#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 4.48 0.01 4.03 1.43 -1.26 -5.03 118.68 122.34 1d5v s LEU 2 Ca 0.00 2.50 -0.01 0.00 -1.03 0.00 0.00 54.13 55.59 1d5v s LEU 2 Cb 0.00 -3.64 -0.01 0.00 0.03 0.00 0.00 46.19 42.57 1d5v s LEU 2 CO 0.00 -0.36 -0.00 0.68 0.23 0.00 0.00 176.35 176.90 1d5v s VAL 3 N -1.15 0.08 -0.04 -1.59 -7.23 -1.26 -5.09 120.40 104.13 1d5v s VAL 3 Ca 0.47 -0.68 -0.27 0.00 -1.81 0.00 0.00 61.98 59.68 1d5v s VAL 3 Cb -0.36 -0.22 -0.03 0.00 0.56 0.00 0.00 36.38 36.32 1d5v s VAL 3 CO 0.48 -0.38 0.87 -0.75 -0.31 0.00 0.00 175.10 175.01 1d5v s LYS 4 N -1.12 4.50 0.49 4.82 2.20 -1.26 -4.89 119.74 124.47 1d5v s LYS 4 Ca -0.12 1.20 -0.19 0.00 -0.36 0.00 0.00 55.97 56.50 1d5v s LYS 4 Cb -0.08 -3.46 -0.09 0.00 -1.51 0.00 0.00 37.83 32.69 1d5v s LYS 4 CO -0.01 -0.03 0.98 -1.25 -0.36 0.00 0.00 175.35 174.69 1d5v s PRO 5 N 1.02 3.99 0.00 4.03 0.04 -1.26 -4.96 135.00 137.86 1d5v s PRO 5 Ca 0.46 1.08 0.26 0.00 0.04 0.00 0.00 61.00 62.84 1d5v s PRO 5 Cb -0.19 -2.14 1.42 0.00 0.04 0.00 0.00 34.50 33.63 1d5v s PRO 5 CO 0.23 -0.24 1.88 -0.35 0.04 0.00 0.00 177.00 178.55 1d5v n PRO 6 N -1.19 0.61 -2.01 0.56 -0.04 -1.26 -4.86 135.00 126.81 1d5v n PRO 6 Ca 0.07 0.02 -0.39 0.00 -0.04 0.00 0.00 63.50 63.16 1d5v n PRO 6 Cb 0.54 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.50 1d5v n PRO 6 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1d5v s TYR 7 N -2.25 2.71 0.74 0.54 2.02 -1.26 -5.00 117.35 114.85 1d5v s TYR 7 Ca 0.32 1.40 -0.12 0.00 -0.37 0.00 0.00 57.07 58.31 1d5v s TYR 7 Cb 0.17 -3.68 0.03 0.00 -0.40 0.00 0.00 41.96 38.09 1d5v s TYR 7 CO 0.33 -2.23 1.12 0.45 -1.57 0.00 0.00 175.55 173.66 1d5v s SER 8 N -0.82 5.17 0.25 2.29 0.15 -1.26 -4.86 113.70 114.62 1d5v s SER 8 Ca 0.60 1.05 -0.06 0.00 0.70 0.00 0.00 55.95 58.24 1d5v s SER 8 Cb -0.38 -1.76 0.26 0.00 -1.71 0.00 0.00 66.02 62.43 1d5v s SER 8 CO 0.48 -1.51 1.93 1.88 1.20 0.00 0.00 173.24 177.21 1d5v h TYR 9 N -0.78 1.26 -0.49 3.44 0.05 -1.99 -2.07 116.97 116.39 1d5v h TYR 9 Ca -0.45 0.03 -0.13 0.00 0.05 0.00 0.00 58.73 58.23 1d5v h TYR 9 Cb 1.27 -0.43 -0.01 0.00 1.01 0.00 0.00 36.73 38.57 1d5v h TYR 9 CO 0.45 0.79 -0.21 0.82 -1.05 0.00 0.00 178.16 178.96 1d5v h ILE 10 N 1.36 1.27 -0.57 -2.88 2.04 -1.98 -2.80 117.51 113.95 1d5v h ILE 10 Ca 0.37 -1.37 0.02 0.00 1.00 0.00 0.00 64.86 64.87 1d5v h ILE 10 Cb -0.15 1.10 -0.03 0.00 -0.74 0.00 0.00 36.82 37.00 1d5v h ILE 10 CO -0.08 0.48 0.36 0.00 0.00 0.00 0.00 178.15 178.91 1d5v h ALA 11 N 0.87 0.73 -0.49 1.87 0.00 -1.75 0.73 119.26 121.23 1d5v h ALA 11 Ca 0.11 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1d5v h ALA 11 Cb 0.79 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 1d5v h ALA 11 CO 0.07 0.12 0.32 -0.07 0.00 0.00 0.00 179.25 179.68 1d5v h LEU 12 N 0.73 0.56 -0.32 0.00 3.38 -1.35 0.43 115.31 118.73 1d5v h LEU 12 Ca 0.22 -0.02 -0.02 0.00 0.09 0.00 0.00 57.88 58.15 1d5v h LEU 12 Cb -0.04 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 1d5v h LEU 12 CO -0.07 0.41 0.10 0.40 0.09 0.00 0.00 178.44 179.37 1d5v h ILE 13 N 0.66 1.20 -0.77 1.22 2.04 -1.10 -0.01 117.51 120.75 1d5v h ILE 13 Ca 0.18 -0.65 -0.04 0.00 1.00 0.00 0.00 64.86 65.35 1d5v h ILE 13 Cb -0.07 1.03 -0.03 0.00 -0.74 0.00 0.00 36.82 37.00 1d5v h ILE 13 CO -0.04 0.22 0.33 0.74 0.00 0.00 0.00 178.15 179.41 1d5v h THR 14 N 0.36 1.25 -0.34 -0.27 2.02 0.10 -2.28 112.91 113.76 1d5v h THR 14 Ca 0.10 -0.77 -0.16 0.00 0.77 0.00 0.00 66.41 66.36 1d5v h THR 14 Cb 0.24 0.32 -0.01 0.00 -1.74 0.00 0.00 68.15 66.96 1d5v h THR 14 CO -0.00 0.32 -0.42 0.24 0.37 0.00 0.00 175.52 176.02 1d5v h MET 15 N 1.11 0.86 -0.43 6.66 2.86 0.02 -2.92 114.93 123.09 1d5v h MET 15 Ca 0.26 -0.47 0.01 0.00 -2.06 0.00 0.00 59.70 57.45 1d5v h MET 15 Cb 0.18 0.02 -0.03 0.00 0.06 0.00 0.00 31.60 31.84 1d5v h MET 15 CO -0.03 1.11 0.27 0.00 1.06 0.00 0.00 176.91 179.32 1d5v h ALA 16 N 0.82 0.55 -0.01 6.32 0.00 -0.68 0.47 119.26 126.73 1d5v h ALA 16 Ca 0.05 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1d5v h ALA 16 Cb 1.00 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.65 1d5v h ALA 16 CO 0.10 -0.04 0.01 0.82 0.00 0.00 0.00 179.25 180.13 1d5v h ILE 17 N 0.54 1.02 -0.91 0.00 2.04 -1.41 0.17 117.51 118.97 1d5v h ILE 17 Ca 0.17 -0.07 -0.02 0.00 1.00 0.00 0.00 64.86 65.94 1d5v h ILE 17 Cb -0.02 1.05 -0.04 0.00 -0.74 0.00 0.00 36.82 37.07 1d5v h ILE 17 CO -0.06 0.02 0.51 1.56 0.00 0.00 0.00 178.15 180.17 1d5v h GLN 18 N -0.01 1.26 0.00 2.37 1.08 -1.28 -1.29 115.11 117.24 1d5v h GLN 18 Ca 0.00 -0.14 0.00 0.00 -1.45 0.00 0.00 58.65 57.06 1d5v h GLN 18 Cb 0.03 -0.25 0.00 0.00 -0.05 0.00 0.00 27.48 27.21 1d5v h GLN 18 CO -0.00 0.92 0.00 0.09 -0.95 0.00 0.00 178.83 178.89 1d5v n ASN 19 N -4.33 0.00 -4.69 1.46 3.02 0.16 -4.77 115.26 106.10 1d5v n ASN 19 Ca 0.10 -0.06 -0.42 0.00 -0.03 0.00 0.00 54.58 54.17 1d5v n ASN 19 Cb 0.09 -0.30 -0.03 0.00 -0.61 0.00 0.00 39.78 38.93 1d5v n ASN 19 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1d5v s ALA 20 N -2.61 3.39 0.65 5.41 0.00 0.56 -4.86 121.76 124.31 1d5v s ALA 20 Ca 0.25 0.50 0.06 0.00 0.00 0.00 0.00 51.96 52.78 1d5v s ALA 20 Cb 0.18 -3.44 0.26 0.00 0.00 0.00 0.00 23.12 20.13 1d5v s ALA 20 CO 0.43 -0.57 1.12 -1.35 0.00 0.00 0.00 175.76 175.39 1d5v h PRO 21 N 7.12 0.00 -3.99 0.00 0.11 -1.86 -3.35 132.00 130.03 1d5v h PRO 21 Ca -0.34 0.00 -0.25 0.00 0.11 0.00 0.00 66.00 65.51 1d5v h PRO 21 Cb 1.17 0.00 -0.27 0.00 0.11 0.00 0.00 31.00 32.01 1d5v h PRO 21 CO 0.84 0.00 -0.73 -1.83 -0.21 0.00 0.00 178.00 176.07 1d5v s GLU 22 N -4.06 0.20 0.38 1.05 -1.05 -1.26 -5.03 118.70 108.94 1d5v s GLU 22 Ca -0.01 -0.18 0.05 0.00 -0.15 0.00 0.00 54.97 54.68 1d5v s GLU 22 Cb 0.03 -0.13 0.77 0.00 -0.44 0.00 0.00 34.13 34.35 1d5v s GLU 22 CO 0.09 0.03 2.02 0.87 0.95 0.00 0.00 175.26 179.22 1d5v h LYS 23 N 5.81 0.61 -6.19 -4.83 1.79 -1.79 -3.39 116.57 108.57 1d5v h LYS 23 Ca -0.27 -0.05 -0.57 0.00 -2.18 0.00 0.00 60.65 57.58 1d5v h LYS 23 Cb 1.20 -0.13 -0.06 0.00 -1.58 0.00 0.00 32.23 31.67 1d5v h LYS 23 CO 0.49 0.43 0.85 0.15 -1.08 0.00 0.00 179.45 180.29 1d5v s LYS 24 N -5.47 4.16 0.09 3.15 1.02 -1.26 -4.56 119.74 116.87 1d5v s LYS 24 Ca -0.09 1.32 0.02 0.00 0.02 0.00 0.00 55.97 57.24 1d5v s LYS 24 Cb 0.17 -3.72 -0.04 0.00 -0.52 0.00 0.00 37.83 33.72 1d5v s LYS 24 CO 0.74 -0.78 -0.07 -1.50 -0.92 0.00 0.00 175.35 172.83 1d5v s ILE 25 N 3.51 0.69 0.53 2.17 2.07 -1.16 -4.88 121.20 124.13 1d5v s ILE 25 Ca 0.48 -1.82 -0.06 0.00 -1.41 0.00 0.00 60.65 57.84 1d5v s ILE 25 Cb -0.16 -1.54 -0.02 0.00 0.13 0.00 0.00 42.46 40.87 1d5v s ILE 25 CO 0.12 -0.80 0.84 0.42 -1.91 0.00 0.00 174.94 173.61 1d5v s THR 26 N -3.30 4.43 0.08 4.00 -4.23 -1.26 -0.54 115.64 114.81 1d5v s THR 26 Ca 0.09 0.16 -0.24 0.00 -1.18 0.00 0.00 61.69 60.53 1d5v s THR 26 Cb 0.03 -3.71 -0.16 0.00 1.34 0.00 0.00 72.50 70.00 1d5v s THR 26 CO -0.04 -0.72 1.68 0.25 -0.54 0.00 0.00 174.62 175.25 1d5v h LEU 27 N 0.04 -0.03 -1.03 4.79 5.85 -1.95 -2.69 115.31 120.29 1d5v h LEU 27 Ca -0.46 -0.05 0.01 0.00 0.84 0.00 0.00 57.88 58.22 1d5v h LEU 27 Cb 1.22 0.01 -0.05 0.00 0.37 0.00 0.00 40.66 42.21 1d5v h LEU 27 CO 0.61 0.03 0.66 0.78 -0.34 0.00 0.00 178.44 180.19 1d5v h ASN 28 N -0.09 1.14 -1.00 1.25 -0.26 -1.94 -2.42 115.58 112.26 1d5v h ASN 28 Ca -0.00 -0.03 0.07 0.00 -0.56 0.00 0.00 56.30 55.78 1d5v h ASN 28 Cb 0.08 -0.28 -0.07 0.00 -1.06 0.00 0.00 38.32 36.99 1d5v h ASN 28 CO 0.01 0.83 0.65 1.23 -1.06 0.00 0.00 177.43 179.08 1d5v h GLY 29 N 1.35 1.54 1.01 2.83 0.00 -1.87 -1.86 103.07 106.07 1d5v h GLY 29 Ca 0.36 -0.47 -0.00 0.00 0.00 0.00 0.00 47.33 47.22 1d5v h GLY 29 CO -0.08 0.31 0.53 -2.22 0.00 0.00 0.00 176.54 175.09 1d5v h ILE 30 N 1.15 1.24 -0.99 2.60 2.04 -1.22 -2.63 117.51 119.70 1d5v h ILE 30 Ca 0.44 -0.52 0.01 0.00 1.00 0.00 0.00 64.86 65.79 1d5v h ILE 30 Cb 0.21 0.01 -0.05 0.00 -0.74 0.00 0.00 36.82 36.25 1d5v h ILE 30 CO -0.18 0.25 0.65 1.88 0.00 0.00 0.00 178.15 180.75 1d5v h TYR 31 N 1.20 1.25 -0.61 1.37 0.05 -1.32 -2.52 116.97 116.39 1d5v h TYR 31 Ca 0.31 0.03 -0.05 0.00 0.05 0.00 0.00 58.73 59.08 1d5v h TYR 31 Cb -0.06 -0.42 -0.03 0.00 1.01 0.00 0.00 36.73 37.23 1d5v h TYR 31 CO -0.00 0.79 0.19 1.96 -1.05 0.00 0.00 178.16 180.05 1d5v h GLN 32 N 1.34 0.91 -0.49 4.88 1.08 -1.34 -2.80 115.11 118.70 1d5v h GLN 32 Ca 0.36 -0.17 0.00 0.00 -1.45 0.00 0.00 58.65 57.40 1d5v h GLN 32 Cb -0.15 -0.15 -0.02 0.00 -0.05 0.00 0.00 27.48 27.11 1d5v h GLN 32 CO -0.08 0.78 0.32 0.35 -0.95 0.00 0.00 178.83 179.26 1d5v h PHE 33 N 0.89 0.61 0.15 2.96 3.04 -1.32 -1.42 116.94 121.85 1d5v h PHE 33 Ca 0.20 0.01 -0.01 0.00 3.98 0.00 0.00 57.97 62.16 1d5v h PHE 33 Cb 0.25 -0.21 0.00 0.00 2.56 0.00 0.00 35.95 38.55 1d5v h PHE 33 CO 0.02 0.39 -0.07 0.82 -2.02 0.00 0.00 178.31 177.44 1d5v h ILE 34 N 0.66 0.99 -0.92 1.41 2.04 -1.48 -2.93 117.51 117.29 1d5v h ILE 34 Ca 0.18 -0.96 -0.02 0.00 1.00 0.00 0.00 64.86 65.06 1d5v h ILE 34 Cb -0.08 1.55 -0.04 0.00 -0.74 0.00 0.00 36.82 37.51 1d5v h ILE 34 CO -0.04 0.21 0.51 0.24 0.00 0.00 0.00 178.15 179.08 1d5v h MET 35 N -0.69 1.27 0.04 2.37 2.86 -1.52 -0.60 114.93 118.66 1d5v h MET 35 Ca -0.02 -0.14 -0.00 0.00 -2.06 0.00 0.00 59.70 57.48 1d5v h MET 35 Cb 0.50 -0.25 0.00 0.00 0.06 0.00 0.00 31.60 31.91 1d5v h MET 35 CO 0.03 0.92 -0.02 -0.44 1.06 0.00 0.00 176.91 178.46 1d5v h ASP 36 N 1.28 -0.05 -0.38 1.22 3.32 -1.32 -2.63 116.42 117.86 1d5v h ASP 36 Ca 0.32 -0.11 -0.16 0.00 0.02 0.00 0.00 57.03 57.10 1d5v h ASP 36 Cb 0.01 0.01 -0.01 0.00 0.22 0.00 0.00 39.33 39.57 1d5v h ASP 36 CO -0.05 0.08 -0.41 0.03 -1.72 0.00 0.00 179.24 177.17 1d5v h ARG 37 N -0.18 0.94 -3.08 3.56 3.08 -1.42 -3.38 114.38 113.90 1d5v h ARG 37 Ca -0.01 -0.51 -0.62 0.00 0.07 0.00 0.00 59.98 58.91 1d5v h ARG 37 Cb 0.16 0.02 -0.41 0.00 0.08 0.00 0.00 29.97 29.82 1d5v h ARG 37 CO 0.01 1.16 -0.63 -0.06 -1.07 0.00 0.00 179.97 179.38 1d5v s PHE 38 N -4.37 3.18 -0.97 3.04 0.08 -0.24 -4.92 117.98 113.78 1d5v s PHE 38 Ca -0.11 -3.16 0.00 0.00 0.12 0.00 0.00 56.93 53.78 1d5v s PHE 38 Cb 0.11 -2.53 0.00 0.00 -0.57 0.00 0.00 43.02 40.03 1d5v s PHE 38 CO 0.88 -0.63 0.50 -2.30 -0.10 0.00 0.00 175.22 173.58 1d5v n PRO 39 N 2.40 0.00 -0.38 0.24 -0.02 -1.00 -1.58 135.00 134.67 1d5v n PRO 39 Ca 0.16 0.12 -0.02 0.00 -2.02 0.00 0.00 63.50 61.74 1d5v n PRO 39 Cb 0.35 -1.58 0.11 0.00 -0.02 0.00 0.00 33.50 32.37 1d5v n PRO 39 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 1d5v h PHE 40 N 0.00 1.27 0.00 6.00 3.57 -1.90 -1.74 116.94 124.14 1d5v h PHE 40 Ca 0.00 0.03 -0.10 0.00 3.53 0.00 0.00 57.97 61.43 1d5v h PHE 40 Cb 0.15 -0.43 -0.01 0.00 2.79 0.00 0.00 35.95 38.45 1d5v h PHE 40 CO 0.00 0.80 -0.49 1.88 -2.23 0.00 0.00 178.31 178.27 1d5v h TYR 41 N 1.37 0.00 -1.00 0.41 -1.99 -1.61 -3.03 116.97 111.12 1d5v h TYR 41 Ca 0.37 0.00 0.01 0.00 2.00 0.00 0.00 58.73 61.11 1d5v h TYR 41 Cb -0.16 0.00 -0.05 0.00 2.00 0.00 0.00 36.73 38.52 1d5v h TYR 41 CO -0.00 0.49 0.66 0.00 -0.00 0.00 0.00 178.16 179.30 1d5v h ARG 42 N 0.00 1.31 -0.83 4.88 3.08 -1.50 -1.99 114.38 119.34 1d5v h ARG 42 Ca -0.00 -0.08 -0.03 0.00 0.07 0.00 0.00 59.98 59.93 1d5v h ARG 42 Cb 0.87 -0.29 -0.04 0.00 0.08 0.00 0.00 29.97 30.59 1d5v h ARG 42 CO 0.06 0.87 0.40 0.93 -1.07 0.00 0.00 179.97 181.16 1d5v h GLU 43 N 1.35 1.19 -3.08 0.04 5.08 -1.49 -3.28 114.58 114.40 1d5v h GLU 43 Ca 0.36 -0.18 -0.70 0.00 -1.00 0.00 0.00 59.36 57.85 1d5v h GLU 43 Cb -0.15 -0.21 -0.36 0.00 0.50 0.00 0.00 28.75 28.53 1d5v h GLU 43 CO -0.08 0.92 -0.08 0.09 -1.00 0.00 0.00 179.01 178.86 1d5v n ASN 44 N -4.33 4.36 -0.12 1.42 5.03 -0.76 -4.88 115.26 115.98 1d5v n ASN 44 Ca 0.08 -3.22 -0.13 0.00 0.87 0.00 0.00 54.58 52.18 1d5v n ASN 44 Cb 0.14 -1.01 -0.02 0.00 -1.02 0.00 0.00 39.78 37.87 1d5v n ASN 44 CO 0.00 0.00 0.00 0.11 -1.83 0.00 0.00 177.26 175.54 1d5v h LYS 45 N 5.60 0.95 -7.01 3.52 1.57 -1.58 -3.42 116.57 116.18 1d5v h LYS 45 Ca 0.17 -0.50 -0.47 0.00 -1.87 0.00 0.00 60.65 57.99 1d5v h LYS 45 Cb 0.76 0.02 0.01 0.00 0.08 0.00 0.00 32.23 33.09 1d5v h LYS 45 CO 0.91 1.16 0.38 -0.65 -0.57 0.00 0.00 179.45 180.68 1d5v s GLN 46 N -4.40 4.10 0.00 3.15 -0.21 -1.26 -3.28 119.66 117.76 1d5v s GLN 46 Ca -0.11 1.36 0.00 0.00 0.02 0.00 0.00 55.36 56.63 1d5v s GLN 46 Cb 0.11 -2.34 0.00 0.00 1.00 0.00 0.00 33.01 31.79 1d5v s GLN 46 CO 0.88 -0.17 0.00 0.41 -2.12 0.00 0.00 175.29 174.29 1d5v n GLY 47 N -0.05 2.62 