#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 4.31 0.16 4.03 1.43 -1.26 -5.07 118.68 122.28 1d5v s LEU 2 Ca 0.00 1.57 0.05 0.00 -1.03 0.00 0.00 54.13 54.72 1d5v s LEU 2 Cb 0.00 -3.79 -0.04 0.00 0.03 0.00 0.00 46.19 42.38 1d5v s LEU 2 CO 0.00 -0.03 -0.11 0.68 0.23 0.00 0.00 176.35 177.12 1d5v s VAL 3 N -1.60 1.34 -0.20 -1.59 -7.23 -1.26 -5.10 120.40 104.75 1d5v s VAL 3 Ca 0.47 -2.11 -0.29 0.00 -1.81 0.00 0.00 61.98 58.24 1d5v s VAL 3 Cb -0.17 -1.91 -0.01 0.00 0.56 0.00 0.00 36.38 34.86 1d5v s VAL 3 CO 0.21 -0.70 1.26 -1.59 -0.31 0.00 0.00 175.10 173.97 1d5v s LYS 4 N -3.71 4.15 0.55 4.82 -2.85 -1.26 -4.97 119.74 116.46 1d5v s LYS 4 Ca 0.18 1.54 -0.18 0.00 -1.00 0.00 0.00 55.97 56.51 1d5v s LYS 4 Cb 0.02 -3.79 -0.12 0.00 -2.06 0.00 0.00 37.83 31.88 1d5v s LYS 4 CO 0.02 -0.81 0.19 -2.30 0.10 0.00 0.00 175.35 172.55 1d5v n PRO 5 N 6.78 0.25 0.07 1.78 -0.02 -1.26 -4.82 135.00 137.78 1d5v n PRO 5 Ca 0.14 0.10 0.10 0.00 -2.02 0.00 0.00 63.50 61.82 1d5v n PRO 5 Cb 0.45 -1.35 0.41 0.00 -0.02 0.00 0.00 33.50 32.99 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 0.72 0.11 -1.77 0.52 -0.04 -1.26 -4.78 135.00 128.50 1d5v n PRO 6 Ca 0.10 0.34 -0.42 0.00 -0.04 0.00 0.00 63.50 63.48 1d5v n PRO 6 Cb 0.47 -1.70 -0.02 0.00 -0.04 0.00 0.00 33.50 32.21 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 -3.17 2.77 0.81 0.54 2.02 -1.26 -4.96 117.35 114.10 1d5v s TYR 7 Ca 0.06 0.73 -0.11 0.00 -0.37 0.00 0.00 57.07 57.38 1d5v s TYR 7 Cb 0.09 -4.08 0.08 0.00 -0.40 0.00 0.00 41.96 37.66 1d5v s TYR 7 CO 0.34 -3.68 1.09 -1.54 -1.57 0.00 0.00 175.55 170.19 1d5v s SER 8 N 0.57 4.19 0.26 2.29 1.04 -1.26 -4.75 113.70 116.03 1d5v s SER 8 Ca 0.65 1.66 -0.04 0.00 0.48 0.00 0.00 55.95 58.69 1d5v s SER 8 Cb -0.48 -2.36 0.34 0.00 0.10 0.00 0.00 66.02 63.62 1d5v s SER 8 CO 0.46 -2.21 1.90 1.88 0.98 0.00 0.00 173.24 176.25 1d5v h TYR 9 N -1.25 1.24 -0.50 5.02 0.05 -1.96 -0.86 116.97 118.70 1d5v h TYR 9 Ca -0.46 0.03 -0.01 0.00 0.05 0.00 0.00 58.73 58.34 1d5v h TYR 9 Cb 1.25 -0.41 -0.02 0.00 1.01 0.00 0.00 36.73 38.56 1d5v h TYR 9 CO 0.52 0.70 0.28 0.82 -1.05 0.00 0.00 178.16 179.43 1d5v h ILE 10 N 1.26 1.17 -0.38 -2.88 1.08 -1.99 -1.20 117.51 114.57 1d5v h ILE 10 Ca 0.41 -0.44 0.00 0.00 -0.39 0.00 0.00 64.86 64.44 1d5v h ILE 10 Cb 0.02 0.55 -0.02 0.00 -3.07 0.00 0.00 36.82 34.31 1d5v h ILE 10 CO -0.13 0.18 0.24 0.00 -0.69 0.00 0.00 178.15 177.75 1d5v h ALA 11 N 1.12 0.48 -1.01 1.87 0.00 -1.60 0.52 119.26 120.64 1d5v h ALA 11 Ca 0.18 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.05 1d5v h ALA 11 Cb 0.05 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 17.63 1d5v h ALA 11 CO -0.03 -0.04 0.67 -0.07 0.00 0.00 0.00 179.25 179.78 1d5v h LEU 12 N 0.50 1.16 -0.38 0.00 3.38 -0.90 0.11 115.31 119.17 1d5v h LEU 12 Ca 0.14 -0.03 -0.16 0.00 0.09 0.00 0.00 57.88 57.91 1d5v h LEU 12 Cb -0.02 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 40.43 1d5v h LEU 12 CO -0.03 0.84 -0.41 0.40 0.09 0.00 0.00 178.44 179.33 1d5v h ILE 13 N 1.37 1.27 -0.76 1.22 2.04 -0.53 -2.47 117.51 119.64 