#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 4.19 0.17 4.03 1.43 -1.26 -5.06 118.68 122.18 1d5v s LEU 2 Ca 0.00 2.08 0.05 0.00 -1.03 0.00 0.00 54.13 55.24 1d5v s LEU 2 Cb 0.00 -4.11 -0.05 0.00 0.03 0.00 0.00 46.19 42.06 1d5v s LEU 2 CO 0.00 -0.47 -0.11 0.68 0.23 0.00 0.00 176.35 176.68 1d5v s VAL 3 N -1.59 1.35 0.47 -1.59 -7.23 -1.26 -5.11 120.40 105.45 1d5v s VAL 3 Ca 0.56 -2.11 -0.21 0.00 -1.81 0.00 0.00 61.98 58.42 1d5v s VAL 3 Cb -0.24 -1.91 -0.09 0.00 0.56 0.00 0.00 36.38 34.70 1d5v s VAL 3 CO 0.30 -0.70 1.01 -0.54 -0.31 0.00 0.00 175.10 174.86 1d5v s LYS 4 N -3.72 3.95 0.77 4.82 3.01 -1.26 -4.97 119.74 122.34 1d5v s LYS 4 Ca 0.19 1.29 -0.11 0.00 -1.01 0.00 0.00 55.97 56.33 1d5v s LYS 4 Cb 0.02 -2.13 0.05 0.00 -1.01 0.00 0.00 37.83 34.75 1d5v s LYS 4 CO 0.03 -0.30 1.08 -1.25 0.51 0.00 0.00 175.35 175.42 1d5v s PRO 5 N -3.19 2.33 0.00 -1.68 0.04 -1.26 -4.91 135.00 126.33 1d5v s PRO 5 Ca 0.65 0.99 0.00 0.00 0.04 0.00 0.00 61.00 62.68 1d5v s PRO 5 Cb -0.14 -1.92 0.00 0.00 0.04 0.00 0.00 34.50 32.48 1d5v s PRO 5 CO 0.18 -1.54 0.65 -0.35 0.04 0.00 0.00 177.00 175.98 1d5v n PRO 6 N -3.43 0.73 -3.81 0.56 -0.04 -1.26 -4.81 135.00 122.94 1d5v n PRO 6 Ca 0.08 0.00 -0.36 0.00 -0.04 0.00 0.00 63.50 63.18 1d5v n PRO 6 Cb 0.54 -1.19 -0.07 0.00 -0.04 0.00 0.00 33.50 32.74 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 -0.03 3.46 0.81 0.54 2.02 -1.26 -5.08 117.35 117.80 1d5v s TYR 7 Ca 0.00 0.38 -0.11 0.00 -0.37 0.00 0.00 57.07 56.97 1d5v s TYR 7 Cb 0.00 -2.07 0.08 0.00 -0.40 0.00 0.00 41.96 39.57 1d5v s TYR 7 CO 0.00 0.44 1.09 0.45 -1.57 0.00 0.00 175.55 175.96 1d5v s SER 8 N -0.14 4.22 0.21 2.29 0.15 -1.26 -4.73 113.70 114.44 1d5v s SER 8 Ca 0.10 1.68 -0.10 0.00 0.70 0.00 0.00 55.95 58.33 1d5v s SER 8 Cb -0.11 -2.38 0.17 0.00 -1.71 0.00 0.00 66.02 61.98 1d5v s SER 8 CO 0.00 -2.19 1.86 1.88 1.20 0.00 0.00 173.24 175.99 1d5v h TYR 9 N -1.24 0.86 -0.68 3.44 0.05 -1.98 0.84 116.97 118.26 1d5v h TYR 9 Ca -0.46 0.02 -0.08 0.00 0.05 0.00 0.00 58.73 58.27 1d5v h TYR 9 Cb 1.25 -0.29 -0.03 0.00 1.01 0.00 0.00 36.73 38.67 1d5v h TYR 9 CO 0.53 0.52 0.11 0.82 -1.05 0.00 0.00 178.16 179.09 1d5v h ILE 10 N 0.92 1.27 -0.57 -2.88 2.04 -1.96 -2.40 117.51 113.92 1d5v h ILE 10 Ca 0.28 -1.04 -0.00 0.00 1.00 0.00 0.00 64.86 65.09 1d5v h ILE 10 Cb -0.04 0.62 -0.03 0.00 -0.74 0.00 0.00 36.82 36.63 1d5v h ILE 10 CO -0.09 0.39 0.34 0.00 0.00 0.00 0.00 178.15 178.80 1d5v h ALA 11 N 1.06 0.73 -1.00 1.87 0.00 -1.57 -0.32 119.26 120.04 1d5v h ALA 11 Ca 0.21 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 55.05 1d5v h ALA 11 Cb 0.44 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 17.95 1d5v h ALA 11 CO 0.01 0.22 0.66 -0.07 0.00 0.00 0.00 179.25 180.07 1d5v h LEU 12 N 0.77 1.14 -0.65 0.00 3.38 -0.61 -1.29 115.31 118.06 1d5v h LEU 12 Ca 0.20 -0.03 -0.03 0.00 0.09 0.00 0.00 57.88 58.11 1d5v h LEU 12 Cb -0.01 -0.29 -0.03 0.00 0.09 0.00 0.00 40.66 40.43 1d5v h LEU 12 CO -0.04 0.83 0.28 0.40 0.09 0.00 0.00 178.44 180.00 1d5v h ILE 13 N 1.35 1.23 -0.65 1.22 2.04 -0.87 -1.19 117.51 120.64 1d5v h ILE 13 Ca 0.36 -0.70 -0.00 0.00 1.00 0.00 0.00 64.86 65.52 1d5v h ILE 13 Cb -0.16 0.48 -0.03 0.00 -0.74 0.00 0.00 36.82 36.38 1d5v h ILE 13 CO -0.08 0.28 0.40 0.74 0.00 0.00 0.00 178.15 179.49 1d5v h THR 14 N 0.91 1.19 -0.37 -0.27 2.02 -0.00 -2.65 112.91 113.73 1d5v h THR 14 Ca 0.22 -0.41 -0.17 0.00 0.77 0.00 0.00 66.41 66.82 1d5v h THR 14 Cb 0.17 0.28 -0.00 0.00 -1.74 0.00 0.00 68.15 66.86 1d5v h THR 14 CO -0.02 0.19 -0.42 0.24 0.37 0.00 0.00 175.52 175.88 1d5v h MET 15 N 0.89 0.93 -0.36 6.66 2.86 -1.04 -2.91 114.93 121.96 1d5v h MET 15 Ca 0.23 -0.51 0.08 0.00 -2.06 0.00 0.00 59.70 57.44 1d5v h MET 15 Cb -0.03 0.03 -0.08 0.00 0.06 0.00 0.00 31.60 31.57 1d5v h MET 15 CO -0.04 1.17 -0.22 0.00 1.06 0.00 0.00 176.91 178.87 1d5v h ALA 16 N 0.76 0.01 -0.58 6.32 0.00 -0.89 0.12 119.26 125.00 1d5v h ALA 16 Ca 0.05 0.12 0.01 0.00 0.00 0.00 0.00 54.91 55.09 1d5v h ALA 16 Cb 1.02 0.50 -0.03 0.00 0.00 0.00 0.00 17.79 19.28 1d5v h ALA 16 CO 0.10 -0.60 0.38 0.82 0.00 0.00 0.00 179.25 179.95 1d5v h ILE 17 N -0.17 1.15 -0.39 0.00 2.04 -1.47 -0.34 117.51 118.33 1d5v h ILE 17 Ca 0.18 -0.27 0.00 0.00 1.00 0.00 0.00 64.86 65.77 1d5v h ILE 17 Cb 0.44 0.30 -0.02 0.00 -0.74 0.00 0.00 36.82 36.80 1d5v h ILE 17 CO -0.46 0.14 0.25 1.56 0.00 0.00 0.00 178.15 179.65 1d5v h GLN 18 N 0.78 0.51 -0.42 2.37 4.20 -0.96 -2.25 115.11 119.34 1d5v h GLN 18 Ca 0.21 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.89 1d5v h GLN 18 Cb -0.09 -0.11 0.00 0.00 0.30 0.00 0.00 27.48 27.58 1d5v h GLN 18 CO -0.05 0.34 0.00 0.27 -0.67 0.00 0.00 178.83 178.73 1d5v n ASN 19 N -4.81 2.15 -4.66 1.46 0.23 0.26 -4.86 115.26 105.04 1d5v n ASN 19 Ca 0.00 -2.05 -0.43 0.00 -0.53 0.00 0.00 54.58 51.57 1d5v n ASN 19 Cb 0.03 -0.29 -0.02 0.00 -2.08 0.00 0.00 39.78 37.42 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 -1.54 3.66 0.39 -2.53 0.00 -0.16 -4.89 121.76 116.70 1d5v s ALA 20 Ca 0.25 0.29 0.24 0.00 0.00 0.00 0.00 51.96 52.74 1d5v s ALA 20 Cb 0.14 -3.57 1.33 0.00 0.00 0.00 0.00 23.12 21.03 1d5v s ALA 20 CO 0.16 -1.06 1.61 -1.35 0.00 0.00 0.00 175.76 175.12 1d5v h PRO 21 N 7.69 0.10 -6.00 0.00 0.11 -1.89 -3.35 132.00 128.65 1d5v h PRO 21 Ca -0.22 -0.01 -0.68 0.00 0.11 0.00 0.00 66.00 65.20 1d5v h PRO 21 Cb 1.08 -0.02 -0.23 0.00 0.11 0.00 0.00 31.00 31.94 1d5v h PRO 21 CO 0.97 0.06 -0.74 -2.00 -0.21 0.00 0.00 178.00 176.08 1d5v s GLU 22 N -5.45 2.82 0.25 1.05 2.56 -1.26 -5.01 118.70 113.66 1d5v s GLU 22 Ca -0.09 -0.65 -0.06 0.00 0.00 0.00 0.00 54.97 54.18 1d5v s GLU 22 Cb 0.31 -2.52 0.26 0.00 2.00 0.00 0.00 34.13 34.19 1d5v s GLU 22 CO 0.80 0.52 1.93 -0.22 -0.56 0.00 0.00 175.26 177.73 1d5v h LYS 23 N 5.69 1.33 -6.26 4.30 1.63 -1.87 -3.39 116.57 118.00 1d5v h LYS 23 Ca -0.42 -0.08 -0.55 0.00 -0.85 0.00 0.00 60.65 58.75 1d5v h LYS 23 Cb 1.17 -0.30 -0.03 0.00 -0.60 0.00 0.00 32.23 32.47 1d5v h LYS 23 CO 0.53 0.88 0.31 0.15 -3.45 0.00 0.00 179.45 177.86 1d5v s LYS 24 N -6.11 4.50 0.01 1.90 1.02 -1.26 -4.65 119.74 115.14 1d5v s LYS 24 Ca -0.13 1.24 0.00 0.00 0.02 