#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1n8v s TYR 4 N 0.00 2.57 0.51 5.64 2.02 -0.61 -4.96 117.35 122.52 1n8v s TYR 4 Ca 0.00 1.50 -0.23 0.00 -0.37 0.00 0.00 57.07 57.97 1n8v s TYR 4 Cb 0.00 -3.47 -0.06 0.00 -0.40 0.00 0.00 41.96 38.03 1n8v s TYR 4 CO 0.00 -1.99 1.39 -2.37 -1.57 0.00 0.00 175.55 171.01 1n8v n THR 5 N -1.11 3.48 -0.43 -0.71 5.66 -1.26 -4.79 114.28 115.12 1n8v n THR 5 Ca 0.11 -0.50 0.09 0.00 -3.05 0.00 0.00 64.05 60.70 1n8v n THR 5 Cb 0.49 -1.74 0.28 0.00 -1.55 0.00 0.00 70.33 67.80 1n8v n THR 5 CO 0.00 0.00 0.00 -0.90 -3.05 0.00 0.00 175.07 171.12 1n8v n ASP 6 N -0.73 3.88 0.29 1.09 5.68 -1.26 -4.66 116.55 120.85 1n8v n ASP 6 Ca 0.08 -2.20 0.18 0.00 -0.50 0.00 0.00 54.79 52.35 1n8v n ASP 6 Cb 0.43 -0.44 0.83 0.00 -1.14 0.00 0.00 41.12 40.80 1n8v n ASP 6 CO 0.00 0.00 0.00 0.07 -1.33 0.00 0.00 177.20 175.94 1n8v h LYS 7 N 3.38 0.00 -0.44 0.11 2.10 -2.04 -1.91 116.57 117.76 1n8v h LYS 7 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 1n8v h LYS 7 Cb 1.08 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.41 1n8v h LYS 7 CO 0.08 0.02 0.00 0.66 -2.00 0.00 0.00 179.45 178.22 1n8v n TYR 8 N -3.16 0.58 0.55 0.07 4.01 -1.26 -4.67 117.16 113.27 1n8v n TYR 8 Ca -0.01 -0.37 0.07 0.00 -0.16 0.00 0.00 57.90 57.43 1n8v n TYR 8 Cb 0.24 -0.01 0.32 0.00 -0.31 0.00 0.00 39.34 39.58 1n8v n TYR 8 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 1n8v n ASP 9 N 1.19 0.00 -0.85 7.72 9.92 -0.72 -1.93 116.55 131.89 1n8v n ASP 9 Ca 0.18 0.36 0.11 0.00 -0.53 0.00 0.00 54.79 54.91 1n8v n ASP 9 Cb 0.53 -0.43 0.28 0.00 -0.64 0.00 0.00 41.12 40.87 1n8v n ASP 9 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 1n8v n ASN 10 N -1.43 2.56 -4.75 -2.24 5.03 -1.26 -4.93 115.26 108.25 1n8v n ASN 10 Ca 0.05 -1.85 -0.41 0.00 0.87 0.00 0.00 54.58 53.23 1n8v n ASN 10 Cb 0.15 -0.15 -0.02 0.00 -1.02 0.00 0.00 39.78 38.74 1n8v n ASN 10 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.26 174.92 1n8v s ILE 11 N -1.70 2.30 -0.56 2.41 2.07 -0.81 -4.91 121.20 120.00 1n8v s ILE 11 Ca 0.35 0.25 -0.27 0.00 -1.41 0.00 0.00 60.65 59.57 1n8v s ILE 11 Cb 0.20 -3.16 0.03 0.00 0.13 0.00 0.00 42.46 39.66 1n8v s ILE 11 CO 0.29 0.04 1.10 0.21 -1.91 0.00 0.00 174.94 174.68 1n8v s ASN 12 N 0.46 6.43 0.30 4.50 3.84 -1.26 -4.88 114.94 124.32 1n8v s ASN 12 Ca 0.62 -0.00 0.11 0.00 0.21 0.00 0.00 52.86 53.79 1n8v s ASN 12 Cb -0.45 -2.51 0.48 0.00 -0.55 0.00 0.00 41.25 38.21 1n8v s ASN 12 CO 0.46 -1.38 1.69 -0.07 -2.79 0.00 0.00 177.10 175.01 1n8v h LEU 13 N 11.55 0.04 -0.93 3.21 3.38 -1.97 -3.13 115.31 127.45 1n8v h LEU 13 Ca -0.25 -0.02 -0.03 0.00 0.09 0.00 0.00 57.88 57.67 1n8v h LEU 13 Cb 1.06 -0.01 -0.04 0.00 0.09 0.00 0.00 40.66 41.77 1n8v h LEU 13 CO 1.15 0.55 0.36 0.44 0.09 0.00 0.00 178.44 181.02 1n8v h ASP 14 N 0.03 1.02 -0.62 -0.43 3.32 -1.99 -1.12 116.42 116.63 1n8v h ASP 14 Ca -0.00 -0.13 -0.09 0.00 0.02 0.00 0.00 57.03 56.83 1n8v h ASP 14 Cb 0.93 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 