1d5v h ILE 13 Ca 0.37 -1.58 -0.06 0.00 1.00 0.00 0.00 64.86 64.59 1d5v h ILE 13 Cb -0.15 1.41 -0.03 0.00 -0.74 0.00 0.00 36.82 37.30 1d5v h ILE 13 CO -0.08 0.53 0.26 0.74 0.00 0.00 0.00 178.15 179.60 1d5v h THR 14 N 0.75 1.26 -0.51 -0.27 2.02 0.86 -2.64 112.91 114.39 1d5v h THR 14 Ca 0.06 -0.89 -0.10 0.00 0.77 0.00 0.00 66.41 66.25 1d5v h THR 14 Cb 1.00 0.40 -0.02 0.00 -1.74 0.00 0.00 68.15 67.79 1d5v h THR 14 CO 0.10 0.35 -0.07 0.24 0.37 0.00 0.00 175.52 176.51 1d5v h MET 15 N 1.13 0.91 -0.85 6.66 2.86 -0.73 -2.59 114.93 122.32 1d5v h MET 15 Ca 0.25 -0.30 0.01 0.00 -2.06 0.00 0.00 59.70 57.59 1d5v h MET 15 Cb 0.28 -0.08 -0.04 0.00 0.06 0.00 0.00 31.60 31.82 1d5v h MET 15 CO -0.01 0.95 0.56 0.00 1.06 0.00 0.00 176.91 179.47 1d5v h ALA 16 N 1.08 1.08 0.23 6.32 0.00 -1.10 0.92 119.26 127.79 1d5v h ALA 16 Ca 0.14 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 1d5v h ALA 16 Cb 0.59 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1d5v h ALA 16 CO 0.04 0.49 -0.11 0.82 0.00 0.00 0.00 179.25 180.49 1d5v h ILE 17 N 1.15 0.85 -0.76 0.00 2.04 -1.27 0.79 117.51 120.30 1d5v h ILE 17 Ca 0.31 -0.48 -0.06 0.00 1.00 0.00 0.00 64.86 65.63 1d5v h ILE 17 Cb -0.13 1.12 -0.03 0.00 -0.74 0.00 0.00 36.82 37.04 1d5v h ILE 17 CO -0.07 0.11 0.25 1.56 0.00 0.00 0.00 178.15 180.00 1d5v h GLN 18 N -0.55 1.18 0.00 2.37 4.20 -1.24 -2.12 115.11 118.95 1d5v h GLN 18 Ca -0.03 -0.25 -0.02 0.00 0.06 0.00 0.00 58.65 58.42 1d5v h GLN 18 Cb 0.40 -0.17 -0.00 0.00 0.30 0.00 0.00 27.48 28.01 1d5v h GLN 18 CO 0.05 0.99 -0.07 -0.91 -0.67 0.00 0.00 178.83 178.22 1d5v h ASN 19 N 1.13 0.00 -3.98 1.46 -0.26 0.99 -3.43 115.58 111.49 1d5v h ASN 19 Ca 0.25 0.00 -0.46 0.00 -0.56 0.00 0.00 56.30 55.53 1d5v h ASN 19 Cb 0.29 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 37.54 1d5v h ASN 19 CO -0.01 0.07 0.35 0.00 -1.06 0.00 0.00 177.43 176.78 1d5v s ALA 20 N -3.71 3.11 0.05 -0.83 0.00 0.26 -4.97 121.76 115.66 1d5v s ALA 20 Ca 0.01 0.49 -0.22 0.00 0.00 0.00 0.00 51.96 52.23 1d5v s ALA 20 Cb 0.10 -3.18 -0.14 0.00 0.00 0.00 0.00 23.12 19.90 1d5v s ALA 20 CO 0.57 0.10 1.47 -1.00 0.00 0.00 0.00 175.76 176.89 1d5v h PRO 21 N 2.47 0.20 -5.04 0.00 0.13 -1.84 -3.41 132.00 124.51 1d5v h PRO 21 Ca -0.48 -0.06 -0.63 0.00 -0.87 0.00 0.00 66.00 63.95 1d5v h PRO 21 Cb 1.19 -0.02 -0.18 0.00 0.13 0.00 0.00 31.00 32.12 1d5v h PRO 21 CO 0.63 0.45 -0.56 -1.21 -0.23 0.00 0.00 178.00 177.08 1d5v s GLU 22 N -4.94 3.88 0.53 0.86 2.02 -1.26 -4.97 118.70 114.82 1d5v s GLU 22 Ca -0.14 -0.37 0.21 0.00 0.02 0.00 0.00 54.97 54.69 1d5v s GLU 22 Cb 0.05 -3.43 1.40 0.00 0.10 0.00 0.00 34.13 32.26 1d5v s GLU 22 CO 0.70 -0.04 2.15 0.87 0.02 0.00 0.00 175.26 178.96 1d5v h LYS 23 N 7.79 0.00 -6.02 1.61 1.57 -1.82 -3.34 116.57 116.36 1d5v h LYS 23 Ca -0.37 0.00 -0.58 0.00 -1.87 0.00 0.00 60.65 57.83 1d5v h LYS 23 Cb 1.18 0.00 -0.09 0.00 0.08 0.00 0.00 32.23 33.40 1d5v h LYS 23 CO 0.61 0.04 1.52 0.15 -0.57 0.00 0.00 179.45 181.21 1d5v s LYS 24 N -4.78 3.53 0.14 3.15 1.02 -1.26 -4.31 119.74 117.22 1d5v s LYS 24 Ca -0.05 -1.17 