#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 3.56 0.17 3.17 1.43 -1.26 -5.08 118.68 120.67 1d5v s LEU 2 Ca 0.00 1.57 0.06 0.00 -1.03 0.00 0.00 54.13 54.73 1d5v s LEU 2 Cb 0.00 -4.51 -0.05 0.00 0.03 0.00 0.00 46.19 41.67 1d5v s LEU 2 CO 0.00 -0.67 -0.11 0.68 0.23 0.00 0.00 176.35 176.47 1d5v s VAL 3 N -2.68 1.36 0.05 -1.59 -7.23 -1.26 -5.09 120.40 103.95 1d5v s VAL 3 Ca 0.59 -2.11 -0.30 0.00 -1.81 0.00 0.00 61.98 58.34 1d5v s VAL 3 Cb -0.11 -1.92 -0.09 0.00 0.56 0.00 0.00 36.38 34.82 1d5v s VAL 3 CO 0.35 -0.70 1.95 2.29 -0.31 0.00 0.00 175.10 178.68 1d5v n LYS 4 N -0.26 2.83 -1.11 4.82 2.85 -1.26 -4.90 118.16 121.12 1d5v n LYS 4 Ca -0.09 1.04 -0.37 0.00 -1.05 0.00 0.00 58.31 57.83 1d5v n LYS 4 Cb 0.61 -2.98 0.04 0.00 -0.65 0.00 0.00 35.03 32.05 1d5v n LYS 4 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 177.40 175.05 1d5v n PRO 5 N 7.18 0.03 0.00 -1.58 -0.02 -1.26 -4.79 135.00 134.57 1d5v n PRO 5 Ca 0.20 0.02 0.09 0.00 -2.02 0.00 0.00 63.50 61.79 1d5v n PRO 5 Cb 0.40 -1.19 0.54 0.00 -0.02 0.00 0.00 33.50 33.23 1d5v n PRO 5 CO 0.00 0.00 0.00 -0.35 1.98 0.00 0.00 175.50 177.13 1d5v n PRO 6 N 1.35 0.66 -2.78 0.52 -0.04 -1.26 -4.77 135.00 128.68 1d5v n PRO 6 Ca 0.04 0.00 -0.41 0.00 -0.04 0.00 0.00 63.50 63.09 1d5v n PRO 6 Cb 0.52 -1.43 -0.04 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 -2.00 3.75 0.95 0.54 2.02 -1.26 -5.03 117.35 116.32 1d5v s TYR 7 Ca 0.27 1.70 -0.12 0.00 -0.37 0.00 0.00 57.07 58.55 1d5v s TYR 7 Cb 0.13 -3.03 0.16 0.00 -0.40 0.00 0.00 41.96 38.82 1d5v s TYR 7 CO 0.21 0.15 1.09 -1.12 -1.57 0.00 0.00 175.55 174.31 1d5v s SER 8 N 0.31 2.97 0.25 2.29 0.01 -1.26 -4.76 113.70 113.51 1d5v s SER 8 Ca 0.47 1.36 -0.06 0.00 1.31 0.00 0.00 55.95 59.02 1d5v s SER 8 Cb -0.22 -2.03 0.27 0.00 0.21 0.00 0.00 66.02 64.25 1d5v s SER 8 CO 0.28 -2.94 1.93 1.88 0.41 0.00 0.00 173.24 174.80 1d5v h TYR 9 N -1.76 1.27 -0.57 2.43 0.05 -1.97 -1.92 116.97 114.50 1d5v h TYR 9 Ca -0.52 0.03 -0.08 0.00 0.05 0.00 0.00 58.73 58.21 1d5v h TYR 9 Cb 1.31 -0.43 -0.02 0.00 1.01 0.00 0.00 36.73 38.60 1d5v h TYR 9 CO 0.36 0.79 0.04 0.82 -1.05 0.00 0.00 178.16 179.12 1d5v h ILE 10 N 1.36 1.26 -0.73 -2.88 2.04 -1.97 -2.96 117.51 113.63 1d5v h ILE 10 Ca 0.37 -1.07 -0.06 0.00 1.00 0.00 0.00 64.86 65.10 1d5v h ILE 10 Cb -0.15 0.83 -0.03 0.00 -0.74 0.00 0.00 36.82 36.73 1d5v h ILE 10 CO -0.08 0.39 0.21 0.00 0.00 0.00 0.00 178.15 178.67 1d5v h ALA 11 N 0.98 0.99 -1.00 1.87 0.00 -1.76 -1.41 119.26 118.93 1d5v h ALA 11 Ca 0.17 -0.23 0.01 0.00 0.00 0.00 0.00 54.91 54.86 1d5v h ALA 11 Cb 0.50 -0.28 -0.05 0.00 0.00 0.00 0.00 17.79 17.95 1d5v h ALA 11 CO 0.02 0.67 0.66 -0.07 0.00 0.00 0.00 179.25 180.53 1d5v h LEU 12 N 1.09 1.14 -0.38 0.00 3.38 -1.22 0.17 115.31 119.49 1d5v h LEU 12 Ca 0.23 -0.03 -0.16 0.00 0.09 0.00 0.00 57.88 58.01 1d5v h LEU 12 Cb 0.33 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 1d5v h LEU 12 CO -0.00 0.82 -0.40 0.40 0.09 0.00 0.00 178.44 179.35 1d5v h ILE 13 N 1.34 1.27 -0.67 1.22 2.04 -1.32 -1.72 117.51 119.68 1d5v