40.19 1n8v h ASP 14 CO 0.07 0.88 0.03 -0.33 -1.72 0.00 0.00 179.24 178.16 1n8v h GLU 15 N 1.11 1.09 -0.20 3.56 5.08 -1.97 -2.06 114.58 121.20 1n8v h GLU 15 Ca 0.27 -0.33 -0.02 0.00 -1.00 0.00 0.00 59.36 58.27 1n8v h GLU 15 Cb 0.14 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 1n8v h GLU 15 CO -0.03 1.04 0.04 0.82 -1.00 0.00 0.00 179.01 179.88 1n8v h ILE 16 N 1.00 1.21 0.00 3.13 2.04 -1.46 -2.96 117.51 120.47 1n8v h ILE 16 Ca 0.18 -0.69 -0.03 0.00 1.00 0.00 0.00 64.86 65.32 1n8v h ILE 16 Cb 0.53 1.29 -0.00 0.00 -0.74 0.00 0.00 36.82 37.90 1n8v h ILE 16 CO 0.03 0.21 -0.14 -0.07 0.00 0.00 0.00 178.15 178.18 1n8v h LEU 17 N 0.13 0.00 -0.53 1.44 3.38 -1.11 -2.62 115.31 116.00 1n8v h LEU 17 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1n8v h LEU 17 Cb 0.29 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.04 1n8v h LEU 17 CO 0.00 0.14 -0.08 0.00 0.09 0.00 0.00 178.44 178.60 1n8v n ALA 18 N -2.27 2.74 -3.85 1.53 0.00 -0.78 -4.71 120.51 113.16 1n8v n ALA 18 Ca -0.01 -0.35 -0.30 0.00 0.00 0.00 0.00 53.44 52.78 1n8v n ALA 18 Cb 0.28 -1.26 -0.16 0.00 0.00 0.00 0.00 19.45 18.31 1n8v n ALA 18 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 1n8v s ASN 19 N -2.22 3.82 0.26 0.00 3.84 -0.99 -5.02 114.94 114.63 1n8v s ASN 19 Ca 0.35 -1.35 -0.03 0.00 0.21 0.00 0.00 52.86 52.04 1n8v s ASN 19 Cb 0.21 -1.02 0.44 0.00 -0.55 0.00 0.00 41.25 40.32 1n8v s ASN 19 CO 0.41 -0.32 1.82 0.50 -2.79 0.00 0.00 177.10 176.73 1n8v h LYS 20 N 8.01 0.86 -0.86 0.43 1.63 -1.84 -1.02 116.57 123.77 1n8v h LYS 20 Ca -0.15 -0.05 0.00 0.00 -0.85 0.00 0.00 60.65 59.60 1n8v h LYS 20 Cb 1.06 -0.19 -0.04 0.00 -0.60 0.00 0.00 32.23 32.45 1n8v h LYS 20 CO 0.43 0.57 0.55 0.00 -3.45 0.00 0.00 179.45 177.54 1n8v h ARG 21 N 0.88 1.15 -0.24 1.90 2.47 -1.95 0.30 114.38 118.89 1n8v h ARG 21 Ca 0.43 -0.08 -0.12 0.00 -1.26 0.00 0.00 59.98 58.94 1n8v h ARG 21 Cb 0.37 -0.25 -0.00 0.00 -1.65 0.00 0.00 29.97 28.44 1n8v h ARG 21 CO -0.24 0.78 -0.32 -0.07 0.56 0.00 0.00 179.97 180.68 1n8v h LEU 22 N 1.18 0.71 -0.31 3.04 3.38 -1.54 -2.76 115.31 119.01 1n8v h LEU 22 Ca 0.31 -0.50 -0.02 0.00 0.09 0.00 0.00 57.88 57.77 1n8v h LEU 22 Cb -0.10 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.44 1n8v h LEU 22 CO -0.06 1.07 0.13 0.25 0.09 0.00 0.00 178.44 179.92 1n8v h LEU 23 N 0.36 0.41 -1.40 1.67 5.85 -1.01 -2.96 115.31 118.23 1n8v h LEU 23 Ca 0.03 -0.15 -0.03 0.00 0.84 0.00 0.00 57.88 58.56 1n8v h LEU 23 Cb 0.91 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.81 1n8v h LEU 23 CO 0.08 0.45 0.04 0.58 -0.34 0.00 0.00 178.44 179.25 1n8v h VAL 24 N 0.35 1.16 -0.62 1.05 2.07 -0.95 -0.62 116.25 118.68 1n8v h VAL 24 Ca 0.10 -0.59 0.00 0.00 0.82 0.00 0.00 66.70 67.03 1n8v h VAL 24 Cb 0.16 0.90 -0.03 0.00 -1.52 0.00 0.00 31.29 30.80 1n8v h VAL 24 CO -0.01 0.21 0.39 0.00 0.02 0.00 0.00 177.57 178.18 1n8v h ALA 25 N 1.63 0.79 -0.38 1.67 0.00 -1.33 0.90 119.26 122.53 1n8v h ALA 25 Ca 0.10 -0.06 -0.15 