0.08 0.00 0.02 0.00 0.00 55.97 54.85 1d5v s LYS 24 Cb 0.16 -5.36 -0.04 0.00 -0.52 0.00 0.00 37.83 32.07 1d5v s LYS 24 CO 0.63 -2.37 -0.12 -1.50 -0.92 0.00 0.00 175.35 171.07 1d5v s ILE 25 N 5.49 3.17 0.61 2.17 2.07 -1.23 -4.82 121.20 128.66 1d5v s ILE 25 Ca 0.50 -1.47 -0.11 0.00 -1.41 0.00 0.00 60.65 58.15 1d5v s ILE 25 Cb -0.00 -2.51 -0.04 0.00 0.13 0.00 0.00 42.46 40.04 1d5v s ILE 25 CO -0.06 0.03 1.03 0.42 -1.91 0.00 0.00 174.94 174.44 1d5v s THR 26 N -1.38 4.68 0.21 4.00 -4.23 -1.26 -1.02 115.64 116.65 1d5v s THR 26 Ca 0.22 0.90 -0.09 0.00 -1.18 0.00 0.00 61.69 61.54 1d5v s THR 26 Cb -0.10 -3.85 0.17 0.00 1.34 0.00 0.00 72.50 70.06 1d5v s THR 26 CO 0.13 -1.11 1.87 0.25 -0.54 0.00 0.00 174.62 175.22 1d5v h LEU 27 N -0.22 0.94 -0.99 4.79 5.85 -1.96 -2.14 115.31 121.58 1d5v h LEU 27 Ca -0.44 -0.05 0.01 0.00 0.84 0.00 0.00 57.88 58.23 1d5v h LEU 27 Cb 1.19 -0.24 -0.05 0.00 0.37 0.00 0.00 40.66 41.93 1d5v h LEU 27 CO 0.62 0.71 0.65 0.78 -0.34 0.00 0.00 178.44 180.86 1d5v h ASN 28 N 1.08 1.15 -0.90 1.25 2.35 -1.93 -2.51 115.58 116.07 1d5v h ASN 28 Ca 0.29 -0.04 -0.02 0.00 -0.55 0.00 0.00 56.30 55.98 1d5v h ASN 28 Cb -0.07 -0.29 -0.04 0.00 0.05 0.00 0.00 38.32 37.97 1d5v h ASN 28 CO -0.06 0.84 0.49 1.23 -1.65 0.00 0.00 177.43 178.28 1d5v h GLY 29 N 1.35 1.35 1.02 2.83 0.00 -1.77 -2.73 103.07 105.13 1d5v h GLY 29 Ca 0.36 -0.62 -0.00 0.00 0.00 0.00 0.00 47.33 47.07 1d5v h GLY 29 CO -0.08 0.59 0.58 -2.22 0.00 0.00 0.00 176.54 175.42 1d5v h ILE 30 N 1.27 1.26 -0.62 2.60 2.04 -1.19 -2.65 117.51 120.22 1d5v h ILE 30 Ca 0.32 -0.56 0.01 0.00 1.00 0.00 0.00 64.86 65.63 1d5v h ILE 30 Cb 0.04 -0.10 -0.03 0.00 -0.74 0.00 0.00 36.82 35.99 1d5v h ILE 30 CO -0.05 0.27 0.41 1.88 0.00 0.00 0.00 178.15 180.66 1d5v h TYR 31 N 1.32 0.78 -1.01 1.37 0.05 -1.42 -1.95 116.97 116.11 1d5v h TYR 31 Ca 0.34 0.02 0.01 0.00 0.05 0.00 0.00 58.73 59.15 1d5v h TYR 31 Cb -0.07 -0.26 -0.05 0.00 1.01 0.00 0.00 36.73 37.36 1d5v h TYR 31 CO 0.01 0.49 0.67 1.96 -1.05 0.00 0.00 178.16 180.24 1d5v h GLN 32 N 0.84 1.33 0.00 4.88 4.20 -1.44 -2.26 115.11 122.66 1d5v h GLN 32 Ca 0.23 -0.08 0.00 0.00 0.06 0.00 0.00 58.65 58.86 1d5v h GLN 32 Cb -0.10 -0.30 -0.00 0.00 0.30 0.00 0.00 27.48 27.38 1d5v h GLN 32 CO -0.05 0.88 -0.00 0.35 -0.67 0.00 0.00 178.83 179.33 1d5v h PHE 33 N 1.37 -0.01 -0.14 2.96 3.04 -1.08 -2.04 116.94 121.04 1d5v h PHE 33 Ca 0.37 0.00 -0.01 0.00 3.98 0.00 0.00 57.97 62.31 1d5v h PHE 33 Cb -0.16 0.00 -0.01 0.00 2.56 0.00 0.00 35.95 38.35 1d5v h PHE 33 CO -0.00 -0.01 0.06 0.82 -2.02 0.00 0.00 178.31 177.17 1d5v h ILE 34 N -0.01 1.13 -1.01 1.41 2.04 -1.10 -1.65 117.51 118.33 1d5v h ILE 34 Ca 0.00 -0.39 0.01 0.00 1.00 0.00 0.00 64.86 65.48 1d5v h ILE 34 Cb 0.01 1.13 -0.05 0.00 -0.74 0.00 0.00 36.82 37.17 1d5v h ILE 34 CO -0.00 0.12 0.67 0.24 0.00 0.00 0.00 178.15 179.17 1d5v h MET 35 N 0.09 1.32 -0.18 2.37 2.86 -1.37 0.14 114.93 120.17 1d5v h MET 35 Ca 0.05 -0.08 -0.03 0.00 -2.06 0.00 0.00 59.70 57.58 1d5v h MET 35 Cb 0.14 -0.30 -0.01 0.00 0.06 0.00 0.00 31.60 31.49 1d5v h MET 35 CO -0.01 