0.00 0.00 55.97 57.10 1d5v s LYS 24 Cb 0.18 -3.47 -0.01 0.00 -0.52 0.00 0.00 37.83 34.01 1d5v s LYS 24 CO 0.82 -0.06 -0.03 -1.50 -0.92 0.00 0.00 175.35 173.66 1d5v s ILE 25 N 1.12 0.16 0.62 2.17 2.07 -1.22 -4.91 121.20 121.21 1d5v s ILE 25 Ca 0.47 -0.60 -0.11 0.00 -1.41 0.00 0.00 60.65 58.99 1d5v s ILE 25 Cb -0.20 -0.24 -0.04 0.00 0.13 0.00 0.00 42.46 42.12 1d5v s ILE 25 CO 0.23 -0.28 1.03 -0.89 -1.91 0.00 0.00 174.94 173.12 1d5v s THR 26 N -0.90 4.68 0.11 4.00 2.01 -1.26 -0.93 115.64 123.35 1d5v s THR 26 Ca -0.09 0.87 -0.20 0.00 0.31 0.00 0.00 61.69 62.58 1d5v s THR 26 Cb -0.06 -3.85 -0.09 0.00 0.01 0.00 0.00 72.50 68.51 1d5v s THR 26 CO -0.00 -1.14 1.77 0.25 -0.69 0.00 0.00 174.62 174.81 1d5v h LEU 27 N -0.34 0.18 -0.97 4.42 5.85 -1.92 -2.23 115.31 120.31 1d5v h LEU 27 Ca -0.44 -0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.27 1d5v h LEU 27 Cb 1.19 -0.05 -0.05 0.00 0.37 0.00 0.00 40.66 42.13 1d5v h LEU 27 CO 0.62 0.14 0.58 0.78 -0.34 0.00 0.00 178.44 180.21 1d5v h ASN 28 N 0.21 1.14 -1.00 1.25 -0.26 -1.94 -2.50 115.58 112.48 1d5v h ASN 28 Ca 0.06 -0.06 0.02 0.00 -0.56 0.00 0.00 56.30 55.75 1d5v h ASN 28 Cb -0.02 -0.29 -0.05 0.00 -1.06 0.00 0.00 38.32 36.90 1d5v h ASN 28 CO -0.01 0.87 0.66 1.23 -1.06 0.00 0.00 177.43 179.11 1d5v h GLY 29 N 1.31 1.42 1.01 2.83 0.00 -1.79 -2.22 103.07 105.62 1d5v h GLY 29 Ca 0.34 -0.52 0.01 0.00 0.00 0.00 0.00 47.33 47.16 1d5v h GLY 29 CO -0.07 0.48 0.49 -2.22 0.00 0.00 0.00 176.54 175.23 1d5v h ILE 30 N 1.32 1.20 -0.87 2.60 2.04 -0.96 -2.48 117.51 120.36 1d5v h ILE 30 Ca 0.38 -0.36 -0.03 0.00 1.00 0.00 0.00 64.86 65.85 1d5v h ILE 30 Cb -0.10 0.10 -0.04 0.00 -0.74 0.00 0.00 36.82 36.04 1d5v h ILE 30 CO -0.10 0.19 0.44 1.88 0.00 0.00 0.00 178.15 180.56 1d5v h TYR 31 N 1.02 1.23 -0.97 1.37 0.05 -1.35 -2.52 116.97 115.80 1d5v h TYR 31 Ca 0.27 -0.05 0.00 0.00 0.05 0.00 0.00 58.73 59.01 1d5v h TYR 31 Cb -0.11 -0.39 -0.05 0.00 1.01 0.00 0.00 36.73 37.20 1d5v h TYR 31 CO -0.02 0.87 0.62 0.37 -1.05 0.00 0.00 178.16 178.95 1d5v h GLN 32 N 1.23 1.29 -0.32 4.88 4.15 -1.15 -2.69 115.11 122.51 1d5v h GLN 32 Ca 0.30 -0.10 0.00 0.00 0.77 0.00 0.00 58.65 59.63 1d5v h GLN 32 Cb 0.09 -0.28 -0.02 0.00 0.21 0.00 0.00 27.48 27.48 1d5v h GLN 32 CO -0.04 0.88 0.21 0.35 -1.93 0.00 0.00 178.83 178.29 1d5v h PHE 33 N 1.32 0.40 -0.02 3.99 3.57 -1.19 -1.59 116.94 123.43 1d5v h PHE 33 Ca 0.35 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.86 1d5v h PHE 33 Cb -0.11 -0.13 -0.00 0.00 2.79 0.00 0.00 35.95 38.49 1d5v h PHE 33 CO 0.00 0.26 0.01 0.82 -2.23 0.00 0.00 178.31 177.17 1d5v h ILE 34 N 0.43 1.01 -0.89 1.41 2.04 -1.31 -1.67 117.51 118.52 1d5v h ILE 34 Ca 0.12 -0.01 -0.02 0.00 1.00 0.00 0.00 64.86 65.94 1d5v h ILE 34 Cb -0.04 0.98 -0.04 0.00 -0.74 0.00 0.00 36.82 36.98 1d5v h ILE 34 CO -0.02 0.01 0.47 0.24 0.00 0.00 0.00 178.15 178.84 1d5v h MET 35 N 0.02 1.26 -0.90 2.37 2.86 -1.42 -1.12 114.93 118.00 1d5v h MET 35 Ca 0.01 -0.16 -0.02 0.00 -2.06 0.00 0.00 59.70 57.47 1d5v h MET 35 Cb -0.00 -0.24 -0.04 0.00 0.06 0.00 0.00 31.60 