0.00 3.09 0.00 -1.26 -4.68 105.19 104.90 1d5v n GLY 47 Ca 0.07 -0.68 0.12 0.00 0.00 0.00 0.00 46.02 45.52 1d5v n GLY 47 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 173.32 170.65 1d5v n TRP 48 N 0.00 0.03 0.26 1.61 4.27 -1.26 -3.96 117.44 118.38 1d5v n TRP 48 Ca 0.00 0.01 -0.14 0.00 -3.89 0.00 0.00 57.50 53.48 1d5v n TRP 48 Cb 0.00 -0.27 -0.08 0.00 -1.36 0.00 0.00 31.31 29.60 1d5v n TRP 48 CO 0.00 0.00 0.00 0.37 -2.29 0.00 0.00 177.69 175.77 1d5v h GLN 49 N 0.00 -0.65 -0.06 -2.67 4.15 -1.82 -2.92 115.11 111.14 1d5v h GLN 49 Ca 0.00 0.04 -0.12 0.00 0.77 0.00 0.00 58.65 59.35 1d5v h GLN 49 Cb 0.52 0.15 -0.01 0.00 0.21 0.00 0.00 27.48 28.34 1d5v h GLN 49 CO 0.00 -0.34 -0.49 -0.91 -1.93 0.00 0.00 178.83 175.16 1d5v h ASN 50 N -0.95 0.18 -0.97 -0.69 2.35 -1.89 -3.12 115.58 110.49 1d5v h ASN 50 Ca -0.07 -0.08 0.04 0.00 -0.55 0.00 0.00 56.30 55.64 1d5v h ASN 50 Cb 0.60 -0.05 -0.06 0.00 0.05 0.00 0.00 38.32 38.87 1d5v h ASN 50 CO 0.11 0.64 0.64 -1.28 -1.65 0.00 0.00 177.43 175.89 1d5v h SER 51 N 0.13 1.05 -0.02 5.81 0.87 -1.68 -0.28 113.55 119.43 1d5v h SER 51 Ca 0.00 -0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1d5v h SER 51 Cb 0.92 -0.24 -0.00 0.00 -0.44 0.00 0.00 62.40 62.64 1d5v h SER 51 CO 0.07 0.71 0.02 0.40 -0.53 0.00 0.00 176.83 177.50 1d5v h ILE 52 N 1.21 1.01 -0.22 2.23 1.08 -1.45 -2.09 117.51 119.28 1d5v h ILE 52 Ca 0.39 -0.02 -0.14 0.00 -0.39 0.00 0.00 64.86 64.70 1d5v h ILE 52 Cb 0.03 0.98 -0.01 0.00 -3.07 0.00 0.00 36.82 34.75 1d5v h ILE 52 CO -0.13 0.01 -0.45 0.03 -0.69 0.00 0.00 178.15 176.92 1d5v h ARG 53 N 0.03 0.56 -0.98 2.37 3.08 -1.60 -2.91 114.38 114.93 1d5v h ARG 53 Ca 0.01 -0.31 0.01 0.00 0.07 0.00 0.00 59.98 59.76 1d5v h ARG 53 Cb 0.00 0.02 -0.05 0.00 0.08 0.00 0.00 29.97 30.02 1d5v h ARG 53 CO -0.00 0.90 0.65 0.45 -1.07 0.00 0.00 179.97 180.90 1d5v h HIS 54 N 0.46 1.24 -0.52 3.04 3.86 -0.80 0.07 115.15 122.50 1d5v h HIS 54 Ca 0.03 0.03 -0.13 0.00 -1.16 0.00 0.00 60.37 59.14 1d5v h HIS 54 Cb 0.97 -0.42 -0.02 0.00 1.06 0.00 0.00 27.41 29.00 1d5v h HIS 54 CO 0.04 0.78 -0.17 -2.95 0.86 0.00 0.00 177.93 176.49 1d5v h ASN 55 N 1.33 1.04 -0.13 2.45 -1.07 -1.30 0.46 115.58 118.36 1d5v h ASN 55 Ca 0.36 -0.38 0.00 0.00 0.07 0.00 0.00 56.30 56.36 1d5v h ASN 55 Cb -0.15 -0.29 -0.01 0.00 -2.07 0.00 0.00 38.32 35.81 1d5v h ASN 55 CO -0.08 1.18 0.09 -0.07 0.07 0.00 0.00 177.43 178.62 1d5v h LEU 56 N 0.90 0.16 -0.32 6.14 3.38 -1.13 0.48 115.31 124.92 1d5v h LEU 56 Ca 0.13 -0.01 -0.14 0.00 0.09 0.00 0.00 57.88 57.94 1d5v h LEU 56 Cb 0.75 -0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.46 1d5v h LEU 56 CO 0.06 0.12 -0.36 0.77 0.09 0.00 0.00 178.44 179.11 1d5v h SER 57 N 0.18 0.88 -0.43 -0.43 4.64 -0.92 -3.18 113.55 114.30 1d5v h SER 57 Ca 0.05 -0.48 -0.15 0.00 -0.47 0.00 0.00 61.79 60.74 1d5v h SER 57 Cb -0.02 -0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 61.82 1d5v h SER 57 CO -0.01 1.18 -0.31 -0.07 -0.87 0.00 0.00 176.83 176.75 1d5v h LEU 58 N 0.59 1.01 -9.14 5.97 3.38 -0.76 -3.41 115.31 112.95 1d5v h LEU 58 Ca 0.05 -0.43 -0.57 0.00 