0.00 0.00 0.00 0.00 54.91 54.79 1n8v h ALA 25 Cb 0.22 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1n8v h ALA 25 CO 0.00 0.25 -0.36 1.88 0.00 0.00 0.00 179.25 181.02 1n8v h TYR 26 N 0.84 1.10 -0.31 0.00 0.05 -1.26 -2.51 116.97 114.88 1n8v h TYR 26 Ca 0.22 -0.32 -0.01 0.00 0.05 0.00 0.00 58.73 58.67 1n8v h TYR 26 Cb -0.06 -0.23 -0.01 0.00 1.01 0.00 0.00 36.73 37.44 1n8v h TYR 26 CO -0.02 1.15 0.17 0.28 -1.05 0.00 0.00 178.16 178.68 1n8v h VAL 27 N 0.73 1.14 -0.36 -2.88 2.07 -0.81 -1.30 116.25 114.84 1n8v h VAL 27 Ca 0.06 -0.36 -0.04 0.00 0.82 0.00 0.00 66.70 67.18 1n8v h VAL 27 Cb 0.95 0.80 -0.02 0.00 -1.52 0.00 0.00 31.29 31.51 1n8v h VAL 27 CO 0.09 0.14 0.05 0.78 0.02 0.00 0.00 177.57 178.65 1n8v h ASN 28 N 0.38 0.49 0.17 0.57 -0.26 -0.84 0.24 115.58 116.34 1n8v h ASN 28 Ca 0.11 -0.08 -0.01 0.00 -0.56 0.00 0.00 56.30 55.76 1n8v h ASN 28 Cb 0.07 -0.13 0.00 0.00 -1.06 0.00 0.00 38.32 37.20 1n8v h ASN 28 CO -0.02 0.53 -0.08 0.00 -1.06 0.00 0.00 177.43 176.80 1n8v h VAL 30 N -0.44 1.08 -0.02 0.00 2.07 -0.97 -1.16 116.25 116.81 1n8v h VAL 30 Ca -0.02 -1.15 0.00 0.00 0.82 0.00 0.00 66.70 66.35 1n8v h VAL 30 Cb 0.34 1.64 0.00 0.00 -1.52 0.00 0.00 31.29 31.76 1n8v h VAL 30 CO 0.04 0.31 0.00 0.23 0.02 0.00 0.00 177.57 178.17 1n8v n MET 31 N -3.94 1.12 -3.55 1.57 2.00 0.05 -4.92 117.12 109.45 1n8v n MET 31 Ca -0.02 -0.19 -0.23 0.00 0.00 0.00 0.00 57.70 57.27 1n8v n MET 31 Cb 0.38 -1.35 0.08 0.00 0.00 0.00 0.00 33.22 32.33 1n8v n MET 31 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 175.97 176.36 1n8v n GLU 32 N -0.64 -7.65 0.00 0.03 1.02 -0.44 -4.90 120.64 108.05 1n8v n GLU 32 Ca 0.16 0.82 0.00 0.00 -0.02 0.00 0.00 57.16 58.12 1n8v n GLU 32 Cb 0.12 -5.82 0.00 0.00 -0.02 0.00 0.00 31.44 25.72 1n8v n GLU 32 CO 0.00 0.00 0.00 2.89 1.18 0.00 0.00 177.13 181.20 1n8v n ARG 33 N -4.80 0.31 -3.90 3.49 1.85 -0.49 -5.06 116.66 108.06 1n8v n ARG 33 Ca -0.04 -0.48 -0.09 0.00 -1.00 0.00 0.00 57.85 56.24 1n8v n ARG 33 Cb 0.58 -0.63 -0.06 0.00 -1.05 0.00 0.00 32.46 31.30 1n8v n ARG 33 CO 0.00 0.00 0.00 0.20 -0.01 0.00 0.00 177.63 177.82 1n8v s GLY 34 N -0.14 0.32 0.56 2.89 0.00 -0.81 -4.94 107.32 105.19 1n8v s GLY 34 Ca 0.00 -0.71 -0.20 0.00 0.00 0.00 0.00 44.72 43.81 1n8v s GLY 34 CO 0.00 -0.69 1.19 0.54 0.00 0.00 0.00 173.10 174.14 1n8v s LYS 35 N -3.94 3.19 -0.02 2.90 -0.14 -1.26 -4.12 119.74 116.35 1n8v s LYS 35 Ca 0.15 1.79 0.02 0.00 -1.36 0.00 0.00 55.97 56.56 1n8v s LYS 35 Cb 0.02 -2.03 -0.03 0.00 -1.68 0.00 0.00 37.83 34.11 1n8v s LYS 35 CO -0.01 -1.02 -0.03 0.00 -0.76 0.00 0.00 175.35 173.52 1n8v s SER 37 N -1.33 4.94 0.23 0.00 1.04 -1.26 -4.83 113.70 112.49 1n8v s SER 37 Ca 0.17 0.86 -0.06 0.00 0.48 0.00 0.00 55.95 57.40 1n8v s SER 37 Cb -0.11 -1.51 0.32 0.00 0.10 0.00 0.00 66.02 64.82 1n8v s SER 37 CO 0.07 -1.62 1.82 -0.65 0.98 0.00 0.00 173.24 173.84 1n8v h PRO 38 N -0.81 0.76 -0.52 4.02 0.11 -2.00 -0.43 132.00 133.14 1n8v h PRO 38 Ca -0.45 -0.05 -0.10 0.00 0.11 0.00 0.00 