31.38 1d5v h MET 35 CO -0.00 0.93 0.49 -0.44 1.06 0.00 0.00 176.91 178.95 1d5v h ASP 36 N 1.26 1.13 0.00 1.22 3.32 -0.95 -3.34 116.42 119.05 1d5v h ASP 36 Ca 0.31 -0.10 -0.00 0.00 0.02 0.00 0.00 57.03 57.26 1d5v h ASP 36 Cb 0.06 -0.29 0.00 0.00 0.22 0.00 0.00 39.33 39.32 1d5v h ASP 36 CO -0.05 0.91 -0.00 0.03 -1.72 0.00 0.00 179.24 178.41 1d5v h ARG 37 N 1.26 -0.00 -5.37 3.56 2.47 -0.93 -3.44 114.38 111.93 1d5v h ARG 37 Ca 0.32 0.00 -0.63 0.00 -1.26 0.00 0.00 59.98 58.40 1d5v h ARG 37 Cb 0.03 0.00 -0.14 0.00 -1.65 0.00 0.00 29.97 28.22 1d5v h ARG 37 CO -0.05 -0.00 0.05 -0.06 0.56 0.00 0.00 179.97 180.47 1d5v s PHE 38 N -1.13 3.18 -1.22 3.04 0.40 -0.46 -4.94 117.98 116.86 1d5v s PHE 38 Ca -0.00 0.34 0.29 0.00 -0.60 0.00 0.00 56.93 56.96 1d5v s PHE 38 Cb 0.00 -2.99 1.37 0.00 0.51 0.00 0.00 43.02 41.91 1d5v s PHE 38 CO 0.00 -0.54 1.98 -0.35 0.70 0.00 0.00 175.22 177.02 1d5v n PRO 39 N 5.85 0.22 -0.38 0.24 -0.04 -1.26 -3.77 135.00 135.86 1d5v n PRO 39 Ca -0.03 0.01 -0.02 0.00 -0.04 0.00 0.00 63.50 63.42 1d5v n PRO 39 Cb 0.49 -1.50 0.11 0.00 -0.04 0.00 0.00 33.50 32.56 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 0.00 1.26 0.00 0.54 0.04 -1.92 -1.81 116.94 115.06 1d5v h PHE 40 Ca 0.00 0.03 -0.06 0.00 2.80 0.00 0.00 57.97 60.74 1d5v h PHE 40 Cb 0.39 -0.43 -0.01 0.00 2.20 0.00 0.00 35.95 38.10 1d5v h PHE 40 CO 0.00 0.79 -0.27 1.88 -0.60 0.00 0.00 178.31 180.12 1d5v h TYR 41 N 1.36 0.00 -1.01 -0.55 -1.99 -1.84 -2.88 116.97 110.07 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 -0.15 0.00 -0.05 0.00 2.00 0.00 0.00 36.73 38.53 1d5v h TYR 41 CO -0.00 0.27 0.67 0.00 -0.00 0.00 0.00 178.16 179.09 1d5v h ARG 42 N 0.00 1.33 0.00 4.88 3.08 -1.54 0.11 114.38 122.24 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 0.60 -0.30 0.00 0.00 0.08 0.00 0.00 29.97 30.35 1d5v h ARG 42 CO 0.03 0.88 0.00 -1.91 -1.07 0.00 0.00 179.97 177.90 1d5v n GLU 43 N -4.38 0.04 -3.51 0.04 4.07 -1.09 -4.27 120.64 111.54 1d5v n GLU 43 Ca 0.12 0.20 -0.27 0.00 -0.06 0.00 0.00 57.16 57.15 1d5v n GLU 43 Cb 0.01 -1.50 -0.14 0.00 -0.06 0.00 0.00 31.44 29.75 1d5v n GLU 43 CO 0.00 0.00 0.00 1.21 -0.06 0.00 0.00 177.13 178.28 1d5v s ASN 44 N -2.93 3.12 0.02 4.31 3.84 0.39 -4.99 114.94 118.70 1d5v s ASN 44 Ca 0.09 -1.22 0.21 0.00 0.21 0.00 0.00 52.86 52.16 1d5v s ASN 44 Cb 0.11 -0.17 -0.23 0.00 -0.55 0.00 0.00 41.25 40.41 1d5v s ASN 44 CO 0.30 -0.42 0.61 0.29 -2.79 0.00 0.00 177.10 175.08 1d5v n LYS 45 N 5.21 0.65 -3.32 0.43 5.02 -1.21 -4.69 118.16 120.24 1d5v n LYS 45 Ca -0.04 -0.06 -0.38 0.00 -2.02 0.00 0.00 58.31 55.80 1d5v n LYS 45 Cb 0.43 -1.62 -0.06 0.00 -0.02 0.00 0.00 35.03 33.76 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 -3.33 4.20 0.00 1.97 1.11 -1.26 -3.82 119.66 118.53 1d5v s GLN 46 Ca -0.06 0.60 0.00 0.00 0.01 0.00 0.00 55.36 55.91 1d5v s GLN 46 Cb 0.12 -3.31 0.00 0.00 -1.01 0.00 0.00 33.01 28.81 1d5v s GLN 46 CO 0.86 0.47 0.00 0.41 0.01 0.00 0.00 175.29 177.04 1d5v n GLY 47 N 2.29 2.05 0.32 3.09 0.00 -1.26 -4.72 105.19 106.96 1d5v n GLY 47 Ca -0.09 -0.66 -0.02 0.00 0.00 0.00 0.00 46.02 45.25 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 0.92 0.02 1.61 5.08 -1.87 -2.49 115.95 119.22 1d5v h TRP 48 Ca 0.00 -0.05 0.00 0.00 1.08 0.00 0.00 58.89 59.92 1d5v h TRP 48 Cb 0.00 -0.29 -0.00 0.00 -3.00 0.00 0.00 29.16 25.87 1d5v h TRP 48 CO 0.00 0.70 -0.02 0.37 -1.28 0.00 0.00 178.44 178.21 1d5v h GLN 49 N 0.91 -0.04 -0.24 0.12 4.15 -1.85 -3.03 115.11 115.13 1d5v h GLN 49 Ca 0.22 0.00 -0.17 0.00 0.77 0.00 0.00 58.65 59.47 1d5v h GLN 49 Cb 0.15 0.01 -0.00 0.00 0.21 0.00 0.00 27.48 27.84 1d5v h GLN 49 CO -0.02 -0.03 -0.54 -0.91 -1.93 0.00 0.00 178.83 175.39 1d5v h ASN 50 N -0.04 0.80 -1.00 -0.69 2.35 -1.82 -3.29 115.58 111.88 1d5v h ASN 50 Ca -0.00 -0.42 0.01 0.00 -0.55 0.00 0.00 56.30 55.34 1d5v h ASN 50 Cb 0.04 -0.23 -0.05 0.00 0.05 0.00 0.00 38.32 38.13 1d5v h ASN 50 CO -0.00 1.18 0.66 0.28 -1.65 0.00 0.00 177.43 177.90 1d5v h SER 51 N 0.55 1.15 0.00 5.81 0.02 -1.39 -1.14 113.55 118.55 1d5v h SER 51 Ca 0.01 -0.03 -0.00 0.00 -0.84 0.00 0.00 61.79 60.93 1d5v h SER 51 Cb 1.12 -0.29 0.00 0.00 0.14 0.00 0.00 62.40 63.37 1d5v h SER 51 CO 0.11 0.83 -0.00 0.40 -1.14 0.00 0.00 176.83 177.03 1d5v h ILE 52 N 1.35 1.08 0.00 3.27 2.04 -1.60 0.43 117.51 124.08 1d5v h ILE 52 Ca 0.37 -0.22 -0.09 0.00 1.00 0.00 0.00 64.86 65.92 1d5v h ILE 52 Cb -0.15 1.23 -0.01 0.00 -0.74 0.00 0.00 36.82 37.14 1d5v h ILE 52 CO -0.08 0.06 -0.43 0.08 0.00 0.00 0.00 178.15 177.78 1d5v h ARG 53 N -0.10 0.00 -0.29 2.37 0.11 -1.64 -2.04 114.38 112.79 1d5v h ARG 53 Ca -0.00 0.00 -0.14 0.00 0.10 0.00 0.00 59.98 59.94 1d5v h ARG 53 Cb 0.09 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 31.17 1d5v h ARG 53 CO 0.00 0.43 -0.40 1.25 0.10 0.00 0.00 179.97 181.35 1d5v h HIS 54 N 0.00 0.82 -0.62 4.08 2.76 -0.78 -2.59 115.15 118.83 1d5v h HIS 54 Ca -0.00 -0.24 -0.00 0.00 -2.20 0.00 0.00 60.37 57.92 1d5v h HIS 54 Cb 0.79 -0.17 -0.03 0.00 1.55 0.00 0.00 27.41 29.54 1d5v h HIS 54 CO 0.00 0.98 0.37 -0.91 -1.30 0.00 0.00 177.93 177.07 1d5v h ASN 55 N 0.57 0.73 -0.81 3.26 -0.26 0.52 -2.46 115.58 117.13 1d5v h ASN 55 Ca 0.05 -0.04 0.01 0.00 -0.56 0.00 0.00 56.30 55.76 1d5v h ASN 55 Cb 0.93 -0.18 -0.04 0.00 -1.06 0.00 0.00 38.32 37.97 1d5v h ASN 55 CO 0.08 0.56 0.54 -0.07 -1.06 0.00 0.00 177.43 177.48 1d5v h LEU 56 N 0.85 0.93 -0.32 1.61 3.38 -1.00 0.16 115.31 120.92 1d5v h LEU 56 Ca 0.22 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.17 1d5v h LEU 56 Cb -0.04 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 40.46 1d5v h LEU 56 CO -0.04 0.67 0.21 -1.28 0.09 0.00 0.00 178.44 178.09 1d5v h SER 57 N 1.09 0.36 -0.19 -0.43 0.87 -1.41 -2.60 113.55 111.26 1d5v h SER 57 Ca 0.30 -0.01 -0.15 0.00 -1.23 0.00 0.00 61.79 60.69 1d5v h SER 57 Cb -0.13 -0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 61.73 1d5v h SER 57 CO -0.06 0.27 -0.43 -0.07 -0.53 0.00 0.00 176.83 176.00 1d5v h LEU 58 N 0.43 0.79 -8.85 2.23 4.07 -1.44 -3.40 115.31 109.14 1d5v h LEU 58 Ca 0.12 -0.37 -0.57 0.00 0.08 0.00 0.00 57.88 57.14 1d5v h LEU 58 Cb -0.05 -0.22 -0.05 0.00 1.08 