h ILE 13 Ca 0.37 -1.57 -0.06 0.00 1.00 0.00 0.00 64.86 64.60 1d5v h ILE 13 Cb -0.14 1.39 -0.03 0.00 -0.74 0.00 0.00 36.82 37.31 1d5v h ILE 13 CO -0.08 0.53 0.19 0.74 0.00 0.00 0.00 178.15 179.52 1d5v h THR 14 N 0.77 1.26 -0.26 -0.27 2.02 -0.52 -2.46 112.91 113.44 1d5v h THR 14 Ca 0.06 -0.91 -0.15 0.00 0.77 0.00 0.00 66.41 66.18 1d5v h THR 14 Cb 1.00 0.57 -0.01 0.00 -1.74 0.00 0.00 68.15 67.97 1d5v h THR 14 CO 0.10 0.35 -0.44 0.24 0.37 0.00 0.00 175.52 176.14 1d5v h MET 15 N 0.99 0.65 -0.39 6.66 2.86 -0.93 -2.78 114.93 121.99 1d5v h MET 15 Ca 0.21 -0.35 0.03 0.00 -2.06 0.00 0.00 59.70 57.53 1d5v h MET 15 Cb 0.33 0.02 -0.03 0.00 0.06 0.00 0.00 31.60 31.97 1d5v h MET 15 CO -0.00 0.96 0.19 0.00 1.06 0.00 0.00 176.91 179.12 1d5v h ALA 16 N 0.99 0.48 -0.00 6.32 0.00 -1.00 0.62 119.26 126.66 1d5v h ALA 16 Ca 0.04 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1d5v h ALA 16 Cb 0.97 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.71 1d5v h ALA 16 CO 0.09 -0.18 0.00 0.82 0.00 0.00 0.00 179.25 179.98 1d5v h ILE 17 N 0.39 1.00 -0.89 0.00 2.04 -1.38 0.38 117.51 119.04 1d5v h ILE 17 Ca 0.17 -0.01 -0.02 0.00 1.00 0.00 0.00 64.86 66.00 1d5v h ILE 17 Cb 0.08 1.01 -0.04 0.00 -0.74 0.00 0.00 36.82 37.13 1d5v h ILE 17 CO -0.12 0.00 0.48 1.56 0.00 0.00 0.00 178.15 180.07 1d5v h GLN 18 N -0.00 1.25 0.00 2.37 1.08 -1.16 -1.71 115.11 116.95 1d5v h GLN 18 Ca 0.00 -0.15 0.00 0.00 -1.45 0.00 0.00 58.65 57.05 1d5v h GLN 18 Cb 0.00 -0.24 0.00 0.00 -0.05 0.00 0.00 27.48 27.19 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 0.01 -4.72 1.46 3.02 0.21 -4.79 115.26 106.13 1d5v n ASN 19 Ca 0.09 0.50 -0.42 0.00 -0.03 0.00 0.00 54.58 54.73 1d5v n ASN 19 Cb 0.10 -0.50 -0.03 0.00 -0.61 0.00 0.00 39.78 38.74 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 -3.00 3.23 0.37 5.41 0.00 0.13 -4.91 121.76 123.00 1d5v s ALA 20 Ca 0.14 0.62 0.20 0.00 0.00 0.00 0.00 51.96 52.92 1d5v s ALA 20 Cb 0.19 -3.34 1.24 0.00 0.00 0.00 0.00 23.12 21.20 1d5v s ALA 20 CO 0.53 -0.21 1.64 -1.35 0.00 0.00 0.00 175.76 176.36 1d5v h PRO 21 N 6.40 0.18 -5.93 0.00 0.11 -1.86 -3.36 132.00 127.54 1d5v h PRO 21 Ca -0.42 -0.01 -0.69 0.00 0.11 0.00 0.00 66.00 64.99 1d5v h PRO 21 Cb 1.22 -0.04 -0.32 0.00 0.11 0.00 0.00 31.00 31.97 1d5v h PRO 21 CO 0.75 0.12 -0.88 -1.21 -0.21 0.00 0.00 178.00 176.57 1d5v s GLU 22 N -5.54 2.61 0.40 1.05 0.41 -1.26 -5.02 118.70 111.36 1d5v s GLU 22 Ca -0.09 -0.90 0.06 0.00 -0.41 0.00 0.00 54.97 53.63 1d5v s GLU 22 Cb 0.31 -2.18 0.83 0.00 -1.78 0.00 0.00 34.13 31.31 1d5v s GLU 22 CO 0.79 0.36 2.05 0.87 -0.49 0.00 0.00 175.26 178.84 1d5v h LYS 23 N 6.15 0.59 -6.44 1.61 1.57 -1.78 -3.38 116.57 114.88 1d5v h LYS 23 Ca -0.30 -0.04 -0.57 0.00 -1.87 0.00 0.00 60.65 57.88 1d5v h LYS 23 Cb 1.18 -0.13 -0.06 0.00 0.08 0.00 0.00 32.23 33.30 1d5v h LYS 23 CO 0.47 0.39 0.93 0.15 -0.57 0.00 0.00 179.45 180.82 1d5v s LYS 24 N -5.53 3.89 0.16 3.15 1.02 -1.26 -4.36 119.74 116.81 1d5v s LYS 24 Ca -0.09 1.01 0.05 0.00 0.02 0.00 0.00 55.97 56.97 1d5v s LYS 24 Cb 0.17 -3.85 -0.05 0.00 -0.52 0.00 0.00 37.83 33.58 1d5v s LYS 24 CO 0.74 -1.15 -0.11 -1.50 -0.92 0.00 0.00 175.35 172.40 1d5v s ILE 25 N 4.27 1.35 0.53 2.17 2.07 -1.14 -4.86 121.20 125.58 1d5v s ILE 25 Ca 0.51 -2.11 -0.02 0.00 -1.41 0.00 0.00 60.65 57.62 1d5v s ILE 25 Cb -0.13 -1.91 0.01 0.00 0.13 0.00 0.00 42.46 40.56 1d5v s ILE 25 CO 0.23 -0.70 0.79 0.42 -1.91 0.00 0.00 174.94 173.77 1d5v s THR 26 N -3.22 3.57 0.09 4.00 -4.23 -1.26 -1.30 115.64 113.29 1d5v s THR 26 Ca 0.19 -0.34 -0.23 0.00 -1.18 0.00 0.00 61.69 60.13 1d5v s THR 26 Cb 0.02 -3.37 -0.15 0.00 1.34 0.00 0.00 72.50 70.34 1d5v s THR 26 CO 0.02 -0.31 1.73 0.25 -0.54 0.00 0.00 174.62 175.78 1d5v h LEU 27 N 0.09 -0.00 -0.86 4.79 5.85 -1.96 -2.26 115.31 120.95 1d5v h LEU 27 Ca -0.45 -0.00 -0.03 0.00 0.84 0.00 0.00 57.88 58.23 1d5v h LEU 27 Cb 1.26 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 42.26 1d5v h LEU 27 CO 0.58 0.00 0.41 0.78 -0.34 0.00 0.00 178.44 179.87 1d5v h ASN 28 N -0.01 1.12 -1.01 1.25 2.35 -1.98 -2.72 115.58 114.58 1d5v h ASN 28 Ca -0.00 -0.14 0.01 0.00 -0.55 0.00 0.00 56.30 55.62 1d5v h ASN 28 Cb 0.01 -0.29 -0.05 0.00 0.05 0.00 0.00 38.32 38.04 1d5v h ASN 28 CO 0.00 0.94 0.67 1.23 -1.65 0.00 0.00 177.43 178.62 1d5v h GLY 29 N 1.22 1.41 1.01 2.83 0.00 -1.86 -2.32 103.07 105.37 1d5v h GLY 29 Ca 0.29 -0.53 0.01 0.00 0.00 0.00 0.00 47.33 47.10 1d5v h GLY 29 CO -0.04 0.52 0.53 -2.22 0.00 0.00 0.00 176.54 175.33 1d5v h ILE 30 N 1.36 1.21 -0.93 2.60 2.04 -1.09 -2.01 117.51 120.69 1d5v h ILE 30 Ca 0.37 -0.38 0.01 0.00 1.00 0.00 0.00 64.86 65.86 1d5v h ILE 30 Cb -0.16 0.04 -0.05 0.00 -0.74 0.00 0.00 36.82 35.91 1d5v h ILE 30 CO -0.08 0.20 0.61 1.88 0.00 0.00 0.00 178.15 180.76 1d5v h TYR 31 N 1.08 1.16 -0.78 1.37 0.05 -1.38 -2.38 116.97 116.10 1d5v h TYR 31 Ca 0.29 0.03 0.01 0.00 0.05 0.00 0.00 58.73 59.11 1d5v h TYR 31 Cb -0.12 -0.39 -0.04 0.00 1.01 0.00 0.00 36.73 37.19 1d5v h TYR 31 CO -0.02 0.73 0.51 0.37 -1.05 0.00 0.00 178.16 178.70 1d5v h GLN 32 N 1.25 1.03 -0.10 4.88 4.15 -1.12 -2.57 115.11 122.63 1d5v h GLN 32 Ca 0.34 -0.07 0.00 0.00 0.77 0.00 0.00 58.65 59.70 1d5v h GLN 32 Cb -0.13 -0.23 -0.01 0.00 0.21 0.00 0.00 27.48 27.32 1d5v h GLN 32 CO -0.08 0.69 0.07 0.35 -1.93 0.00 0.00 178.83 177.92 1d5v h PHE 33 N 1.06 0.12 -0.00 3.99 3.57 -1.02 -1.87 116.94 122.79 1d5v h PHE 33 Ca 0.28 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.79 1d5v h PHE 33 Cb -0.11 -0.04 -0.00 0.00 2.79 0.00 0.00 35.95 38.58 1d5v h PHE 33 CO -0.02 0.08 0.00 0.82 -2.23 0.00 0.00 178.31 176.96 1d5v h ILE 34 N 0.14 1.01 -0.00 1.41 2.04 -1.27 0.96 117.51 121.80 1d5v h ILE 34 Ca 0.04 -0.02 0.00 0.00 1.00 0.00 0.00 64.86 65.88 1d5v h ILE 34 Cb -0.01 1.02 -0.00 0.00 -0.74 0.00 0.00 36.82 37.08 1d5v h ILE 34 CO -0.01 0.01 0.00 0.24 0.00 0.00 0.00 178.15 178.39 1d5v h MET 35 N -0.01 0.00 -0.44 2.37 2.86 -1.41 0.77 114.93 119.07 1d5v h MET 35 Ca 0.00 -0.00 -0.15 0.00 -2.06 0.00 0.00 59.70 57.49 1d5v h MET 35 Cb 0.01 -0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.66 1d5v h MET 35 CO -0.00 0.01 -0.29 -0.44 1.06 0.00 0.00 176.91 177.25 1d5v h ASP 36 N -0.01 1.03 -0.02 1.22 3.32 -1.24 -3.20 116.42 117.51 1d5v h ASP 36 Ca 0.00 -0.43 -0.00 0.00 0.02 0.00 0.00 57.03 56.62 1d5v h ASP 36 Cb 0.01 -0.29 -0.00 0.00 0.22 0.00 0.00 39.33 39.28 1d5v h ASP 36 CO -0.00 1.23 0.00 -0.09 -1.72 0.00 0.00 179.24 178.66 1d5v h ARG 37 N 0.83 0.03 -5.06 3.56 9.65 0.12 -3.42 114.38 120.09 1d5v h ARG 37 Ca 0.09 -0.01 -0.67 0.00 -1.10 0.00 0.00 59.98 58.29 1d5v h ARG 37 Cb 0.88 -0.00 -0.34 0.00 -1.39 0.00 0.00 29.97 29.12 1d5v h ARG 37 CO 0.08 0.33 -0.85 -0.06 2.80 0.00 0.00 179.97 182.27 1d5v s PHE 38 N -4.97 2.79 -1.25 2.20 0.08 0.26 -4.99 117.98 112.10 1d5v s PHE 38 Ca -0.15 -1.58 0.29 0.00 0.12 0.00 0.00 56.93 55.61 1d5v s PHE 38 Cb 0.03 -1.93 1.37 0.00 -0.57 0.00 0.00 43.02 41.92 1d5v s PHE 38 CO 0.67 -0.78 1.97 -0.35 -0.10 0.00 0.00 175.22 176.63 1d5v n PRO 39 N 4.61 0.24 -0.34 0.24 -0.04 -1.24 -3.75 135.00 134.72 1d5v n PRO 39 Ca -0.21 0.01 -0.03 0.00 -0.04 0.00 0.00 63.50 63.23 1d5v n PRO 39 Cb 0.50 -1.50 0.09 0.00 -0.04 0.00 0.00 33.50 32.55 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 1.15 0.00 0.54 3.57 -1.91 -2.19 116.94 118.10 1d5v h PHE 40 Ca 0.00 0.03 -0.06 0.00 3.53 0.00 0.00 57.97 61.47 1d5v h PHE 40 Cb 0.36 -0.39 -0.01 0.00 2.79 0.00 0.00 35.95 38.71 1d5v h PHE 40 CO 0.00 0.73 -0.26 1.88 -2.23 0.00 0.00 178.31 178.42 1d5v h TYR 41 N 1.24 0.00 -0.11 0.41 0.05 -1.87 -2.42 116.97 114.27 1d5v h TYR 41 Ca 0.34 0.00 0.03 0.00 0.05 0.00 0.00 58.73 59.15 1d5v h TYR 41 Cb -0.14 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 37.59 1d5v h TYR 41 CO -0.01 0.26 0.11 0.00 -1.05 0.00 0.00 178.16 177.48 1d5v h ARG 42 N 0.00 0.00 -0.07 4.88 3.08 -1.61 0.30 114.38 120.96 1d5v h ARG 42 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1d5v h ARG 42 Cb 0.54 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.59 1d5v h ARG 42 CO 0.03 0.00 0.00 0.39 -1.07 0.00 0.00 179.97 179.32 1d5v n GLU 43 N -3.91 1.62 -3.40 0.04 1.02 -0.91 -4.65 120.64 110.44 1d5v n GLU 43 Ca -0.00 -0.91 -0.16 0.00 -0.02 0.00 0.00 57.16 56.07 1d5v n GLU 43 Cb 0.22 -1.44 -0.10 0.00 -0.02 0.00 0.00 31.44 30.10 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 -1.82 1.40 -0.07 1.62 2.47 0.11 -5.05 114.94 113.59 1d5v s ASN 44 Ca 0.36 -0.56 -0.04 0.00 0.42 0.00 0.00 52.86 53.04 1d5v s ASN 44 Cb 0.19 0.60 -0.01 0.00 -1.45 0.00 0.00 41.25 40.58 1d5v s ASN 44 CO 0.31 -0.37 -0.08 0.11 -3.72 0.00 0.00 177.10 173.34 1d5v h LYS 45 N 8.25 0.00 -6.95 0.43 1.57 -1.83 -3.44 116.57 114.60 1d5v h LYS 45 Ca -0.14 0.00 -0.51 0.00 -1.87 0.00 0.00 60.65 58.13 1d5v h LYS 45 Cb 1.10 0.00 0.06 0.00 0.08 0.00 0.00 32.23 33.46 1d5v h LYS 45 CO 0.32 0.00 0.51 -0.65 -0.57 0.00 0.00 179.45 179.06 1d5v s GLN 46 N -1.61 4.03 0.00 3.15 -0.21 -1.26 -3.38 119.66 120.38 1d5v s GLN 46 Ca -0.07 1.87 0.00 0.00 0.02 0.00 0.00 55.36 57.18 1d5v s GLN 46 Cb 0.01 -2.67 0.00 0.00 1.00 0.00 0.00 33.01 31.35 1d5v s GLN 46 CO 0.10 -0.35 0.00 0.41 -2.12 0.00 0.00 175.29 173.33 1d5v n GLY 47 N 