0.88 -0.01 -0.44 1.06 0.00 0.00 176.91 178.40 1d5v h ASP 36 N 1.36 0.32 -0.37 1.22 3.32 -1.18 -2.15 116.42 118.93 1d5v h ASP 36 Ca 0.37 -0.32 -0.17 0.00 0.02 0.00 0.00 57.03 56.93 1d5v h ASP 36 Cb -0.16 -0.09 -0.00 0.00 0.22 0.00 0.00 39.33 39.30 1d5v h ASP 36 CO -0.08 0.56 -0.41 -0.09 -1.72 0.00 0.00 179.24 177.49 1d5v h ARG 37 N 0.07 0.94 -2.66 3.56 2.43 -1.03 -3.37 114.38 114.32 1d5v h ARG 37 Ca 0.05 -0.51 -0.60 0.00 -0.81 0.00 0.00 59.98 58.10 1d5v h ARG 37 Cb 0.40 0.03 -0.41 0.00 -0.42 0.00 0.00 29.97 29.57 1d5v h ARG 37 CO 0.01 1.17 -0.71 1.19 -1.51 0.00 0.00 179.97 180.12 1d5v n PHE 38 N -4.05 2.12 0.00 2.20 3.72 0.48 -4.94 117.46 116.99 1d5v n PHE 38 Ca -0.03 -4.00 0.00 0.00 -0.05 0.00 0.00 57.45 53.37 1d5v n PHE 38 Cb 0.56 -0.39 0.00 0.00 -0.94 0.00 0.00 39.48 38.71 1d5v n PHE 38 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 176.76 174.41 1d5v n PRO 39 N 1.88 0.00 -0.37 -1.08 -0.02 -0.81 -1.73 135.00 132.87 1d5v n PRO 39 Ca 0.24 0.11 0.00 0.00 -2.02 0.00 0.00 63.50 61.83 1d5v n PRO 39 Cb 0.41 -1.76 0.14 0.00 -0.02 0.00 0.00 33.50 32.26 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 1.24 0.00 6.00 3.57 -1.91 -1.53 116.94 124.30 1d5v h PHE 40 Ca 0.00 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.49 1d5v h PHE 40 Cb 0.53 -0.41 -0.01 0.00 2.79 0.00 0.00 35.95 38.85 1d5v h PHE 40 CO 0.00 0.71 -0.19 1.88 -2.23 0.00 0.00 178.31 178.47 1d5v h TYR 41 N 1.27 0.00 -1.01 0.41 0.05 -1.62 -2.95 116.97 113.13 1d5v h TYR 41 Ca 0.40 0.00 0.01 0.00 0.05 0.00 0.00 58.73 59.19 1d5v h TYR 41 Cb 0.01 0.00 -0.05 0.00 1.01 0.00 0.00 36.73 37.70 1d5v h TYR 41 CO -0.00 0.19 0.66 0.00 -1.05 0.00 0.00 178.16 177.97 1d5v h ARG 42 N 0.00 1.33 -0.39 4.88 3.08 -1.48 -1.75 114.38 120.04 1d5v h ARG 42 Ca -0.00 -0.08 -0.10 0.00 0.07 0.00 0.00 59.98 59.86 1d5v h ARG 42 Cb 0.65 -0.30 -0.02 0.00 0.08 0.00 0.00 29.97 30.38 1d5v h ARG 42 CO 0.03 0.88 -0.18 1.49 -1.07 0.00 0.00 179.97 181.11 1d5v h GLU 43 N 1.36 0.74 -4.94 0.04 4.81 -1.57 -3.41 114.58 111.61 1d5v h GLU 43 Ca 0.37 -0.27 -0.66 0.00 -0.13 0.00 0.00 59.36 58.67 1d5v h GLU 43 Cb -0.16 -0.05 -0.25 0.00 0.63 0.00 0.00 28.75 28.93 1d5v h GLU 43 CO -0.08 0.87 -0.66 -0.80 -0.73 0.00 0.00 179.01 177.61 1d5v s ASN 44 N -6.74 4.84 -0.07 1.04 0.02 -0.66 -4.93 114.94 108.45 1d5v s ASN 44 Ca -0.09 -0.35 0.10 0.00 -1.02 0.00 0.00 52.86 51.50 1d5v s ASN 44 Cb 0.13 -1.85 0.17 0.00 0.02 0.00 0.00 41.25 39.72 1d5v s ASN 44 CO 0.82 -0.05 1.10 0.29 0.02 0.00 0.00 177.10 179.28 1d5v n LYS 45 N 4.87 2.22 0.00 -0.60 5.02 -1.26 -4.71 118.16 123.70 1d5v n LYS 45 Ca -0.17 -2.08 0.00 0.00 -2.02 0.00 0.00 58.31 54.04 1d5v n LYS 45 Cb 0.51 -1.28 0.00 0.00 -0.02 0.00 0.00 35.03 34.24 1d5v n LYS 45 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1d5v n GLN 46 N -0.88 0.00 0.00 1.97 6.02 -1.26 -4.57 117.38 118.66 1d5v n GLN 46 Ca 0.09 0.00 0.12 0.00 -0.01 0.00 0.00 57.00 57.20 1d5v n GLN 46 Cb 0.47 0.00 0.29 0.00 1.02 0.00 0.00 30.24 32.02 1d5v n GLN 46 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1d5v n GLY 47 N 0.00 -1.28 