0.00 0.00 40.66 41.42 1d5v h LEU 58 CO -0.02 1.11 1.02 0.20 -1.08 0.00 0.00 178.44 179.67 1d5v s ASN 59 N -6.87 6.49 0.00 -0.43 0.01 0.54 -4.84 114.94 109.85 1d5v s ASN 59 Ca -0.09 0.94 0.26 0.00 -0.71 0.00 0.00 52.86 53.26 1d5v s ASN 59 Cb 0.12 -2.54 0.66 0.00 0.41 0.00 0.00 41.25 39.90 1d5v s ASN 59 CO 0.85 -1.28 1.52 -0.62 -1.51 0.00 0.00 177.10 176.07 1d5v n GLU 60 N 7.76 0.03 -0.12 -0.60 -0.58 -1.26 -3.89 120.64 121.98 1d5v n GLU 60 Ca 0.15 -0.02 0.02 0.00 -0.42 0.00 0.00 57.16 56.90 1d5v n GLU 60 Cb 0.48 -1.50 0.33 0.00 -0.57 0.00 0.00 31.44 30.17 1d5v n GLU 60 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1d5v s PHE 62 N -5.68 3.36 -0.10 0.00 0.08 -1.25 -4.50 117.98 109.89 1d5v s PHE 62 Ca -0.10 1.66 0.03 0.00 0.12 0.00 0.00 56.93 58.65 1d5v s PHE 62 Cb 0.18 -2.97 -0.00 0.00 -0.57 0.00 0.00 43.02 39.65 1d5v s PHE 62 CO 0.76 -0.25 -0.21 0.08 -0.10 0.00 0.00 175.22 175.50 1d5v s VAL 63 N -1.86 2.32 0.65 -0.44 1.01 -1.21 -5.04 120.40 115.82 1d5v s VAL 63 Ca 0.58 -0.93 -0.12 0.00 0.00 0.00 0.00 61.98 61.51 1d5v s VAL 63 Cb -0.16 -1.90 -0.02 0.00 0.00 0.00 0.00 36.38 34.30 1d5v s VAL 63 CO 0.21 0.55 1.05 -0.54 0.00 0.00 0.00 175.10 176.37 1d5v s LYS 64 N 0.28 3.21 -0.45 2.72 1.02 -1.26 -3.06 119.74 122.20 1d5v s LYS 64 Ca -0.15 0.96 0.03 0.00 0.02 0.00 0.00 55.97 56.82 1d5v s LYS 64 Cb -0.17 -2.03 0.16 0.00 -0.52 0.00 0.00 37.83 35.27 1d5v s LYS 64 CO 0.08 -0.88 0.31 0.08 -0.92 0.00 0.00 175.35 174.02 1d5v s VAL 65 N -2.94 0.92 0.21 3.17 1.01 -0.33 -4.92 120.40 117.52 1d5v s VAL 65 Ca 0.58 -2.69 -0.31 0.00 0.00 0.00 0.00 61.98 59.56 1d5v s VAL 65 Cb -0.13 -1.64 -0.15 0.00 0.00 0.00 0.00 36.38 34.45 1d5v s VAL 65 CO 0.50 -1.08 1.09 -2.65 0.00 0.00 0.00 175.10 172.97 1d5v n PRO 66 N 3.11 1.17 -3.22 2.72 -0.02 -1.26 -2.90 135.00 134.59 1d5v n PRO 66 Ca 0.20 0.41 -0.32 0.00 -2.02 0.00 0.00 63.50 61.77 1d5v n PRO 66 Cb 0.41 -1.86 -0.06 0.00 -0.02 0.00 0.00 33.50 31.97 1d5v n PRO 66 CO 0.00 0.00 0.00 -0.98 1.98 0.00 0.00 175.50 176.50 1d5v s ARG 67 N -0.72 3.95 0.35 -0.52 1.70 -1.26 -4.94 118.95 117.50 1d5v s ARG 67 Ca 0.69 0.55 -0.28 0.00 -0.47 0.00 0.00 55.73 56.22 1d5v s ARG 67 Cb -0.81 -2.51 -0.11 0.00 -0.57 0.00 0.00 34.95 30.95 1d5v s ARG 67 CO 0.54 0.21 1.46 -0.51 -1.08 0.00 0.00 175.30 175.92 1d5v s ASP 68 N -2.28 6.46 0.19 -2.89 1.01 -1.26 -4.90 116.67 113.00 1d5v s ASP 68 Ca 0.52 2.94 -0.09 0.00 0.71 0.00 0.00 52.55 56.63 1d5v s ASP 68 Cb -0.11 -2.66 0.09 0.00 1.01 0.00 0.00 42.92 41.26 1d5v s ASP 68 CO 0.19 -0.79 1.68 0.44 0.21 0.00 0.00 175.17 176.89 1d5v h ASP 69 N 3.37 1.08 -0.77 0.27 3.32 -2.03 -2.97 116.42 118.69 1d5v h ASP 69 Ca -0.50 -0.27 -0.05 0.00 0.02 0.00 0.00 57.03 56.23 1d5v h ASP 69 Cb 1.23 -0.29 -0.03 0.00 0.22 0.00 0.00 39.33 40.46 1d5v h ASP 69 CO 0.67 1.08 0.27 0.11 -1.72 0.00 0.00 179.24 179.64 1d5v h LYS 70 N 1.04 1.17 -5.63 3.56 1.57 -2.05 -3.39 116.57 112.83 1d5v h LYS 70 Ca 0.20 -0.23 -0.62 0.00 -1.87 0.00 0.00 60.65 58.13 1d5v h LYS 70 Cb 0.47 -0.18 -0.12 0.00 0.08 0.00 0.00 32.23 32.49 1d5v h LYS 70 CO 