66.00 65.51 1n8v h PRO 38 Cb 1.30 -0.17 -0.02 0.00 0.11 0.00 0.00 31.00 32.22 1n8v h PRO 38 CO 0.64 0.50 -0.08 0.93 -0.21 0.00 0.00 178.00 179.78 1n8v h GLU 39 N 0.78 0.97 -0.65 1.05 3.07 -1.99 -2.03 114.58 115.78 1n8v h GLU 39 Ca 0.36 -0.35 -0.05 0.00 -0.50 0.00 0.00 59.36 58.81 1n8v h GLU 39 Cb 0.26 -0.07 -0.03 0.00 -0.84 0.00 0.00 28.75 28.07 1n8v h GLU 39 CO -0.21 1.02 0.21 0.78 -1.40 0.00 0.00 179.01 179.42 1n8v h GLY 40 N 0.84 1.09 0.98 -3.84 0.00 -1.80 -0.90 103.07 99.43 1n8v h GLY 40 Ca 0.14 -0.64 -0.03 0.00 0.00 0.00 0.00 47.33 46.80 1n8v h GLY 40 CO 0.04 0.60 0.21 1.70 0.00 0.00 0.00 176.54 179.08 1n8v h LYS 41 N 0.94 0.81 -0.49 4.80 3.64 -1.00 -0.02 116.57 125.25 1n8v h LYS 41 Ca 0.21 -0.15 -0.01 0.00 -1.27 0.00 0.00 60.65 59.43 1n8v h LYS 41 Cb 0.28 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 31.95 1n8v h LYS 41 CO -0.01 0.72 0.26 1.49 -2.27 0.00 0.00 179.45 179.64 1n8v h GLU 42 N 0.73 0.69 -0.04 1.90 4.57 -1.10 -1.24 114.58 120.08 1n8v h GLU 42 Ca 0.18 -0.09 -0.00 0.00 -1.18 0.00 0.00 59.36 58.27 1n8v h GLU 42 Cb 0.22 -0.13 -0.00 0.00 -0.16 0.00 0.00 28.75 28.67 1n8v h GLU 42 CO -0.01 0.55 0.02 1.25 -1.18 0.00 0.00 179.01 179.64 1n8v h LEU 43 N 0.65 0.05 -1.07 1.64 5.85 -0.95 -2.78 115.31 118.70 1n8v h LEU 43 Ca 0.17 -0.08 0.12 0.00 0.84 0.00 0.00 57.88 58.93 1n8v h LEU 43 Cb 0.07 -0.01 -0.08 0.00 0.37 0.00 0.00 40.66 41.01 1n8v h LEU 43 CO -0.03 0.12 0.62 0.50 -0.34 0.00 0.00 178.44 179.31 1n8v h LYS 44 N -0.02 0.92 0.00 1.25 3.64 -0.75 -1.06 116.57 120.55 1n8v h LYS 44 Ca 0.01 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.34 1n8v h LYS 44 Cb 0.08 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 31.69 1n8v h LYS 44 CO -0.00 0.61 0.00 0.39 -2.27 0.00 0.00 179.45 178.18 1n8v n GLU 45 N -4.60 0.12 0.00 1.90 1.02 -0.49 -3.51 120.64 115.08 1n8v n GLU 45 Ca 0.18 0.21 0.01 0.00 -0.02 0.00 0.00 57.16 57.54 1n8v n GLU 45 Cb 0.36 -1.67 -0.01 0.00 -0.02 0.00 0.00 31.44 30.11 1n8v n GLU 45 CO 0.00 0.00 0.00 0.72 1.18 0.00 0.00 177.13 179.03 1n8v n HIS 46 N -1.87 0.00 -0.13 -0.32 8.25 -0.75 -4.80 115.22 115.60 1n8v n HIS 46 Ca 0.05 0.00 -0.09 0.00 -0.26 0.00 0.00 57.72 57.41 1n8v n HIS 46 Cb 0.30 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 31.40 1n8v n HIS 46 CO 0.00 0.00 0.00 1.25 0.64 0.00 0.00 176.34 178.23 1n8v h LEU 47 N 0.07 0.55 -0.34 2.41 5.85 -1.26 -1.92 115.31 120.66 1n8v h LEU 47 Ca 0.00 -0.20 0.01 0.00 0.84 0.00 0.00 57.88 58.53 1n8v h LEU 47 Cb 0.04 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 40.91 1n8v h LEU 47 CO 0.00 0.60 0.21 -0.61 -0.34 0.00 0.00 178.44 178.30 1n8v h GLN 48 N 0.47 0.42 -0.58 1.25 5.75 -1.87 -1.63 115.11 118.91 1n8v h GLN 48 Ca 0.12 -0.03 0.05 0.00 -0.15 0.00 0.00 58.65 58.65 1n8v h GLN 48 Cb 0.24 -0.09 -0.05 0.00 1.07 0.00 0.00 27.48 28.65 1n8v h GLN 48 CO -0.01 0.28 0.31 0.22 -2.65 0.00 0.00 178.83 176.98 1n8v h ASP 49 N 0.43 0.46 -0.11 -0.69 3.58 -1.85 -1.43 116.42 116.81 1n8v h ASP 49 Ca 0.13 