0.63 2.90 0.02 3.09 0.00 -1.26 -4.74 105.19 105.82 1d5v n GLY 47 Ca 0.04 -0.79 0.12 0.00 0.00 0.00 0.00 46.02 45.40 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 0.16 0.17 1.61 4.27 -1.25 -3.80 117.44 118.60 1d5v n TRP 48 Ca 0.00 0.05 -0.12 0.00 -3.89 0.00 0.00 57.50 53.53 1d5v n TRP 48 Cb 0.00 -0.37 -0.07 0.00 -1.36 0.00 0.00 31.31 29.51 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 -0.45 -0.06 -2.67 4.15 -1.85 -3.03 115.11 111.22 1d5v h GLN 49 Ca 0.00 0.03 -0.11 0.00 0.77 0.00 0.00 58.65 59.34 1d5v h GLN 49 Cb 0.58 0.10 -0.01 0.00 0.21 0.00 0.00 27.48 28.36 1d5v h GLN 49 CO 0.00 -0.12 -0.49 -0.91 -1.93 0.00 0.00 178.83 175.38 1d5v h ASN 50 N -0.90 0.15 -0.97 -0.69 2.35 -1.90 -3.13 115.58 110.50 1d5v h ASN 50 Ca -0.05 -0.07 0.01 0.00 -0.55 0.00 0.00 56.30 55.64 1d5v h ASN 50 Cb 0.53 -0.04 -0.05 0.00 0.05 0.00 0.00 38.32 38.81 1d5v h ASN 50 CO 0.08 0.62 0.64 0.77 -1.65 0.00 0.00 177.43 177.89 1d5v h SER 51 N 0.11 1.10 0.10 5.81 4.64 -1.65 0.19 113.55 123.85 1d5v h SER 51 Ca 0.00 -0.03 -0.00 0.00 -0.47 0.00 0.00 61.79 61.29 1d5v h SER 51 Cb 0.91 -0.27 0.00 0.00 -0.31 0.00 0.00 62.40 62.73 1d5v h SER 51 CO 0.07 0.79 -0.05 0.40 -0.87 0.00 0.00 176.83 177.18 1d5v h ILE 52 N 1.30 0.91 -0.30 0.95 1.08 -1.47 -1.41 117.51 118.57 1d5v h ILE 52 Ca 0.36 -0.01 -0.15 0.00 -0.39 0.00 0.00 64.86 64.67 1d5v h ILE 52 Cb -0.13 0.91 -0.01 0.00 -3.07 0.00 0.00 36.82 34.52 1d5v h ILE 52 CO -0.08 0.00 -0.43 0.03 -0.69 0.00 0.00 178.15 176.98 1d5v h ARG 53 N -0.13 0.75 -1.00 2.37 3.08 -1.60 -3.14 114.38 114.70 1d5v h ARG 53 Ca -0.01 -0.40 0.01 0.00 0.07 0.00 0.00 59.98 59.65 1d5v h ARG 53 Cb 0.10 0.02 -0.05 0.00 0.08 0.00 0.00 29.97 30.12 1d5v h ARG 53 CO 0.02 1.03 0.66 1.25 -1.07 0.00 0.00 179.97 181.86 1d5v h HIS 54 N 0.60 1.26 0.00 3.04 2.76 -0.41 -1.37 115.15 121.03 1d5v h HIS 54 Ca 0.04 0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.24 1d5v h HIS 54 Cb 0.98 -0.43 0.00 0.00 1.55 0.00 0.00 27.41 29.52 1d5v h HIS 54 CO 0.05 0.79 0.00 -2.95 -1.30 0.00 0.00 177.93 174.52 1d5v h ASN 55 N 1.35 0.00 -0.60 3.26 7.08 -1.22 -3.11 115.58 122.35 1d5v h ASN 55 Ca 0.37 0.00 -0.10 0.00 -3.08 0.00 0.00 56.30 53.49 1d5v h ASN 55 Cb -0.15 0.00 -0.02 0.00 -2.08 0.00 0.00 38.32 36.07 1d5v h ASN 55 CO -0.08 0.00 -0.02 -0.07 -2.08 0.00 0.00 177.43 175.18 1d5v h LEU 56 N 0.00 1.05 -0.06 6.14 3.38 -1.25 -1.63 115.31 122.96 1d5v h LEU 56 Ca 0.00 -0.31 -0.03 0.00 0.09 0.00 0.00 57.88 57.63 1d5v h LEU 56 Cb 0.46 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 40.92 1d5v h LEU 56 CO 0.00 1.11 -0.06 -1.28 0.09 0.00 0.00 178.44 178.30 1d5v h SER 57 N 0.97 0.16 -0.81 -0.43 0.87 -1.62 -3.24 113.55 109.46 1d5v h SER 57 Ca 0.17 -0.50 -0.05 0.00 -1.23 0.00 0.00 61.79 60.18 1d5v h SER 57 Cb 0.59 -0.04 -0.04 0.00 -0.44 0.00 0.00 62.40 62.47 1d5v h SER 57 CO 0.03 0.62 0.32 -0.07 -0.53 0.00 0.00 176.83 177.21 1d5v h LEU 58 N -0.30 1.11 -8.88 2.23 3.38 -1.63 -3.40 115.31 107.81 1d5v h LEU 58 Ca 0.01 -0.17 -0.57 0.00 0.09 0.00 0.00 57.88 57.24 1d5v h LEU 58 Cb 