0.34 1.08 0.00 -1.26 -3.93 105.19 100.14 1d5v n GLY 47 Ca 0.00 -0.32 0.01 0.00 0.00 0.00 0.00 46.02 45.71 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 0.89 0.00 1.61 5.08 -1.91 0.23 115.95 121.85 1d5v h TRP 48 Ca 0.00 0.02 -0.00 0.00 1.08 0.00 0.00 58.89 59.99 1d5v h TRP 48 Cb 0.50 -0.30 -0.00 0.00 -3.00 0.00 0.00 29.16 26.36 1d5v h TRP 48 CO 0.00 0.56 -0.00 0.37 -1.28 0.00 0.00 178.44 178.09 1d5v h GLN 49 N 0.96 -0.00 -0.37 0.12 4.15 -1.81 -2.68 115.11 115.47 1d5v h GLN 49 Ca 0.26 0.00 -0.16 0.00 0.77 0.00 0.00 58.65 59.51 1d5v h GLN 49 Cb -0.11 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 27.58 1d5v h GLN 49 CO -0.06 -0.00 -0.41 -0.91 -1.93 0.00 0.00 178.83 175.52 1d5v h ASN 50 N -0.00 1.01 -0.61 -0.69 -0.26 -1.58 -3.16 115.58 110.27 1d5v h ASN 50 Ca -0.00 -0.47 0.08 0.00 -0.56 0.00 0.00 56.30 55.35 1d5v h ASN 50 Cb 0.00 -0.28 -0.04 0.00 -1.06 0.00 0.00 38.32 36.94 1d5v h ASN 50 CO 0.00 1.28 0.41 0.77 -1.06 0.00 0.00 177.43 178.82 1d5v h SER 51 N 0.76 0.44 -0.40 5.81 4.64 -0.43 -0.64 113.55 123.73 1d5v h SER 51 Ca 0.06 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.39 1d5v h SER 51 Cb 1.01 -0.09 -0.02 0.00 -0.31 0.00 0.00 62.40 62.99 1d5v h SER 51 CO 0.10 0.27 0.27 0.40 -0.87 0.00 0.00 176.83 177.00 1d5v h ILE 52 N 0.49 1.10 -0.18 0.95 1.08 -1.44 -1.44 117.51 118.08 1d5v h ILE 52 Ca 0.28 -0.19 -0.21 0.00 -0.39 0.00 0.00 64.86 64.35 1d5v h ILE 52 Cb 0.44 0.51 0.01 0.00 -3.07 0.00 0.00 36.82 34.71 1d5v h ILE 52 CO -0.08 0.10 -0.72 0.03 -0.69 0.00 0.00 178.15 176.79 1d5v h ARG 53 N 0.54 0.77 -1.01 2.37 3.08 -1.46 -2.97 114.38 115.71 1d5v h ARG 53 Ca 0.15 -0.60 0.01 0.00 0.07 0.00 0.00 59.98 59.61 1d5v h ARG 53 Cb -0.06 0.11 -0.05 0.00 0.08 0.00 0.00 29.97 30.05 1d5v h ARG 53 CO -0.03 1.21 0.67 1.25 -1.07 0.00 0.00 179.97 182.00 1d5v h HIS 54 N 0.54 1.27 0.00 3.04 2.76 -0.89 -2.02 115.15 119.85 1d5v h HIS 54 Ca -0.04 0.03 -0.08 0.00 -2.20 0.00 0.00 60.37 58.09 1d5v h HIS 54 Cb 1.34 -0.43 -0.01 0.00 1.55 0.00 0.00 27.41 29.86 1d5v h HIS 54 CO 0.08 0.80 -0.38 -2.95 -1.30 0.00 0.00 177.93 174.18 1d5v h ASN 55 N 1.36 0.00 -0.53 3.26 7.08 -1.28 -3.10 115.58 122.37 1d5v h ASN 55 Ca 0.37 0.00 -0.04 0.00 -3.08 0.00 0.00 56.30 53.54 1d5v h ASN 55 Cb -0.16 0.00 -0.02 0.00 -2.08 0.00 0.00 38.32 36.06 1d5v h ASN 55 CO -0.08 0.38 0.16 -0.07 -2.08 0.00 0.00 177.43 175.73 1d5v h LEU 56 N 0.00 0.78 -0.35 6.14 3.38 -1.20 0.16 115.31 124.22 1d5v h LEU 56 Ca -0.00 -0.21 -0.16 0.00 0.09 0.00 0.00 57.88 57.60 1d5v h LEU 56 Cb 1.04 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.58 1d5v h LEU 56 CO 0.05 0.78 -0.39 0.77 0.09 0.00 0.00 178.44 179.75 1d5v h SER 57 N 0.73 0.95 -0.41 -0.43 4.64 -1.54 -3.15 113.55 114.34 1d5v h SER 57 Ca 0.17 -0.48 -0.16 0.00 -0.47 0.00 0.00 61.79 60.86 1d5v h SER 57 Cb 0.29 -0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 62.10 1d5v h SER 57 CO -0.00 1.24 -0.35 -0.07 -0.87 0.00 0.00 176.83 176.77 1d5v h LEU 58 N 0.69 1.02 -9.10 5.97 3.38 -1.45 -3.41 115.31 112.41 1d5v h LEU 58 Ca 0.05 -0.45 -0.57 0.00 0.09 0.00 