0.02 0.98 0.26 0.21 -0.57 0.00 0.00 179.45 180.35 1d5v s LYS 71 N -5.48 3.83 -0.55 3.15 2.20 -1.12 -5.00 119.74 116.76 1d5v s LYS 71 Ca -0.12 0.31 -0.28 0.00 -0.36 0.00 0.00 55.97 55.52 1d5v s LYS 71 Cb 0.15 -3.77 0.02 0.00 -1.51 0.00 0.00 37.83 32.72 1d5v s LYS 71 CO 0.84 -0.71 1.36 -1.25 -0.36 0.00 0.00 175.35 175.23 1d5v s PRO 72 N 2.84 3.38 0.00 4.03 0.04 -1.26 -4.45 135.00 139.57 1d5v s PRO 72 Ca 0.28 0.45 0.00 0.00 0.04 0.00 0.00 61.00 61.77 1d5v s PRO 72 Cb -0.14 -4.09 0.00 0.00 0.04 0.00 0.00 34.50 30.31 1d5v s PRO 72 CO 0.14 -1.84 0.00 0.41 0.04 0.00 0.00 177.00 175.75 1d5v n GLY 73 N 5.19 2.07 1.49 0.56 0.00 -1.26 -5.01 105.19 108.23 1d5v n GLY 73 Ca 0.12 -2.03 0.08 0.00 0.00 0.00 0.00 46.02 44.19 1d5v n GLY 73 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1d5v n LYS 74 N 0.00 4.10 0.00 1.61 4.76 -1.26 -5.06 118.16 122.31 1d5v n LYS 74 Ca 0.00 -3.03 0.00 0.00 -2.87 0.00 0.00 58.31 52.41 1d5v n LYS 74 Cb 0.00 -2.09 0.00 0.00 -1.84 0.00 0.00 35.03 31.10 1d5v n LYS 74 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1d5v n GLY 75 N 0.19 -0.02 3.79 0.72 0.00 -1.26 -4.92 105.19 103.69 1d5v n GLY 75 Ca 0.25 -2.26 -0.36 0.00 0.00 0.00 0.00 46.02 43.65 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 -4.00 7.12 0.29 1.61 0.15 -1.26 -4.51 113.70 113.09 1d5v s SER 76 Ca 0.00 1.88 0.07 0.00 0.70 0.00 0.00 55.95 58.60 1d5v s SER 76 Cb 0.00 -2.58 -0.03 0.00 -1.71 0.00 0.00 66.02 61.70 1d5v s SER 76 CO 0.00 -0.23 0.28 -0.31 1.20 0.00 0.00 173.24 174.19 1d5v s TYR 77 N -1.70 3.10 -0.03 3.44 2.02 -1.14 -4.19 117.35 118.85 1d5v s TYR 77 Ca 0.54 -0.17 0.06 0.00 -0.37 0.00 0.00 57.07 57.14 1d5v s TYR 77 Cb -0.18 -1.62 -0.02 0.00 -0.40 0.00 0.00 41.96 39.74 1d5v s TYR 77 CO 0.24 0.34 -0.22 -1.58 -1.57 0.00 0.00 175.55 172.76 1d5v s TRP 78 N -2.17 2.46 0.07 2.71 0.52 -0.11 -1.19 118.94 121.24 1d5v s TRP 78 Ca 0.37 -0.34 -0.06 0.00 0.02 0.00 0.00 56.10 56.09 1d5v s TRP 78 Cb -0.08 -1.54 -0.02 0.00 -1.15 0.00 0.00 33.47 30.68 1d5v s TRP 78 CO 0.27 0.04 0.10 -0.08 0.02 0.00 0.00 176.95 177.30 1d5v s THR 79 N -0.65 0.17 0.69 2.01 -1.32 -1.17 -3.44 115.64 111.93 1d5v s THR 79 Ca 0.11 -1.43 -0.11 0.00 -1.21 0.00 0.00 61.69 59.04 1d5v s THR 79 Cb -0.10 -1.41 0.00 0.00 -1.51 0.00 0.00 72.50 69.49 1d5v s THR 79 CO -0.00 -0.79 1.06 -0.76 -2.21 0.00 0.00 174.62 171.91 1d5v s LEU 80 N -2.88 3.05 0.81 9.08 1.43 -1.26 -3.31 118.68 125.61 1d5v s LEU 80 Ca 0.06 1.46 -0.12 0.00 -1.03 0.00 0.00 54.13 54.49 1d5v s LEU 80 Cb 0.06 -4.34 0.09 0.00 0.03 0.00 0.00 46.19 42.03 1d5v s LEU 80 CO -0.11 -1.35 1.17 -1.81 0.23 0.00 0.00 176.35 174.49 1d5v s ASP 81 N -3.98 3.67 0.00 2.29 1.01 -1.26 -4.88 116.67 113.51 1d5v s ASP 81 Ca 0.58 2.24 0.00 0.00 0.71 0.00 0.00 52.55 56.07 1d5v s ASP 81 Cb -0.13 -2.57 0.00 0.00 1.01 0.00 0.00 42.92 41.23 1d5v s ASP 81 CO 0.54 -2.61 0.00 -2.65 0.21 0.00 0.00 175.17 170.66 1d5v n PRO 82 N -3.45 2.10 -0.08 8.23 -0.02 -1.26 -4.64 135.00 135.89 1d5v n PRO 82 Ca 0.12 0.00 -0.09 0.00 -2.02 0.00 0.00 63.50 61.51 1d5v n PRO 82 Cb 0.51 0.00 -0.02 0.00 -0.02 0.00 0.00 33.50 33.97 1d5v n PRO 82 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1d5v h ASP 83 N 0.00 0.31 0.00 2.55 3.32 -2.06 -3.42 116.42 117.13 1d5v h ASP 83 Ca 0.00 -0.01 -0.03 0.00 0.02 0.00 0.00 57.03 57.02 1d5v h ASP 83 Cb 0.00 -0.08 -0.03 0.00 0.22 0.00 0.00 39.33 39.44 1d5v h ASP 83 CO 0.00 0.23 0.12 -0.24 -1.72 0.00 0.00 179.24 177.63 1d5v n SER 84 N -4.90 -0.43 -0.31 6.45 2.88 -1.26 -4.93 113.62 111.11 1d5v n SER 84 Ca -0.02 -1.22 -0.04 0.00 -1.33 0.00 0.00 58.87 56.26 1d5v n SER 84 Cb 0.03 0.43 0.09 0.00 -0.75 0.00 0.00 64.21 64.01 1d5v n SER 84 CO 0.00 0.00 0.00 0.22 -1.23 0.00 0.00 175.04 174.03 1d5v h TYR 85 N 0.43 1.22 0.00 0.66 3.20 -1.88 -3.28 116.97 117.32 1d5v h TYR 85 Ca -0.28 -0.05 -0.09 0.00 3.14 0.00 0.00 58.73 61.45 1d5v h TYR 85 Cb 1.10 -0.38 -0.21 0.00 1.54 0.00 0.00 36.73 38.78 1d5v h TYR 85 CO -0.15 0.87 -0.75 -1.71 -1.64 0.00 0.00 178.16 174.78 1d5v n ASN 86 N -4.31 1.02 -0.29 -2.11 4.05 -1.26 -4.81 115.26 107.54 1d5v n ASN 86 Ca 0.09 -2.43 0.00 0.00 0.45 0.00 0.00 54.58 52.68 1d5v n ASN 86 Cb 0.13 -0.33 0.00 0.00 1.23 0.00 0.00 39.78 40.81 1d5v n ASN 86 CO 0.00 0.00 0.00 0.23 -3.05 0.00 0.00 177.26 174.44 1d5v n MET 87 N -0.05 0.69 -0.77 1.20 2.81 -1.24 -3.70 117.12 116.07 1d5v n MET 87 Ca 0.08 0.00 -0.14 0.00 -1.81 0.00 0.00 57.70 55.82 1d5v n MET 87 Cb 0.93 -1.20 0.06 0.00 -0.71 0.00 0.00 33.22 32.30 1d5v n MET 87 CO 0.00 0.00 0.00 1.19 1.51 0.00 0.00 175.97 178.67 1d5v n PHE 88 N -0.12 1.51 -1.16 2.03 3.01 -1.26 -4.84 117.46 116.61 1d5v n PHE 88 Ca 0.00 -1.63 -0.28 0.00 1.01 0.00 0.00 57.45 56.55 1d5v n PHE 88 Cb 0.10 -0.80 0.18 0.00 -0.01 0.00 0.00 39.48 38.95 1d5v n PHE 88 CO 0.00 0.00 0.00 -1.83 1.01 0.00 0.00 176.76 175.94 1d5v s GLU 89 N -1.71 0.31 0.00 -1.08 -1.05 -1.24 -4.83 118.70 109.10 1d5v s GLU 89 Ca 0.29 0.48 0.08 0.00 -0.15 0.00 0.00 54.97 55.67 1d5v s GLU 89 Cb 0.24 -1.73 0.48 0.00 -0.44 0.00 0.00 34.13 32.68 1d5v s GLU 89 CO 0.02 -2.80 0.91 0.27 0.95 0.00 0.00 175.26 174.61 1d5v n ASN 90 N -4.22 0.00 -0.78 0.83 0.23 -1.26 -4.57 115.26 105.49 1d5v n ASN 90 Ca 0.05 -0.34 0.00 0.00 -0.53 0.00 0.00 54.58 53.76 1d5v n ASN 90 Cb 0.57 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 38.27 1d5v n ASN 90 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1d5v n GLY 91 N -0.37 1.52 3.33 4.83 0.00 -1.26 -5.13 105.19 108.10 1d5v n GLY 91 Ca 0.06 -1.69 0.02 0.00 0.00 0.00 0.00 46.02 44.41 1d5v n GLY 91 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1d5v s SER 92 N -1.00 -0.37 -0.02 1.61 0.01 -1.26 -5.06 113.70 107.60 1d5v s SER 92 Ca 0.00 0.51 -0.28 0.00 1.31 0.00 0.00 55.95 57.50 1d5v s SER 92 Cb 0.00 1.42 -0.03 0.00 0.21 0.00 0.00 66.02 67.61 1d5v s SER 92 CO 0.00 -0.07 0.89 0.12 0.41 0.00 0.00 173.24 174.59 1d5v s PHE 93 N 2.25 3.64 -2.00 2.43 5.36 -1.26 -5.19 117.98 123.21 1d5v s PHE 93 Ca -0.02 1.56 0.18 0.00 -0.96 0.00 0.00 56.93 57.69 1d5v s PHE 93 Cb -0.04 -3.02 1.07 0.00 -0.34 0.00 0.00 43.02 40.69 1d5v s PHE 93 CO -0.17 0.02 1.47 -0.11 -1.46 0.00 0.00 175.22 174.97