0.58 -0.29 -0.05 0.00 0.09 0.00 0.00 40.66 40.99 1d5v h LEU 58 CO 0.02 0.98 1.00 0.20 0.09 0.00 0.00 178.44 180.72 1d5v s ASN 59 N -6.36 6.56 0.00 -0.43 0.01 -0.61 -4.84 114.94 109.27 1d5v s ASN 59 Ca -0.12 1.01 0.26 0.00 -0.71 0.00 0.00 52.86 53.30 1d5v s ASN 59 Cb 0.16 -2.54 0.71 0.00 0.41 0.00 0.00 41.25 39.98 1d5v s ASN 59 CO 0.84 -1.21 1.54 -0.62 -1.51 0.00 0.00 177.10 176.14 1d5v n GLU 60 N 7.61 0.68 -0.04 -0.60 -0.58 -1.26 -4.04 120.64 122.40 1d5v n GLU 60 Ca 0.15 -0.40 0.00 0.00 -0.42 0.00 0.00 57.16 56.49 1d5v n GLU 60 Cb 0.47 -1.49 0.30 0.00 -0.57 0.00 0.00 31.44 30.15 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 -5.19 3.30 -0.13 0.00 0.08 -1.26 -4.73 117.98 110.05 1d5v s PHE 62 Ca -0.08 1.53 -0.00 0.00 0.12 0.00 0.00 56.93 58.49 1d5v s PHE 62 Cb 0.16 -2.87 -0.02 0.00 -0.57 0.00 0.00 43.02 39.73 1d5v s PHE 62 CO 0.77 -0.43 -0.12 0.08 -0.10 0.00 0.00 175.22 175.41 1d5v s VAL 63 N -2.39 3.13 0.39 -0.44 1.01 -1.00 -4.99 120.40 116.11 1d5v s VAL 63 Ca 0.61 -0.63 -0.19 0.00 0.00 0.00 0.00 61.98 61.77 1d5v s VAL 63 Cb -0.11 -2.32 -0.10 0.00 0.00 0.00 0.00 36.38 33.85 1d5v s VAL 63 CO 0.25 0.52 0.88 -0.54 0.00 0.00 0.00 175.10 176.21 1d5v s LYS 64 N 0.35 4.17 -0.03 2.72 1.02 -1.26 -2.96 119.74 123.75 1d5v s LYS 64 Ca -0.10 0.98 -0.00 0.00 0.02 0.00 0.00 55.97 56.87 1d5v s LYS 64 Cb -0.16 -2.30 0.03 0.00 -0.52 0.00 0.00 37.83 34.88 1d5v s LYS 64 CO 0.05 0.05 0.02 0.08 -0.92 0.00 0.00 175.35 174.64 1d5v s VAL 65 N -2.08 0.03 0.96 3.17 1.01 -0.46 -4.96 120.40 118.06 1d5v s VAL 65 Ca 0.59 0.19 -0.16 0.00 0.00 0.00 0.00 61.98 62.60 1d5v s VAL 65 Cb -0.10 -0.16 0.23 0.00 0.00 0.00 0.00 36.38 36.35 1d5v s VAL 65 CO 0.15 0.12 0.98 -0.81 0.00 0.00 0.00 175.10 175.54 1d5v n PRO 66 N 4.31 -2.23 -4.22 2.72 -0.04 -1.26 0.12 135.00 134.40 1d5v n PRO 66 Ca -0.24 -1.54 -0.23 0.00 -0.04 0.00 0.00 63.50 61.45 1d5v n PRO 66 Cb 0.50 -1.29 -0.06 0.00 -0.04 0.00 0.00 33.50 32.61 1d5v n PRO 66 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 1d5v s ARG 67 N -5.18 2.47 0.84 0.54 0.52 -1.26 -4.47 118.95 112.41 1d5v s ARG 67 Ca 0.60 -1.34 -0.12 0.00 -0.52 0.00 0.00 55.73 54.36 1d5v s ARG 67 Cb -0.04 -2.27 0.10 0.00 0.52 0.00 0.00 34.95 33.26 1d5v s ARG 67 CO 0.45 0.34 1.16 -0.51 0.02 0.00 0.00 175.30 176.76 1d5v s ASP 68 N -3.74 3.45 0.64 0.23 1.01 -1.26 -4.84 116.67 112.16 1d5v s ASP 68 Ca 0.33 2.22 0.40 0.00 0.71 0.00 0.00 52.55 56.21 1d5v s ASP 68 Cb -0.06 -2.57 2.23 0.00 1.01 0.00 0.00 42.92 43.53 1d5v s ASP 68 CO 0.22 -2.75 2.33 0.44 0.21 0.00 0.00 175.17 175.61 1d5v h ASP 69 N -1.30 0.00 -0.86 0.27 3.32 -2.02 -1.96 116.42 113.87 1d5v h ASP 69 Ca -0.45 0.00 0.01 0.00 0.02 0.00 0.00 57.03 56.61 1d5v h ASP 69 Cb 1.28 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 40.78 1d5v h ASP 69 CO 0.45 0.00 0.57 0.11 -1.72 0.00 0.00 179.24 178.65 1d5v h LYS 70 N 0.00 1.14 -6.74 3.56 1.57 -2.06 -3.41 116.57 110.62 1d5v h LYS 70 Ca -0.00 -0.07 -0.49 0.00 -1.87 0.00 0.00 60.65 58.22 1d5v h LYS 70 Cb 0.02 -0.25 -0.03 0.00 0.08 0.00 0.00 32.23 32.05 