0.03 -0.05 0.00 0.42 0.00 0.00 57.03 57.56 1n8v h ASP 49 Cb -0.02 -0.06 -0.01 0.00 1.72 0.00 0.00 39.33 40.95 1n8v h ASP 49 CO -0.05 0.31 -0.06 0.00 -2.88 0.00 0.00 179.24 176.56 1n8v h ALA 50 N 1.30 1.43 -0.51 -0.78 0.00 -0.84 -2.08 119.26 117.79 1n8v h ALA 50 Ca 0.25 -0.20 -0.13 0.00 0.00 0.00 0.00 54.91 54.83 1n8v h ALA 50 Cb 0.14 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 1n8v h ALA 50 CO -0.16 0.40 -0.18 0.82 0.00 0.00 0.00 179.25 180.13 1n8v h ILE 51 N 0.38 1.27 0.00 0.00 1.08 -0.65 -1.08 117.51 118.50 1n8v h ILE 51 Ca 0.08 -1.34 -0.03 0.00 -0.39 0.00 0.00 64.86 63.18 1n8v h ILE 51 Cb 0.35 1.06 -0.00 0.00 -3.07 0.00 0.00 36.82 35.16 1n8v h ILE 51 CO 0.02 0.47 -0.14 -0.33 -0.69 0.00 0.00 178.15 177.47 1n8v h GLU 52 N 0.88 0.00 0.00 2.37 4.39 -0.62 -3.31 114.58 118.29 1n8v h GLU 52 Ca 0.12 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.82 1n8v h GLU 52 Cb 0.75 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.40 1n8v h GLU 52 CO 0.06 0.14 -0.13 0.27 -1.16 0.00 0.00 179.01 178.19 1n8v n ASN 53 N -3.28 1.50 -3.71 1.42 0.23 -0.93 -5.03 115.26 105.47 1n8v n ASN 53 Ca 0.00 -2.46 -0.25 0.00 -0.53 0.00 0.00 54.58 51.35 1n8v n ASN 53 Cb 0.39 -0.26 0.05 0.00 -2.08 0.00 0.00 39.78 37.88 1n8v n ASN 53 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1n8v n GLY 54 N -0.80 -0.47 2.32 4.83 0.00 -0.50 -2.52 105.19 108.05 1n8v n GLY 54 Ca 0.08 0.19 -0.16 0.00 0.00 0.00 0.00 46.02 46.14 1n8v n GLY 54 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1n8v h LYS 56 N 0.00 0.00 -0.27 0.00 3.64 -1.78 -1.71 116.57 116.46 1n8v h LYS 56 Ca -0.37 -0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.01 1n8v h LYS 56 Cb 1.25 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.07 1n8v h LYS 56 CO 0.45 0.00 0.00 1.63 -2.27 0.00 0.00 179.45 179.26 1n8v n LYS 57 N -4.43 2.17 -2.57 1.90 5.02 -1.26 -4.99 118.16 114.00 1n8v n LYS 57 Ca 0.06 -2.01 -0.36 0.00 -2.02 0.00 0.00 58.31 53.98 1n8v n LYS 57 Cb 0.46 -1.42 -0.04 0.00 -0.02 0.00 0.00 35.03 34.01 1n8v n LYS 57 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1n8v s THR 59 N -1.68 2.93 0.23 0.00 -4.23 -1.26 -4.86 115.64 106.77 1n8v s THR 59 Ca 0.57 0.30 -0.08 0.00 -1.18 0.00 0.00 61.69 61.31 1n8v s THR 59 Cb -0.21 -3.02 0.21 0.00 1.34 0.00 0.00 72.50 70.81 1n8v s THR 59 CO 0.27 -0.40 1.89 -0.33 -0.54 0.00 0.00 174.62 175.51 1n8v h GLU 60 N -1.17 1.18 -0.72 3.99 5.08 -1.98 -1.65 114.58 119.30 1n8v h GLU 60 Ca -0.48 -0.09 -0.02 0.00 -1.00 0.00 0.00 59.36 57.77 1n8v h GLU 60 Cb 1.28 -0.26 -0.03 0.00 0.50 0.00 0.00 28.75 30.23 1n8v h GLU 60 CO 0.59 0.81 0.35 -0.91 -1.00 0.00 0.00 179.01 178.85 1n8v h ASN 61 N 1.21 0.92 -0.61 1.42 2.35 -1.96 -1.58 115.58 117.33 1n8v h ASN 61 Ca 0.32 -0.10 -0.10 0.00 -0.55 0.00 0.00 56.30 55.87 1n8v h ASN 61 Cb -0.09 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 38.02 1n8v h ASN 61 CO -0.06 0.78 -0.00 1.56 -1.65 0.00 0.00 177.43 178.05 1n8v h GLN 62 N 1.02 1.08 -0.21 0.81 4.20 -1.78 0.76 115.11 120.99 1n8v h GLN 62 Ca 0.25 -0.35 -0.01 0.00 0.06 0.00 0.00 58.65 58.61 1n8v h GLN 62 Cb 0.10 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 27.77 1n8v h GLN 62 CO -0.03 1.05 0.09 0.93 -0.67 0.00 0.00 178.83 180.20 1n8v h GLU 63 N 0.99 0.30 -0.48 1.46 5.08 -0.88 0.15 114.58 121.20 1n8v h GLU 63 Ca 0.17 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.47 1n8v h GLU 63 Cb 0.57 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.74 1n8v h GLU 63 CO 0.03 0.33 0.23 -0.22 -1.00 0.00 0.00 179.01 178.39 1n8v h LYS 64 N 0.20 0.68 -0.47 2.33 3.64 -1.21 -2.45 116.57 119.29 1n8v h LYS 64 Ca 0.07 -0.10 -0.08 0.00 -1.27 0.00 0.00 60.65 59.27 1n8v h LYS 64 Cb 0.14 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 31.81 1n8v h LYS 64 CO -0.01 0.57 -0.04 0.78 -2.27 0.00 0.00 179.45 178.48 1n8v h GLY 65 N 0.63 0.87 0.97 5.01 0.00 -0.67 -1.85 103.07 108.03 1n8v h GLY 65 Ca 0.16 -0.62 -0.01 0.00 0.00 0.00 0.00 47.33 46.86 1n8v h GLY 65 CO -0.02 0.57 0.22 0.00 0.00 0.00 0.00 176.54 177.31 1n8v h ALA 66 N 1.20 0.57 -0.64 3.60 0.00 -0.47 -1.14 119.26 122.37 1n8v h ALA 66 Ca 0.14 -0.10 -0.09 0.00 0.00 0.00 0.00 54.91 54.86 1n8v h ALA 66 Cb 0.51 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 1n8v h ALA 66 CO 0.03 0.12 0.06 -0.92 0.00 0.00 0.00 179.25 178.53 1n8v h TYR 67 N 0.57 1.18 -0.33 0.00 3.20 -1.24 0.46 116.97 120.81 1n8v h TYR 67 Ca 0.15 -0.18 0.03 0.00 3.14 0.00 0.00 58.73 61.87 1n8v h TYR 67 Cb 0.10 -0.32 -0.03 0.00 1.54 0.00 0.00 36.73 38.02 1n8v h TYR 67 CO -0.01 1.01 0.14 -0.09 -1.64 0.00 0.00 178.16 177.56 1n8v h ARG 68 N 1.01 0.29 -0.26 1.82 9.65 -1.03 -0.66 114.38 125.20 1n8v h ARG 68 Ca 0.19 -0.02 -0.04 0.00 -1.10 0.00 0.00 59.98 59.01 1n8v h ARG 68 Cb 0.50 -0.06 -0.01 0.00 -1.39 0.00 0.00 29.97 29.00 1n8v h ARG 68 CO 0.02 0.19 0.01 0.28 2.80 0.00 0.00 179.97 183.27 1n8v h VAL 69 N 0.29 1.25 -0.51 0.20 2.07 -0.97 -2.37 116.25 116.22 1n8v h VAL 69 Ca 0.14 -0.88 -0.03 0.00 0.82 0.00 0.00 66.70 66.75 1n8v h VAL 69 Cb 0.08 1.33 -0.02 0.00 -1.52 0.00 0.00 31.29 31.16 1n8v h VAL 69 CO -0.12 0.28 0.20 0.40 0.02 0.00 0.00 177.57 178.35 1n8v h ILE 70 N 0.23 1.22 -0.64 4.57 2.04 -0.79 -1.10 117.51 123.03 1n8v h ILE 70 Ca 0.07 -0.67 -0.02 0.00 1.00 0.00 0.00 64.86 65.24 1n8v h ILE 70 Cb 0.40 0.70 -0.03 0.00 -0.74 0.00 0.00 36.82 37.15 1n8v h ILE 70 CO 0.01 0.25 0.34 -0.08 0.00 0.00 0.00 178.15 178.68 1n8v h GLU 71 N 0.69 0.91 -0.49 2.37 4.81 -1.10 -0.74 114.58 121.02 1n8v h GLU 71 Ca 0.17 -0.12 0.01 0.00 -0.13 0.00 0.00 59.36 59.29 1n8v h GLU 71 Cb 0.20 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 29.38 1n8v h GLU 71 CO -0.01 0.70 0.32 1.25 -0.73 0.00 0.00 179.01 180.54 1n8v h HIS 72 N 0.88 0.61 -0.33 0.92 2.76 -1.03 -1.70 115.15 117.27 1n8v h HIS 72 Ca 0.23 0.01 -0.03 0.00 -2.20 0.00 0.00 60.37 58.38 1n8v h HIS 72 Cb 0.07 -0.20 -0.01 0.00 1.55 0.00 0.00 27.41 28.81 1n8v h HIS 72 CO -0.00 0.38 0.07 -0.07 -1.30 0.00 0.00 177.93 177.01 1n8v h