE 62 Ca -0.13 1.72 -0.04 0.00 0.12 0.00 0.00 56.93 58.60 1d5v s PHE 62 Cb 0.18 -2.92 -0.02 0.00 -0.57 0.00 0.00 43.02 39.69 1d5v s PHE 62 CO 0.82 0.03 -0.03 0.08 -0.10 0.00 0.00 175.22 176.01 1d5v s VAL 63 N -1.79 3.72 0.16 -0.44 1.01 -1.23 -5.00 120.40 116.82 1d5v s VAL 63 Ca 0.54 -0.40 -0.30 0.00 0.00 0.00 0.00 61.98 61.83 1d5v s VAL 63 Cb -0.16 -2.66 -0.07 0.00 0.00 0.00 0.00 36.38 33.49 1d5v s VAL 63 CO 0.21 0.45 1.04 -0.54 0.00 0.00 0.00 175.10 176.26 1d5v s LYS 64 N 0.90 4.65 -0.01 2.72 -0.14 -1.26 -3.60 119.74 123.00 1d5v s LYS 64 Ca -0.00 1.61 0.02 0.00 -1.36 0.00 0.00 55.97 56.24 1d5v s LYS 64 Cb -0.14 -3.31 -0.00 0.00 -1.68 0.00 0.00 37.83 32.69 1d5v s LYS 64 CO 0.01 0.15 -0.07 0.14 -0.76 0.00 0.00 175.35 174.82 1d5v s VAL 65 N -0.20 0.57 0.00 3.17 -7.23 -1.01 -5.03 120.40 110.68 1d5v s VAL 65 Ca 0.48 -0.29 0.00 0.00 -1.81 0.00 0.00 61.98 60.36 1d5v s VAL 65 Cb -0.27 -0.49 0.00 0.00 0.56 0.00 0.00 36.38 36.18 1d5v s VAL 65 CO 0.33 0.17 0.00 -0.81 -0.31 0.00 0.00 175.10 174.47 1d5v n PRO 66 N 3.01 1.81 -4.18 4.82 -0.04 -1.26 -1.12 135.00 138.05 1d5v n PRO 66 Ca -0.14 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.20 1d5v n PRO 66 Cb 0.57 0.00 -0.10 0.00 -0.04 0.00 0.00 33.50 33.93 1d5v n PRO 66 CO 0.00 0.00 0.00 -0.98 -0.04 0.00 0.00 175.50 174.48 1d5v s ARG 67 N 0.00 1.20 0.53 0.54 1.70 -1.26 -4.24 118.95 117.41 1d5v s ARG 67 Ca 0.00 -1.58 -0.23 0.00 -0.47 0.00 0.00 55.73 53.45 1d5v s ARG 67 Cb 0.00 0.28 -0.06 0.00 -0.57 0.00 0.00 34.95 34.61 1d5v s ARG 67 CO 0.00 -0.39 1.39 -0.51 -1.08 0.00 0.00 175.30 174.71 1d5v s ASP 68 N -3.14 5.36 0.55 -2.89 1.01 -1.26 -4.87 116.67 111.43 1d5v s ASP 68 Ca 0.36 2.84 0.34 0.00 0.71 0.00 0.00 52.55 56.80 1d5v s ASP 68 Cb 0.07 -2.64 1.38 0.00 1.01 0.00 0.00 42.92 42.73 1d5v s ASP 68 CO 0.11 -1.52 1.99 0.44 0.21 0.00 0.00 175.17 176.39 1d5v h ASP 69 N 1.63 0.00 0.52 0.27 3.32 -2.03 -2.49 116.42 117.64 1d5v h ASP 69 Ca -0.51 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.54 1d5v h ASP 69 Cb 1.29 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.84 1d5v h ASP 69 CO 0.58 0.00 0.00 0.29 -1.72 0.00 0.00 179.24 178.39 1d5v n LYS 70 N -3.07 0.04 -3.48 3.56 5.02 -1.26 -3.93 118.16 115.04 1d5v n LYS 70 Ca 0.01 0.21 -0.27 0.00 -2.02 0.00 0.00 58.31 56.24 1d5v n LYS 70 Cb 0.30 -1.50 -0.09 0.00 -0.02 0.00 0.00 35.03 33.72 1d5v n LYS 70 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1d5v n LYS 71 N -1.47 1.30 -2.31 1.97 5.02 -0.94 -5.11 118.16 116.63 1d5v n LYS 71 Ca 0.05 -3.88 -0.27 0.00 -2.02 0.00 0.00 58.31 52.19 1d5v n LYS 71 Cb 0.18 -1.86 0.16 0.00 -0.02 0.00 0.00 35.03 33.49 1d5v n LYS 71 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1d5v s PRO 72 N -1.24 1.00 0.00 1.97 0.04 -1.25 -4.46 135.00 131.07 1d5v s PRO 72 Ca 0.33 -0.91 0.00 0.00 0.04 0.00 0.00 61.00 