1d5v h LYS 70 CO 0.00 0.75 0.15 0.15 -0.57 0.00 0.00 179.45 179.94 1d5v s LYS 71 N -6.12 4.14 0.00 3.15 3.01 -0.74 -4.94 119.74 118.25 1d5v s LYS 71 Ca -0.13 0.83 0.17 0.00 -1.01 0.00 0.00 55.97 55.83 1d5v s LYS 71 Cb 0.16 -2.54 1.04 0.00 -1.01 0.00 0.00 37.83 35.48 1d5v s LYS 71 CO 0.80 0.20 1.47 -0.35 0.51 0.00 0.00 175.35 177.97 1d5v n PRO 72 N -0.05 0.66 -1.48 -1.68 -0.04 -1.26 -4.81 135.00 126.34 1d5v n PRO 72 Ca 0.02 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.48 1d5v n PRO 72 Cb 0.52 -1.41 0.00 0.00 -0.04 0.00 0.00 33.50 32.57 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 0.29 0.65 0.38 0.55 0.00 -1.26 -4.96 105.19 100.84 1d5v n GLY 73 Ca 0.13 -0.39 -0.02 0.00 0.00 0.00 0.00 46.02 45.74 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 0.00 1.32 -2.52 1.61 1.57 -1.99 -3.46 116.57 113.11 1d5v h LYS 74 Ca 0.00 -0.08 0.15 0.00 -1.87 0.00 0.00 60.65 58.85 1d5v h LYS 74 Cb 0.83 -0.30 -0.05 0.00 0.08 0.00 0.00 32.23 32.79 1d5v h LYS 74 CO 0.00 0.88 0.52 0.20 -0.57 0.00 0.00 179.45 180.48 1d5v s GLY 75 N -3.12 0.03 -0.15 3.86 0.00 -1.26 -5.12 107.32 101.56 1d5v s GLY 75 Ca -0.13 -0.23 -0.08 0.00 0.00 0.00 0.00 44.72 44.28 1d5v s GLY 75 CO 0.82 1.33 0.13 -1.35 0.00 0.00 0.00 173.10 174.03 1d5v s SER 76 N -3.22 6.25 0.75 1.64 1.04 -1.26 -4.52 113.70 114.38 1d5v s SER 76 Ca 0.18 0.36 -0.12 0.00 0.48 0.00 0.00 55.95 56.85 1d5v s SER 76 Cb -0.02 -2.05 0.04 0.00 0.10 0.00 0.00 66.02 64.09 1d5v s SER 76 CO 0.05 0.32 1.09 -0.31 0.98 0.00 0.00 173.24 175.37 1d5v s TYR 77 N -0.49 2.60 -0.06 5.02 2.02 0.12 -4.56 117.35 121.99 1d5v s TYR 77 Ca 0.12 1.55 0.06 0.00 -0.37 0.00 0.00 57.07 58.43 1d5v s TYR 77 Cb -0.12 -3.07 -0.01 0.00 -0.40 0.00 0.00 41.96 38.36 1d5v s TYR 77 CO 0.02 -1.76 -0.24 -1.58 -1.57 0.00 0.00 175.55 170.42 1d5v s TRP 78 N -2.78 2.37 0.26 2.71 0.52 -0.42 -1.36 118.94 120.25 1d5v s TRP 78 Ca 0.62 -0.75 -0.14 0.00 0.02 0.00 0.00 56.10 55.85 1d5v s TRP 78 Cb -0.18 -1.56 0.00 0.00 -1.15 0.00 0.00 33.47 30.58 1d5v s TRP 78 CO 0.53 -0.25 0.54 -0.08 0.02 0.00 0.00 176.95 177.71 1d5v s THR 79 N -0.05 0.00 -0.26 2.01 -1.32 -1.16 -2.89 115.64 111.97 1d5v s THR 79 Ca -0.06 -1.33 -0.14 0.00 -1.21 0.00 0.00 61.69 58.95 1d5v s THR 79 Cb -0.14 -2.21 -0.04 0.00 -1.51 0.00 0.00 72.50 68.59 1d5v s THR 79 CO 0.04 0.00 0.31 -0.76 -2.21 0.00 0.00 174.62 172.00 1d5v s LEU 80 N -3.01 4.05 -0.43 9.08 1.43 -1.26 -2.38 118.68 126.16 1d5v s LEU 80 Ca 0.20 0.22 0.03 0.00 -1.03 0.00 0.00 54.13 53.56 1d5v s LEU 80 Cb -0.02 -2.33 0.16 0.00 0.03 0.00 0.00 46.19 44.03 1d5v s LEU 80 CO 0.09 -0.12 0.32 -1.81 0.23 0.00 0.00 176.35 175.07 1d5v s ASP 81 N 1.55 2.25 0.00 2.29 1.11 -1.26 -5.00 116.67 117.61 1d5v s ASP 81 Ca 0.13 -2.93 0.00 0.00 0.18 0.00 0.00 52.55 49.92 1d5v s ASP 81 Cb -0.15 -0.60 0.00 0.00 1.07 0.00 0.00 42.92 43.24 1d5v s ASP 81 CO 0.09 -0.20 0.00 -2.65 1.18 0.00 0.00 175.17 173.60 1d5v n PRO 82 N 3.05 2.47 -0.89 8.23 -0.02 -1.26 -4.24 135.00 142.35 1d5v n PRO 82 Ca 0.24 0.00 -0.26 0.00 -2.02 0.00 0.00 63.50 61.45 1d5v n