0.00 57.88 57.00 1d5v h LEU 58 Cb 0.98 -0.29 -0.04 0.00 0.09 0.00 0.00 40.66 41.40 1d5v h LEU 58 CO 0.09 1.26 0.92 0.20 0.09 0.00 0.00 178.44 181.00 1d5v s ASN 59 N -6.82 6.87 0.00 -0.43 0.02 0.55 -4.86 114.94 110.27 1d5v s ASN 59 Ca -0.11 1.57 0.26 0.00 -1.02 0.00 0.00 52.86 53.56 1d5v s ASN 59 Cb 0.11 -2.54 0.76 0.00 0.02 0.00 0.00 41.25 39.61 1d5v s ASN 59 CO 0.88 -0.85 1.57 -0.62 0.02 0.00 0.00 177.10 178.10 1d5v n GLU 60 N 6.80 0.72 -0.37 -0.60 1.02 -1.26 -3.98 120.64 122.97 1d5v n GLU 60 Ca 0.14 -0.41 -0.02 0.00 -0.02 0.00 0.00 57.16 56.85 1d5v n GLU 60 Cb 0.45 -1.49 0.10 0.00 -0.02 0.00 0.00 31.44 30.49 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 -6.05 3.52 -0.16 0.00 0.08 -1.26 -4.15 117.98 109.96 1d5v s PHE 62 Ca -0.13 1.31 -0.00 0.00 0.12 0.00 0.00 56.93 58.23 1d5v s PHE 62 Cb 0.18 -2.58 -0.00 0.00 -0.57 0.00 0.00 43.02 40.04 1d5v s PHE 62 CO 0.82 0.22 -0.14 0.08 -0.10 0.00 0.00 175.22 176.10 1d5v s VAL 63 N -1.74 2.73 0.01 -0.44 1.01 -0.62 -4.97 120.40 116.38 1d5v s VAL 63 Ca 0.48 -0.74 -0.30 0.00 0.00 0.00 0.00 61.98 61.42 1d5v s VAL 63 Cb -0.14 -2.16 -0.03 0.00 0.00 0.00 0.00 36.38 34.05 1d5v s VAL 63 CO 0.19 0.51 1.02 -0.75 0.00 0.00 0.00 175.10 176.07 1d5v s LYS 64 N 0.91 4.54 -0.41 2.72 2.20 -1.26 -2.61 119.74 125.83 1d5v s LYS 64 Ca -0.03 1.48 -0.03 0.00 -0.36 0.00 0.00 55.97 57.02 1d5v s LYS 64 Cb -0.15 -3.44 0.11 0.00 -1.51 0.00 0.00 37.83 32.84 1d5v s LYS 64 CO -0.01 -0.08 0.21 0.08 -0.36 0.00 0.00 175.35 175.18 1d5v s VAL 65 N 1.02 3.35 1.08 4.02 1.01 0.15 -4.95 120.40 126.08 1d5v s VAL 65 Ca 0.53 -2.01 -0.18 0.00 0.00 0.00 0.00 61.98 60.32 1d5v s VAL 65 Cb -0.22 -3.28 0.08 0.00 0.00 0.00 0.00 36.38 32.95 1d5v s VAL 65 CO 0.28 -0.68 0.02 -2.65 0.00 0.00 0.00 175.10 172.07 1d5v n PRO 66 N 4.62 -1.27 -4.23 2.72 -0.02 -1.26 -1.53 135.00 134.03 1d5v n PRO 66 Ca -0.03 -0.35 -0.23 0.00 -2.02 0.00 0.00 63.50 60.87 1d5v n PRO 66 Cb 0.41 -1.70 -0.07 0.00 -0.02 0.00 0.00 33.50 32.13 1d5v n PRO 66 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 1d5v s ARG 67 N -3.41 2.36 0.49 -0.52 3.52 -1.25 -4.73 118.95 115.41 1d5v s ARG 67 Ca 0.55 -1.43 -0.22 0.00 -0.13 0.00 0.00 55.73 54.50 1d5v s ARG 67 Cb -0.13 -2.19 -0.07 0.00 -1.56 0.00 0.00 34.95 31.01 1d5v s ARG 67 CO 0.67 0.29 1.17 -0.51 -0.81 0.00 0.00 175.30 176.11 1d5v s ASP 68 N -3.73 5.97 0.31 -2.12 1.01 -1.26 -4.91 116.67 111.93 1d5v s ASP 68 Ca 0.33 2.31 0.25 0.00 0.71 0.00 0.00 52.55 56.15 1d5v s ASP 68 Cb -0.05 -2.60 0.66 0.00 1.01 0.00 0.00 42.92 41.94 1d5v s ASP 68 CO 0.21 -1.05 1.72 0.44 0.21 0.00 0.00 175.17 176.69 1d5v h ASP 69 N 1.76 0.00 -1.01 0.27 3.32 -2.01 -3.26 116.42 115.49 1d5v h ASP 69 Ca -0.50 0.00 0.01 0.00 0.02 0.00 0.00 57.03 56.56 1d5v h ASP 69 Cb 1.26 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 40.76 1d5v h ASP 69 CO 0.59 0.00 0.66 0.11 -1.72 0.00 0.00 179.24 178.88 1d5v h LYS 70 N 0.00 1.33 -3.19 3.56 1.57 -2.06 -3.31 116.57 114.47 1d5v h LYS 70 Ca 0.00 -0.08 -0.63 0.00 -1.87 0.00 0.00 60.65 58.07 1d5v h LYS 70 Cb 0.81 -0.30 -0.41 0.00 0.08 0.00 0.00 