0.09 0.00 0.00 57.88 57.02 1d5v h LEU 58 Cb 0.95 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 41.38 1d5v h LEU 58 CO 0.09 1.23 0.94 0.20 0.09 0.00 0.00 178.44 180.98 1d5v s ASN 59 N -6.78 6.88 0.00 -0.43 0.01 0.17 -4.86 114.94 109.93 1d5v s ASN 59 Ca -0.11 1.72 0.27 0.00 -0.71 0.00 0.00 52.86 54.03 1d5v s ASN 59 Cb 0.11 -2.54 0.90 0.00 0.41 0.00 0.00 41.25 40.14 1d5v s ASN 59 CO 0.88 -0.82 1.69 -0.62 -1.51 0.00 0.00 177.10 176.72 1d5v n GLU 60 N 6.75 0.02 -0.38 -0.60 1.02 -1.26 -3.76 120.64 122.44 1d5v n GLU 60 Ca 0.14 -0.01 -0.02 0.00 -0.02 0.00 0.00 57.16 57.26 1d5v n GLU 60 Cb 0.45 -1.50 0.11 0.00 -0.02 0.00 0.00 31.44 30.48 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 -6.10 3.86 -0.12 0.00 0.08 -1.25 -3.23 117.98 111.22 1d5v s PHE 62 Ca -0.13 1.85 0.01 0.00 0.12 0.00 0.00 56.93 58.78 1d5v s PHE 62 Cb 0.18 -3.04 -0.01 0.00 -0.57 0.00 0.00 43.02 39.58 1d5v s PHE 62 CO 0.82 0.21 -0.16 0.08 -0.10 0.00 0.00 175.22 176.07 1d5v s VAL 63 N -1.24 2.80 0.19 -0.44 1.01 -1.12 -4.97 120.40 116.63 1d5v s VAL 63 Ca 0.43 -0.75 -0.30 0.00 0.00 0.00 0.00 61.98 61.36 1d5v s VAL 63 Cb -0.26 -2.15 -0.08 0.00 0.00 0.00 0.00 36.38 33.88 1d5v s VAL 63 CO 0.33 0.53 1.16 -0.54 0.00 0.00 0.00 175.10 176.58 1d5v s LYS 64 N 0.33 4.53 -0.08 2.72 1.02 -1.26 -3.15 119.74 123.86 1d5v s LYS 64 Ca -0.13 1.82 0.01 0.00 0.02 0.00 0.00 55.97 57.70 1d5v s LYS 64 Cb -0.16 -3.25 0.02 0.00 -0.52 0.00 0.00 37.83 33.92 1d5v s LYS 64 CO 0.06 -0.02 -0.09 0.08 -0.92 0.00 0.00 175.35 174.46 1d5v s VAL 65 N -0.17 0.97 0.77 3.17 1.01 0.24 -4.97 120.40 121.41 1d5v s VAL 65 Ca 0.51 -0.34 -0.10 0.00 0.00 0.00 0.00 61.98 62.06 1d5v s VAL 65 Cb -0.32 -0.94 0.08 0.00 0.00 0.00 0.00 36.38 35.21 1d5v s VAL 65 CO 0.36 0.33 1.11 -2.16 0.00 0.00 0.00 175.10 174.75 1d5v s PRO 66 N 1.07 1.95 0.00 2.72 0.04 -1.26 0.19 135.00 139.71 1d5v s PRO 66 Ca -0.07 -0.14 0.00 0.00 0.04 0.00 0.00 61.00 60.83 1d5v s PRO 66 Cb -0.14 -2.05 0.00 0.00 0.04 0.00 0.00 34.50 32.34 1d5v s PRO 66 CO -0.01 -1.50 0.00 0.54 0.04 0.00 0.00 177.00 176.07 1d5v n ARG 67 N -3.16 0.00 -4.06 4.56 1.74 -1.26 -4.73 116.66 109.75 1d5v n ARG 67 Ca 0.09 0.00 -0.10 0.00 -0.77 0.00 0.00 57.85 57.07 1d5v n ARG 67 Cb 0.61 0.00 -0.07 0.00 -1.02 0.00 0.00 32.46 31.98 1d5v n ARG 67 CO 0.00 0.00 0.00 0.16 -1.52 0.00 0.00 177.63 176.27 1d5v s ASP 68 N -1.53 -0.02 0.32 0.55 -4.77 -1.25 -5.04 116.67 104.93 1d5v s ASP 68 Ca 0.00 -1.07 0.06 0.00 -3.30 0.00 0.00 52.55 48.24 1d5v s ASP 68 Cb 0.00 0.52 0.55 0.00 -1.09 0.00 0.00 42.92 42.90 1d5v s ASP 68 CO 0.00 -1.04 1.79 0.44 0.70 0.00 0.00 175.17 177.06 1d5v h ASP 69 N 2.37 0.36 -1.01 2.11 3.32 -1.97 -3.00 116.42 118.61 1d5v h ASP 69 Ca -0.29 -0.11 0.01 0.00 0.02 0.00 0.00 57.03 56.66 1d5v h ASP 69 Cb 1.25 -0.10 -0.05 0.00 0.22 0.00 0.00 39.33 40.65 1d5v h ASP 69 CO 0.41 0.59 0.67 0.11 -1.72 0.00 0.00 179.24 179.30 1d5v h LYS 70 N 0.34 1.33 -5.02 3.56 1.57 -2.05 -3.39 116.57 112.90 1d5v h LYS 70 Ca 0.06 -0.08 -0.67 0.00 -1.87 0.00 0.00 60.65 58.09 1d5v h LYS 70 Cb 0.57 -0.30 -0.35 0.00 0.08 0.00 0.00 32.23 32.23 