60.46 1d5v s PRO 72 Cb 0.08 -2.10 0.00 0.00 0.04 0.00 0.00 34.50 32.52 1d5v s PRO 72 CO -0.13 -2.03 0.00 0.41 0.04 0.00 0.00 177.00 175.30 1d5v n GLY 73 N -3.33 0.47 3.41 0.56 0.00 -1.26 -5.03 105.19 100.01 1d5v n GLY 73 Ca 0.17 -0.30 -0.23 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.54 1.50 0.93 1.61 1.02 -1.26 -5.14 119.74 117.86 1d5v s LYS 74 Ca 0.00 -1.61 -0.16 0.00 0.02 0.00 0.00 55.97 54.23 1d5v s LYS 74 Cb 0.00 -1.60 0.23 0.00 -0.52 0.00 0.00 37.83 35.94 1d5v s LYS 74 CO 0.00 0.31 0.99 0.41 -0.92 0.00 0.00 175.35 176.14 1d5v n GLY 75 N -0.17 -2.19 3.77 -3.33 0.00 -1.26 -5.00 105.19 97.01 1d5v n GLY 75 Ca -0.09 -1.58 -0.38 0.00 0.00 0.00 0.00 46.02 43.98 1d5v n GLY 75 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1d5v s SER 76 N -4.39 7.42 0.61 1.61 0.15 -1.26 -4.87 113.70 112.97 1d5v s SER 76 Ca 0.60 1.87 -0.11 0.00 0.70 0.00 0.00 55.95 59.00 1d5v s SER 76 Cb -0.04 -2.59 -0.04 0.00 -1.71 0.00 0.00 66.02 61.64 1d5v s SER 76 CO 0.45 -0.01 1.03 -0.31 1.20 0.00 0.00 173.24 175.59 1d5v s TYR 77 N -1.50 3.62 0.07 3.44 1.51 -0.27 -3.38 117.35 120.84 1d5v s TYR 77 Ca 0.48 1.30 0.04 0.00 -1.01 0.00 0.00 57.07 57.88 1d5v s TYR 77 Cb -0.20 -2.73 -0.03 0.00 -0.11 0.00 0.00 41.96 38.89 1d5v s TYR 77 CO 0.26 -0.67 -0.12 -1.58 -1.11 0.00 0.00 175.55 172.33 1d5v s TRP 78 N -3.15 1.09 0.24 2.71 0.52 -0.85 -2.40 118.94 117.10 1d5v s TRP 78 Ca 0.55 -0.52 -0.11 0.00 0.02 0.00 0.00 56.10 56.04 1d5v s TRP 78 Cb -0.11 -0.61 -0.01 0.00 -1.15 0.00 0.00 33.47 31.59 1d5v s TRP 78 CO 0.53 0.02 0.42 -0.08 0.02 0.00 0.00 176.95 177.86 1d5v s THR 79 N -1.62 0.00 0.67 2.01 -1.32 -1.24 -3.71 115.64 110.44 1d5v s THR 79 Ca -0.01 -1.50 -0.11 0.00 -1.21 0.00 0.00 61.69 58.86 1d5v s THR 79 Cb -0.08 -2.25 -0.01 0.00 -1.51 0.00 0.00 72.50 68.65 1d5v s THR 79 CO 0.01 -0.00 1.06 -0.76 -2.21 0.00 0.00 174.62 172.72 1d5v s LEU 80 N -3.04 3.08 0.99 9.08 1.43 -1.26 -3.55 118.68 125.40 1d5v s LEU 80 Ca 0.25 1.39 -0.12 0.00 -1.03 0.00 0.00 54.13 54.62 1d5v s LEU 80 Cb 0.01 -4.30 0.18 0.00 0.03 0.00 0.00 46.19 42.10 1d5v s LEU 80 CO 0.09 -1.20 1.08 1.51 0.23 0.00 0.00 176.35 178.06 1d5v s ASP 81 N -4.11 2.63 0.00 2.29 1.47 -1.26 -4.72 116.67 112.98 1d5v s ASP 81 Ca 0.57 1.45 0.00 0.00 1.18 0.00 0.00 52.55 55.75 1d5v s ASP 81 Cb -0.12 -2.12 0.00 0.00 -0.34 0.00 0.00 42.92 40.34 1d5v s ASP 81 CO 0.54 -3.16 0.00 -2.65 0.68 0.00 0.00 175.17 170.58 1d5v n PRO 82 N -4.22 2.03 0.00 2.11 -0.02 -1.26 -4.54 135.00 129.10 1d5v n PRO 82 Ca 0.06 0.00 0.09 0.00 -2.02 0.00 0.00 63.50 61.63 1d5v n PRO 82 Cb 0.55 0.00 0.52 0.00 -0.02 0.00 0.00 33.50 34.55 1d5v n PRO 82 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1d5v n ASP 83 N 0.00 0.00 -1.46 2.55 5.75 -1.26 -3.45 116.55 118.68 1d5v n ASP 83 Ca 0.00 -0.48 -0.02 0.00 -0.01 0.00 0.00 54.79 54.27 1d5v n