32.23 32.41 1d5v h LYS 70 CO 0.00 0.88 -0.62 0.21 -0.57 0.00 0.00 179.45 179.35 1d5v s LYS 71 N -6.11 2.13 0.29 3.15 2.20 -1.23 -5.10 119.74 115.08 1d5v s LYS 71 Ca -0.13 -2.91 -0.22 0.00 -0.36 0.00 0.00 55.97 52.35 1d5v s LYS 71 Cb 0.18 -3.25 -0.09 0.00 -1.51 0.00 0.00 37.83 33.15 1d5v s LYS 71 CO 0.82 -1.20 0.83 -1.25 -0.36 0.00 0.00 175.35 174.19 1d5v s PRO 72 N -0.79 4.35 0.00 4.03 0.04 -1.25 -4.73 135.00 136.66 1d5v s PRO 72 Ca 0.21 1.05 0.00 0.00 0.04 0.00 0.00 61.00 62.30 1d5v s PRO 72 Cb -0.15 -2.74 0.00 0.00 0.04 0.00 0.00 34.50 31.65 1d5v s PRO 72 CO -0.08 0.29 0.00 0.41 0.04 0.00 0.00 177.00 177.65 1d5v n GLY 73 N 0.42 0.95 3.56 0.56 0.00 -1.26 -5.14 105.19 104.29 1d5v n GLY 73 Ca 0.01 -0.07 -0.28 0.00 0.00 0.00 0.00 46.02 45.68 1d5v n GLY 73 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1d5v s LYS 74 N 0.00 2.04 0.00 1.61 1.02 -1.26 -5.09 119.74 118.06 1d5v s LYS 74 Ca 0.00 -1.17 0.00 0.00 0.02 0.00 0.00 55.97 54.82 1d5v s LYS 74 Cb 0.00 -2.20 0.00 0.00 -0.52 0.00 0.00 37.83 35.11 1d5v s LYS 74 CO 0.00 0.47 0.28 0.41 -0.92 0.00 0.00 175.35 175.58 1d5v n GLY 75 N 0.39 -0.59 3.80 -3.33 0.00 -1.26 -4.84 105.19 99.35 1d5v n GLY 75 Ca -0.12 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 45.82 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 -1.70 -0.21 0.23 1.61 0.15 -1.26 -3.92 113.70 108.60 1d5v s SER 76 Ca 0.00 -0.70 0.07 0.00 0.70 0.00 0.00 55.95 56.02 1d5v s SER 76 Cb 0.00 0.70 -0.04 0.00 -1.71 0.00 0.00 66.02 64.97 1d5v s SER 76 CO 0.00 -1.31 0.12 -0.31 1.20 0.00 0.00 173.24 172.94 1d5v s TYR 77 N -3.90 2.99 -0.06 3.44 2.02 -0.58 -4.06 117.35 117.20 1d5v s TYR 77 Ca 0.14 -0.12 0.06 0.00 -0.37 0.00 0.00 57.07 56.77 1d5v s TYR 77 Cb -0.05 -1.37 -0.01 0.00 -0.40 0.00 0.00 41.96 40.13 1d5v s TYR 77 CO 0.08 0.54 -0.25 -1.58 -1.57 0.00 0.00 175.55 172.77 1d5v s TRP 78 N -2.07 2.44 0.11 2.71 0.52 -0.19 0.30 118.94 122.77 1d5v s TRP 78 Ca 0.32 -0.71 -0.13 0.00 0.02 0.00 0.00 56.10 55.60 1d5v s TRP 78 Cb -0.08 -1.60 0.02 0.00 -1.15 0.00 0.00 33.47 30.66 1d5v s TRP 78 CO 0.23 -0.21 0.31 -0.08 0.02 0.00 0.00 176.95 177.22 1d5v s THR 79 N -0.18 0.10 0.64 2.01 -1.32 -1.07 -3.52 115.64 112.30 1d5v s THR 79 Ca -0.03 -0.88 -0.11 0.00 -1.21 0.00 0.00 61.69 59.46 1d5v s THR 79 Cb -0.14 -1.28 -0.02 0.00 -1.51 0.00 0.00 72.50 69.55 1d5v s THR 79 CO 0.03 -0.45 1.04 -0.76 -2.21 0.00 0.00 174.62 172.27 1d5v s LEU 80 N -2.84 3.22 -0.09 9.08 1.43 -1.26 -1.59 118.68 126.63 1d5v s LEU 80 Ca 0.05 1.52 -0.30 0.00 -1.03 0.00 0.00 54.13 54.37 1d5v s LEU 80 Cb 0.03 -4.48 -0.02 0.00 0.03 0.00 0.00 46.19 41.75 1d5v s LEU 80 CO -0.11 -1.09 1.16 -1.81 0.23 0.00 0.00 176.35 174.73 1d5v s ASP 81 N -3.93 7.08 0.00 2.29 1.11 -1.26 -4.85 116.67 117.11 1d5v s ASP 81 Ca 0.57 1.71 0.00 0.00 0.18 0.00 0.00 52.55 55.00 1d5v s ASP 81 Cb -0.12 -2.55 0.00 0.00 1.07 0.00 0.00 42.92 41.31 1d5v s ASP 81 CO 0.53 -0.58 0.89 -2.65 1.18 0.00 0.00 175.17 174.54 1d5v n PRO 82 N 5.43 0.00 -2.65 8.23 -0.02 -1.26 -4.54 135.00 140.18 1d5v n PRO 82 Ca 0.11 0.68 -0.02 0.00 -2.02 0.00 0.00 