1d5v h LYS 70 CO 0.04 0.88 -0.84 0.15 -0.57 0.00 0.00 179.45 179.11 1d5v s LYS 71 N -6.11 2.87 1.00 3.15 1.02 -1.13 -5.11 119.74 115.42 1d5v s LYS 71 Ca -0.13 -0.92 -0.20 0.00 0.02 0.00 0.00 55.97 54.74 1d5v s LYS 71 Cb 0.18 -2.67 -0.14 0.00 -0.52 0.00 0.00 37.83 34.68 1d5v s LYS 71 CO 0.82 -0.28 -0.92 -2.30 -0.92 0.00 0.00 175.35 171.75 1d5v n PRO 72 N 4.60 -0.10 -1.83 -1.68 -0.02 -1.26 -3.90 135.00 130.80 1d5v n PRO 72 Ca -0.19 -0.03 -0.34 0.00 -2.02 0.00 0.00 63.50 60.92 1d5v n PRO 72 Cb 0.48 -1.10 -0.05 0.00 -0.02 0.00 0.00 33.50 32.81 1d5v n PRO 72 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1d5v n GLY 73 N 3.27 1.67 0.38 -1.23 0.00 -1.26 -4.67 105.19 103.35 1d5v n GLY 73 Ca -0.01 -0.94 -0.02 0.00 0.00 0.00 0.00 46.02 45.05 1d5v n GLY 73 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1d5v h LYS 74 N 8.91 1.32 -3.96 1.61 1.57 -1.97 -3.44 116.57 120.61 1d5v h LYS 74 Ca 0.31 -0.08 -0.10 0.00 -1.87 0.00 0.00 60.65 58.91 1d5v h LYS 74 Cb 0.85 -0.30 -0.14 0.00 0.08 0.00 0.00 32.23 32.72 1d5v h LYS 74 CO 1.48 0.88 -0.47 0.20 -0.57 0.00 0.00 179.45 180.97 1d5v s GLY 75 N -3.13 0.25 -0.29 3.86 0.00 -1.26 -5.14 107.32 101.62 1d5v s GLY 75 Ca -0.13 -0.83 -0.12 0.00 0.00 0.00 0.00 44.72 43.64 1d5v s GLY 75 CO 0.82 -0.97 0.24 -0.45 0.00 0.00 0.00 173.10 172.73 1d5v s SER 76 N -2.89 6.08 0.46 1.64 0.15 -1.26 -4.30 113.70 113.57 1d5v s SER 76 Ca 0.07 0.00 -0.21 0.00 0.70 0.00 0.00 55.95 56.51 1d5v s SER 76 Cb 0.06 -2.14 -0.09 0.00 -1.71 0.00 0.00 66.02 62.14 1d5v s SER 76 CO -0.10 -0.11 1.04 -0.31 1.20 0.00 0.00 173.24 174.96 1d5v s TYR 77 N 1.83 3.09 0.01 3.44 1.51 0.52 -3.73 117.35 124.02 1d5v s TYR 77 Ca 0.09 1.60 0.09 0.00 -1.01 0.00 0.00 57.07 57.83 1d5v s TYR 77 Cb -0.16 -3.07 -0.02 0.00 -0.11 0.00 0.00 41.96 38.60 1d5v s TYR 77 CO 0.11 -0.73 -0.26 -1.58 -1.11 0.00 0.00 175.55 171.98 1d5v s TRP 78 N -1.90 2.33 0.07 2.71 0.52 0.30 0.80 118.94 123.76 1d5v s TRP 78 Ca 0.64 -0.43 -0.04 0.00 0.02 0.00 0.00 56.10 56.29 1d5v s TRP 78 Cb -0.17 -1.45 -0.02 0.00 -1.15 0.00 0.00 33.47 30.67 1d5v s TRP 78 CO 0.21 0.04 0.07 -0.08 0.02 0.00 0.00 176.95 177.21 1d5v s THR 79 N -0.70 0.19 0.05 2.01 -1.32 -1.19 -2.97 115.64 111.72 1d5v s THR 79 Ca 0.11 -1.54 -0.22 0.00 -1.21 0.00 0.00 61.69 58.83 1d5v s THR 79 Cb -0.10 -1.44 -0.06 0.00 -1.51 0.00 0.00 72.50 69.38 1d5v s THR 79 CO 0.00 -0.85 0.67 -0.76 -2.21 0.00 0.00 174.62 171.48 1d5v s LEU 80 N -2.90 4.48 0.14 9.08 1.43 -1.26 -2.79 118.68 126.86 1d5v s LEU 80 Ca 0.06 1.34 -0.30 0.00 -1.03 0.00 0.00 54.13 54.20 1d5v s LEU 80 Cb 0.07 -3.07 -0.07 0.00 0.03 0.00 0.00 46.19 43.15 1d5v s LEU 80 CO -0.10 0.13 1.16 -0.62 0.23 0.00 0.00 176.35 177.14 1d5v s ASP 81 N -0.48 7.15 0.25 2.29 2.15 -1.20 -4.95 116.67 121.89 1d5v s ASP 81 Ca 0.34 2.11 0.00 0.00 0.43 0.00 0.00 52.55 55.42 1d5v s ASP 81 Cb -0.20 -2.60 0.00 0.00 -0.30 0.00 0.00 42.92 39.82 1d5v s ASP 81 CO 0.21 -0.35 0.00 -0.81 -0.17 0.00 0.00 175.17 174.05 1d5v n PRO 82 N 2.90 0.73 -0.94 4.34 -0.04 -1.26 -4.86 135.00 135.87 1d5v n PRO 82 Ca 0.05 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.39 