PRO 82 Cb 0.43 0.00 -0.02 0.00 -0.02 0.00 0.00 33.50 33.89 1d5v n PRO 82 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1d5v n ASP 83 N 0.00 5.86 0.01 2.55 8.00 -1.26 -4.51 116.55 127.20 1d5v n ASP 83 Ca 0.00 -2.39 0.04 0.00 0.71 0.00 0.00 54.79 53.15 1d5v n ASP 83 Cb 0.00 -1.21 0.43 0.00 -0.02 0.00 0.00 41.12 40.32 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 6.00 0.46 -1.00 -2.24 0.87 -2.01 -1.46 113.55 114.17 1d5v h SER 84 Ca 0.59 -0.01 0.01 0.00 -1.23 0.00 0.00 61.79 61.15 1d5v h SER 84 Cb 0.20 -0.11 -0.05 0.00 -0.44 0.00 0.00 62.40 61.99 1d5v h SER 84 CO 1.54 0.33 0.66 0.22 -0.53 0.00 0.00 176.83 179.05 1d5v h TYR 85 N 0.54 1.26 -0.23 2.24 5.03 -1.93 -1.46 116.97 122.42 1d5v h TYR 85 Ca 0.14 0.03 -0.06 0.00 2.58 0.00 0.00 58.73 61.43 1d5v h TYR 85 Cb -0.06 -0.43 -0.03 0.00 1.55 0.00 0.00 36.73 37.76 1d5v h TYR 85 CO 0.00 0.80 0.07 -1.71 -1.32 0.00 0.00 178.16 176.00 1d5v n ASN 86 N -4.38 2.77 -4.55 -2.11 2.85 -0.55 -4.81 115.26 104.47 1d5v n ASN 86 Ca 0.12 -2.37 -0.36 0.00 -0.11 0.00 0.00 54.58 51.85 1d5v n ASN 86 Cb 0.01 -0.58 -0.04 0.00 1.24 0.00 0.00 39.78 40.42 1d5v n ASN 86 CO 0.00 0.00 0.00 -0.04 -2.11 0.00 0.00 177.26 175.11 1d5v s MET 87 N -1.39 2.89 0.17 1.20 -1.94 -0.55 -4.72 119.30 114.96 1d5v s MET 87 Ca 0.18 -0.11 0.23 0.00 -1.71 0.00 0.00 55.69 54.28 1d5v s MET 87 Cb 0.14 -4.69 0.18 0.00 2.01 0.00 0.00 34.83 32.46 1d5v s MET 87 CO 0.05 -2.70 1.20 0.74 -0.01 0.00 0.00 175.02 174.29 1d5v h PHE 88 N 12.05 0.00 -4.36 -0.03 -1.00 -1.89 -3.43 116.94 118.28 1d5v h PHE 88 Ca -0.09 0.00 -0.51 0.00 2.81 0.00 0.00 57.97 60.18 1d5v h PHE 88 Cb 1.07 0.00 0.07 0.00 3.61 0.00 0.00 35.95 40.70 1d5v h PHE 88 CO 1.15 0.00 0.41 -1.21 -1.61 0.00 0.00 178.31 177.05 1d5v s GLU 89 N -3.26 3.42 0.13 1.51 0.41 -1.26 -4.98 118.70 114.67 1d5v s GLU 89 Ca 0.03 0.80 -0.31 0.00 -0.41 0.00 0.00 54.97 55.08 1d5v s GLU 89 Cb 0.11 -2.06 -0.08 0.00 -1.78 0.00 0.00 34.13 30.32 1d5v s GLU 89 CO 0.75 -0.71 1.39 -0.80 -0.49 0.00 0.00 175.26 175.40 1d5v s ASN 90 N -4.08 6.82 0.00 -0.19 0.02 -1.26 -4.58 114.94 111.67 1d5v s ASN 90 Ca 0.56 2.36 0.00 0.00 -1.02 0.00 0.00 52.86 54.76 1d5v s ASN 90 Cb -0.12 -2.59 0.00 0.00 0.02 0.00 0.00 41.25 38.56 1d5v s ASN 90 CO 0.54 -0.64 0.00 0.61 0.02 0.00 0.00 177.10 177.63 1d5v n GLY 91 N 3.30 -0.39 0.04 0.66 0.00 -1.26 -4.91 105.19 102.63 1d5v n GLY 91 Ca 0.11 0.31 0.10 0.00 0.00 0.00 0.00 46.02 46.54 1d5v n GLY 91 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1d5v n SER 92 N 0.00 0.26 -0.38 1.61 2.88 -1.26 -3.34 113.62 113.38 1d5v n SER 92 Ca 0.00 0.55 -0.02 0.00 -1.33 0.00 0.00 58.87 58.07 1d5v n SER 92 Cb 0.00 -0.61 0.11 0.00 -0.75 0.00 0.00 64.21 62.96 1d5v n SER 92 CO 0.00 0.00 0.00 0.15 -1.23 0.00 0.00 175.04 173.96 1d5v h PHE 93 N 0.00 1.27 0.00 0.66 3.57 -1.82 -3.52 116.94 117.09 1d5v h PHE 93 Ca 0.00 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.53 1d5v h PHE 93 Cb 0.39 -0.43 0.00 0.00 2.79 0.00 0.00 35.95 38.70 1d5v h PHE 93 CO 0.00 0.80 0.00 1.47 -2.23 0.00 0.00 178.31 178.35