ASP 83 Cb 0.00 -0.03 0.01 0.00 -1.03 0.00 0.00 41.12 40.06 1d5v n ASP 83 CO 0.00 0.00 0.00 -1.20 -0.11 0.00 0.00 177.20 175.89 1d5v n SER 84 N -1.03 4.98 0.09 -1.12 7.64 -1.26 -4.47 113.62 118.44 1d5v n SER 84 Ca 0.13 -2.43 -0.13 0.00 1.01 0.00 0.00 58.87 57.45 1d5v n SER 84 Cb 0.07 -0.99 -0.08 0.00 -1.01 0.00 0.00 64.21 62.21 1d5v n SER 84 CO 0.00 0.00 0.00 0.10 -3.01 0.00 0.00 175.04 172.13 1d5v h TYR 85 N 0.85 -0.15 0.00 1.43 -0.00 -1.82 -3.37 116.97 113.92 1d5v h TYR 85 Ca 0.05 -0.00 -0.02 0.00 -0.00 0.00 0.00 58.73 58.76 1d5v h TYR 85 Cb 1.02 0.05 -0.03 0.00 -0.00 0.00 0.00 36.73 37.77 1d5v h TYR 85 CO 0.28 -0.03 -0.47 0.27 -0.00 0.00 0.00 178.16 178.21 1d5v n ASN 86 N -5.13 0.49 -3.97 0.10 0.23 -1.26 -5.05 115.26 100.67 1d5v n ASN 86 Ca -0.08 -2.21 -0.27 0.00 -0.53 0.00 0.00 54.58 51.49 1d5v n ASN 86 Cb 0.12 -0.25 0.12 0.00 -2.08 0.00 0.00 39.78 37.69 1d5v n ASN 86 CO 0.00 0.00 0.00 1.15 -0.93 0.00 0.00 177.26 177.48 1d5v n MET 87 N -0.20 -1.29 -3.01 -3.83 0.00 -1.26 -4.83 117.12 102.69 1d5v n MET 87 Ca 0.03 -0.37 -0.43 0.00 0.00 0.00 0.00 57.70 56.93 1d5v n MET 87 Cb 0.73 -1.40 -0.05 0.00 0.00 0.00 0.00 33.22 32.49 1d5v n MET 87 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 175.97 175.91 1d5v s PHE 88 N -2.11 2.91 0.14 3.17 0.08 -1.26 -5.00 117.98 115.90 1d5v s PHE 88 Ca 0.41 -0.44 -0.35 0.00 0.12 0.00 0.00 56.93 56.67 1d5v s PHE 88 Cb -0.03 -3.88 -0.15 0.00 -0.57 0.00 0.00 43.02 38.39 1d5v s PHE 88 CO 0.52 -1.26 1.53 -0.85 -0.10 0.00 0.00 175.22 175.05 1d5v n GLU 89 N 6.82 1.91 -0.46 0.44 0.28 -1.26 -4.91 120.64 123.46 1d5v n GLU 89 Ca -0.04 0.69 0.00 0.00 -0.16 0.00 0.00 57.16 57.65 1d5v n GLU 89 Cb 0.46 -2.43 0.00 0.00 1.43 0.00 0.00 31.44 30.90 1d5v n GLU 89 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 177.13 177.24 1d5v n ASN 90 N 3.26 0.00 -0.02 -1.84 6.94 -1.26 -5.04 115.26 117.29 1d5v n ASN 90 Ca 0.17 -0.32 -0.09 0.00 -0.02 0.00 0.00 54.58 54.32 1d5v n ASN 90 Cb 0.26 0.00 -0.03 0.00 -2.36 0.00 0.00 39.78 37.65 1d5v n ASN 90 CO 0.00 0.00 0.00 1.23 -1.03 0.00 0.00 177.26 177.46 1d5v h GLY 91 N 0.00 0.07 -5.59 4.83 0.00 -2.08 -3.42 103.07 96.88 1d5v h GLY 91 Ca 0.00 0.10 0.09 0.00 0.00 0.00 0.00 47.33 47.52 1d5v h GLY 91 CO 0.00 -0.10 -0.20 -1.35 0.00 0.00 0.00 176.54 174.89 1d5v s SER 92 N -5.15 -1.26 0.00 0.19 1.04 -1.26 -5.01 113.70 102.25 1d5v s SER 92 Ca -0.14 1.15 0.00 0.00 0.48 0.00 0.00 55.95 57.44 1d5v s SER 92 Cb 0.10 2.21 0.00 0.00 0.10 0.00 0.00 66.02 68.43 1d5v s SER 92 CO 0.68 -0.24 0.78 0.33 0.98 0.00 0.00 173.24 175.77 1d5v n PHE 93 N 5.43 0.00 0.24 5.02 7.35 -1.26 -5.19 117.46 129.05 1d5v n PHE 93 Ca -0.06 -0.30 0.02 0.00 -0.76 0.00 0.00 57.45 56.35 1d5v n PHE 93 Cb 0.50 -0.03 0.11 0.00 0.35 0.00 0.00 39.48 40.42 1d5v n PHE 93 CO 0.00 0.00 0.00 -0.11 -0.76 0.00 0.00 176.76 175.89