1d5v n PRO 82 Cb 0.46 0.00 -0.07 0.00 -0.04 0.00 0.00 33.50 33.85 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 -0.74 5.68 -0.12 3.54 8.00 -1.26 -4.53 116.55 127.12 1d5v n ASP 83 Ca 0.00 -2.68 0.23 0.00 0.71 0.00 0.00 54.79 53.05 1d5v n ASP 83 Cb 0.00 -1.25 0.66 0.00 -0.02 0.00 0.00 41.12 40.50 1d5v n ASP 83 CO 0.00 0.00 0.00 -1.28 -0.39 0.00 0.00 177.20 175.53 1d5v h SER 84 N 2.23 0.10 -0.93 -2.24 0.87 -1.98 0.85 113.55 112.45 1d5v h SER 84 Ca 0.19 0.01 0.01 0.00 -1.23 0.00 0.00 61.79 60.76 1d5v h SER 84 Cb 1.14 -0.01 -0.05 0.00 -0.44 0.00 0.00 62.40 63.05 1d5v h SER 84 CO 0.36 0.04 0.60 1.88 -0.53 0.00 0.00 176.83 179.19 1d5v h TYR 85 N 0.10 1.18 -0.24 2.24 0.05 -2.00 -1.61 116.97 116.69 1d5v h TYR 85 Ca 0.36 0.02 0.00 0.00 0.05 0.00 0.00 58.73 59.16 1d5v h TYR 85 Cb 1.28 -0.40 0.00 0.00 1.01 0.00 0.00 36.73 38.62 1d5v h TYR 85 CO -0.00 0.75 0.00 0.09 -1.05 0.00 0.00 178.16 177.95 1d5v n ASN 86 N -4.38 1.36 -4.78 3.88 5.03 0.28 -4.88 115.26 111.76 1d5v n ASN 86 Ca 0.11 -1.95 -0.37 0.00 0.87 0.00 0.00 54.58 53.23 1d5v n ASN 86 Cb 0.03 -0.16 -0.06 0.00 -1.02 0.00 0.00 39.78 38.57 1d5v n ASN 86 CO 0.00 0.00 0.00 -0.04 -1.83 0.00 0.00 177.26 175.39 1d5v s MET 87 N -1.68 4.57 0.00 3.52 -1.94 -0.61 -5.01 119.30 118.15 1d5v s MET 87 Ca 0.19 1.26 0.00 0.00 -1.71 0.00 0.00 55.69 55.43 1d5v s MET 87 Cb 0.10 -2.92 0.00 0.00 2.01 0.00 0.00 34.83 34.02 1d5v s MET 87 CO 0.14 0.36 0.00 1.19 -0.01 0.00 0.00 175.02 176.69 1d5v n PHE 88 N 0.81 0.00 0.57 -0.03 3.72 -1.26 -5.00 117.46 116.27 1d5v n PHE 88 Ca 0.00 0.00 0.07 0.00 -0.05 0.00 0.00 57.45 57.47 1d5v n PHE 88 Cb 0.50 0.00 0.19 0.00 -0.94 0.00 0.00 39.48 39.23 1d5v n PHE 88 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 176.76 177.10 1d5v n GLU 89 N 0.00 2.08 -4.74 -1.08 4.71 -1.26 -4.83 120.64 115.51 1d5v n GLU 89 Ca 0.00 -1.58 -0.25 0.00 -0.01 0.00 0.00 57.16 55.32 1d5v n GLU 89 Cb 0.00 -1.37 -0.16 0.00 -1.01 0.00 0.00 31.44 28.90 1d5v n GLU 89 CO 0.00 0.00 0.00 1.21 0.09 0.00 0.00 177.13 178.43 1d5v s ASN 90 N -0.97 1.95 -0.39 1.62 2.47 -1.26 -5.09 114.94 113.27 1d5v s ASN 90 Ca 0.29 -0.32 0.03 0.00 0.42 0.00 0.00 52.86 53.29 1d5v s ASN 90 Cb 0.16 -0.51 0.18 0.00 -1.45 0.00 0.00 41.25 39.63 1d5v s ASN 90 CO 0.19 0.14 0.76 -0.83 -3.72 0.00 0.00 177.10 173.64 1d5v s GLY 91 N 0.03 -1.36 -0.10 1.21 0.00 -1.26 -4.99 107.32 100.85 1d5v s GLY 91 Ca -0.03 0.48 0.19 0.00 0.00 0.00 0.00 44.72 45.36 1d5v s GLY 91 CO 0.02 3.85 1.62 1.44 0.00 0.00 0.00 173.10 180.03 1d5v n SER 92 N 4.11 4.66 0.04 1.64 7.64 -1.26 -4.48 113.62 125.96 1d5v n SER 92 Ca 0.10 -2.39 -0.12 0.00 1.01 0.00 0.00 58.87 57.47 1d5v n SER 92 Cb 0.59 -0.57 -0.07 0.00 -1.01 0.00 0.00 64.21 63.15 1d5v n SER 92 CO 0.00 0.00 0.00 0.15 -3.01 0.00 0.00 175.04 172.18 1d5v h PHE 93 N 4.14 0.01 0.00 1.43 3.57 -2.07 -3.58 116.94 120.45 1d5v h PHE 93 Ca 0.00 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1d5v h PHE 93 Cb 1.39 -0.00 0.00 0.00 2.79 0.00 0.00 35.95 40.13 1d5v h PHE 93 CO 0.74 0.01 0.00 1.28 -2.23 0.00 0.00 178.31 178.11