63.50 62.26 1d5v n PRO 82 Cb 0.47 -1.39 0.12 0.00 -0.02 0.00 0.00 33.50 32.67 1d5v n PRO 82 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 1d5v n ASP 83 N -2.20 -1.11 -4.51 2.55 -0.08 -1.26 -5.06 116.55 104.88 1d5v n ASP 83 Ca 0.00 -2.19 -0.16 0.00 -1.51 0.00 0.00 54.79 50.92 1d5v n ASP 83 Cb 0.00 0.55 -0.14 0.00 2.34 0.00 0.00 41.12 43.87 1d5v n ASP 83 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 1d5v n SER 84 N -1.42 0.14 -0.03 1.67 7.64 -1.26 -4.70 113.62 115.66 1d5v n SER 84 Ca -0.15 -1.12 -0.13 0.00 1.01 0.00 0.00 58.87 58.47 1d5v n SER 84 Cb 0.87 -1.11 -0.09 0.00 -1.01 0.00 0.00 64.21 62.86 1d5v n SER 84 CO 0.00 0.00 0.00 0.22 -3.01 0.00 0.00 175.04 172.25 1d5v h TYR 85 N 11.71 0.14 0.00 1.43 5.03 -2.00 -3.40 116.97 129.89 1d5v h TYR 85 Ca 0.02 -0.05 -0.15 0.00 2.58 0.00 0.00 58.73 61.13 1d5v h TYR 85 Cb 1.06 -0.03 -0.25 0.00 1.55 0.00 0.00 36.73 39.06 1d5v h TYR 85 CO 1.28 0.62 -0.64 -1.71 -1.32 0.00 0.00 178.16 176.39 1d5v n ASN 86 N -4.73 -0.02 -4.73 -2.11 2.85 -1.26 -5.10 115.26 100.15 1d5v n ASN 86 Ca -0.08 -1.98 -0.40 0.00 -0.11 0.00 0.00 54.58 52.01 1d5v n ASN 86 Cb 0.31 0.00 -0.05 0.00 1.24 0.00 0.00 39.78 41.29 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 0.00 4.48 0.00 1.20 -1.94 -1.26 -4.93 119.30 116.84 1d5v s MET 87 Ca 0.16 1.03 0.25 0.00 -1.71 0.00 0.00 55.69 55.42 1d5v s MET 87 Cb 0.18 -3.40 0.42 0.00 2.01 0.00 0.00 34.83 34.04 1d5v s MET 87 CO -0.08 0.18 1.39 1.19 -0.01 0.00 0.00 175.02 177.69 1d5v n PHE 88 N 3.23 0.00 -4.08 -0.03 3.72 -1.26 -4.94 117.46 114.11 1d5v n PHE 88 Ca -0.01 0.00 -0.07 0.00 -0.05 0.00 0.00 57.45 57.31 1d5v n PHE 88 Cb 0.51 -0.00 -0.10 0.00 -0.94 0.00 0.00 39.48 38.95 1d5v n PHE 88 CO 0.00 0.00 0.00 -1.83 -0.05 0.00 0.00 176.76 174.88 1d5v s GLU 89 N -2.00 0.59 -0.08 -1.08 1.03 -1.26 -5.15 118.70 110.74 1d5v s GLU 89 Ca 0.31 -1.16 0.03 0.00 0.03 0.00 0.00 54.97 54.18 1d5v s GLU 89 Cb 0.20 0.20 0.01 0.00 -0.80 0.00 0.00 34.13 33.74 1d5v s GLU 89 CO 0.31 -0.11 -0.17 1.21 -1.33 0.00 0.00 175.26 175.18 1d5v s ASN 90 N -2.79 2.26 0.00 0.83 2.47 -1.26 -5.01 114.94 111.44 1d5v s ASN 90 Ca 0.05 -0.39 0.00 0.00 0.42 0.00 0.00 52.86 52.93 1d5v s ASN 90 Cb 0.06 -1.04 0.00 0.00 -1.45 0.00 0.00 41.25 38.82 1d5v s ASN 90 CO -0.09 0.08 0.00 0.61 -3.72 0.00 0.00 177.10 173.98 1d5v n GLY 91 N 3.71 -1.69 3.23 1.21 0.00 -1.26 -5.06 105.19 105.33 1d5v n GLY 91 Ca -0.21 0.74 -0.42 0.00 0.00 0.00 0.00 46.02 46.12 1d5v n GLY 91 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1d5v s SER 92 N 2.00 6.18 -0.18 1.61 0.15 -1.26 -5.04 113.70 117.16 1d5v s SER 92 Ca 0.00 -2.86 -0.07 0.00 0.70 0.00 0.00 55.95 53.72 1d5v s SER 92 Cb 0.00 -2.06 -0.04 0.00 -1.71 0.00 0.00 66.02 62.21 1d5v s SER 92 CO 0.00 -0.46 0.07 0.72 1.20 0.00 0.00 173.24 174.76 1d5v s PHE 93 N -0.08 3.27 -1.43 3.44 -0.71 -1.26 -5.25 117.98 115.96 1d5v s PHE 93 Ca 0.19 0.11 0.11 0.00 -1.04 0.00 0.00 56.93 56.30 1d5v s PHE 93 Cb -0.14 -2.06 0.09 0.00 -1.21 0.00 0.00 43.02 39.70 1d5v s PHE 93 CO -0.07 0.20 0.86 1.28 -1.34 0.00 0.00 175.22 176.15