LEU 73 N 0.65 0.50 -1.15 0.26 3.38 -0.81 0.10 115.31 118.25 1n8v h LEU 73 Ca 0.18 -0.24 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 1n8v h LEU 73 Cb -0.07 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 40.51 1n8v h LEU 73 CO -0.04 0.61 0.50 0.40 0.09 0.00 0.00 178.44 180.00 1n8v h ILE 74 N 0.37 1.22 0.18 1.22 2.04 -1.02 0.39 117.51 121.92 1n8v h ILE 74 Ca 0.10 -0.45 -0.27 0.00 1.00 0.00 0.00 64.86 65.24 1n8v h ILE 74 Cb 0.31 0.06 0.02 0.00 -0.74 0.00 0.00 36.82 36.47 1n8v h ILE 74 CO 0.00 0.22 -1.26 0.11 0.00 0.00 0.00 178.15 177.23 1n8v h LYS 75 N 1.10 0.38 0.00 2.37 1.57 -1.19 -3.42 116.57 117.39 1n8v h LYS 75 Ca 0.29 -0.65 0.00 0.00 -1.87 0.00 0.00 60.65 58.42 1n8v h LYS 75 Cb -0.08 0.24 0.00 0.00 0.08 0.00 0.00 32.23 32.48 1n8v h LYS 75 CO -0.06 1.31 -0.50 0.09 -0.57 0.00 0.00 179.45 179.72 1n8v n ASN 76 N -3.89 1.06 -3.17 0.86 3.02 0.35 -4.77 115.26 108.71 1n8v n ASN 76 Ca -0.18 -0.49 -0.19 0.00 -0.03 0.00 0.00 54.58 53.70 1n8v n ASN 76 Cb 0.96 1.06 -0.03 0.00 -0.61 0.00 0.00 39.78 41.16 1n8v n ASN 76 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1n8v n GLU 77 N -1.27 0.93 -0.28 3.52 -0.58 0.11 -4.99 120.64 118.09 1n8v n GLU 77 Ca 0.01 -3.30 0.03 0.00 -0.42 0.00 0.00 57.16 53.48 1n8v n GLU 77 Cb 0.10 -1.61 0.17 0.00 -0.57 0.00 0.00 31.44 29.53 1n8v n GLU 77 CO 0.00 0.00 0.00 0.82 -0.48 0.00 0.00 177.13 177.47 1n8v h ILE 78 N 1.23 0.84 -0.84 -3.67 2.04 -1.75 -1.17 117.51 114.19 1n8v h ILE 78 Ca 0.09 -0.23 -0.02 0.00 1.00 0.00 0.00 64.86 65.69 1n8v h ILE 78 Cb 0.96 0.10 -0.04 0.00 -0.74 0.00 0.00 36.82 37.10 1n8v h ILE 78 CO 0.48 0.12 0.43 -0.33 0.00 0.00 0.00 178.15 178.86 1n8v h GLU 79 N 0.68 1.19 -0.14 2.37 3.07 -1.94 -0.10 114.58 119.71 1n8v h GLU 79 Ca 0.40 -0.16 -0.03 0.00 -0.50 0.00 0.00 59.36 59.07 1n8v h GLU 79 Cb 0.44 -0.23 -0.00 0.00 -0.84 0.00 0.00 28.75 28.12 1n8v h GLU 79 CO -0.28 0.89 -0.02 0.82 -1.40 0.00 0.00 179.01 179.02 1n8v h ILE 80 N 1.19 1.28 -0.43 3.13 2.04 -1.62 -2.25 117.51 120.84 1n8v h ILE 80 Ca 0.29 -0.94 0.08 0.00 1.00 0.00 0.00 64.86 65.29 1n8v h ILE 80 Cb 0.07 1.61 -0.06 0.00 -0.74 0.00 0.00 36.82 37.70 1n8v h ILE 80 CO -0.04 0.27 0.05 -0.25 0.00 0.00 0.00 178.15 178.18 1n8v h TRP 81 N -0.02 0.06 -0.85 1.37 2.91 -0.98 -1.54 115.95 116.90 1n8v h TRP 81 Ca 0.04 0.03 -0.03 0.00 1.13 0.00 0.00 58.89 60.06 1n8v h TRP 81 Cb 0.43 0.04 -0.04 0.00 -0.51 0.00 0.00 29.16 29.08 1n8v h TRP 81 CO 0.05 -0.04 0.43 0.00 -1.03 0.00 0.00 178.44 177.84 1n8v h ARG 82 N 0.17 1.21 -0.12 2.65 3.08 -0.92 -0.77 114.38 119.68 1n8v h ARG 82 Ca 0.21 -0.17 -0.15 0.00 0.07 0.00 0.00 59.98 59.94 1n8v h ARG 82 Cb 0.29 -0.22 -0.01 0.00 0.08 0.00 0.00 29.97 30.11 1n8v h ARG 82 CO -0.32 0.92 -0.57 1.05 -1.07 0.00 0.00 179.97 179.98 1n8v h GLU 83 N 1.20 0.39 -0.07 0.04 4.11 -1.08 -1.83 114.58 117.35 1n8v h GLU 83 Ca 0.29 -0.25 -0.03 0.00 0.07 0.00 0.00 59.36 59.44 1n8v h GLU 83 Cb 0.09 0.03 -0.00 0.00 0.50 0.00 0.00 28.75 29.37 1n8v h GLU 83 CO -0.04 0.86 -0.08 -0.07 0.07 0.00 0.00 179.01 179.75 1n8v h LEU 84 N 0.30 0.19 -0.99 3.06 3.38 -0.90 -1.92 115.31 118.42 1n8v h LEU 84 Ca 0.00 -0.50 -0.07 0.00 0.09 0.00 0.00 57.88 57.40 1n8v h LEU 84 Cb 1.09 -0.05 -0.02 0.00 0.09 0.00 0.00 40.66 41.77 1n8v h LEU 84 CO 0.10 0.65 -0.06 0.00 0.09 0.00 0.00 178.44 179.22 1n8v h THR 85 N -0.27 1.24 -0.66 0.22 1.03 -1.19 -1.12 112.91 112.16 1n8v h THR 85 Ca 0.01 -1.01 -0.07 0.00 -0.01 0.00 0.00 66.41 65.33 1n8v h THR 85 Cb 0.60 1.00 -0.03 0.00 -1.07 0.00 0.00 68.15 68.65 1n8v h THR 85 CO 0.02 0.34 0.13 0.00 -0.01 0.00 0.00 175.52 176.01 1n8v h ALA 86 N 1.32 0.99 -0.00 0.00 0.00 -1.31 0.10 119.26 120.37 1n8v h ALA 86 Ca 0.12 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 1n8v h ALA 86 Cb 0.47 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1n8v h ALA 86 CO 0.02 0.65 -0.02 -0.22 0.00 0.00 0.00 179.25 179.69 1n8v h LYS 87 N 1.00 0.01 0.00 0.00 3.64 -1.09 -3.28 116.57 116.85 1n8v h LYS 87 Ca 0.21 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.57 1n8v h LYS 87 Cb 0.39 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.22 1n8v h LYS 87 CO 0.01 0.77 -0.99 0.66 -2.27 0.00 0.00 179.45 177.63 1n8v n TYR 88 N -4.71 0.90 -3.11 1.91 4.01 -0.44 -4.44 117.16 111.27 1n8v n TYR 88 Ca -0.09 0.26 -0.21 0.00 -0.16 0.00 0.00 57.90 57.70 1n8v n TYR 88 Cb 0.38 -0.91 -0.03 0.00 -0.31 0.00 0.00 39.34 38.47 1n8v n TYR 88 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 1n8v n ASP 89 N -2.60 1.98 0.29 7.72 2.03 0.35 -4.92 116.55 121.41 1n8v n ASP 89 Ca 0.00 -3.22 0.16 0.00 0.52 0.00 0.00 54.79 52.25 1n8v n ASP 89 Cb 0.54 -0.60 0.88 0.00 -0.72 0.00 0.00 41.12 41.21 1n8v n ASP 89 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1n8v h PRO 90 N 2.99 0.00 -0.05 -0.67 0.13 -1.62 0.12 132.00 132.90 1n8v h PRO 90 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 1n8v h PRO 90 Cb 0.82 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.95 1n8v h PRO 90 CO 0.60 0.05 0.00 0.25 -0.23 0.00 0.00 178.00 178.67 1n8v n THR 91 N -3.58 0.05 -3.18 1.56 -2.24 -1.26 -4.98 114.28 100.65 1n8v n THR 91 Ca -0.02 -0.34 -0.15 0.00 -2.27 0.00 0.00 64.05 61.26 1n8v n THR 91 Cb 0.16 0.75 0.05 0.00 -2.10 0.00 0.00 70.33 69.20 1n8v n THR 91 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1n8v n GLY 92 N 1.23 -0.06 0.29 3.38 0.00 0.03 -4.94 105.19 105.13 1n8v n GLY 92 Ca 0.17 -0.06 -0.02 0.00 0.00 0.00 0.00 46.02 46.12 1n8v n GLY 92 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1n8v h ASN 93 N -1.70 0.76 -0.00 1.61 2.35 -1.94 -3.33 115.58 113.33 1n8v h ASN 93 Ca -0.38 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.38 1n8v h ASN 93 Cb 1.24 -0.15 0.00 0.00 0.05 0.00 0.00 38.32 39.46 1n8v h ASN 93 CO 0.37 0.51 -0.10 0.79 -1.65 0.00 0.00 177.43 177.34 1n8v n TRP 94 N -4.65 0.00 0.13 1.19 7.02 -1.26 -4.79 117.44 115.08 1n8v n TRP 94 Ca 0.09 0.00 -0.13 0.00 -1.02 0.00 0.00 57.50 56.44 1n8v n TRP 94 Cb 0.12 0.00 -0.06 0.00 -2.42 0.00 0.00 31.31 28.95 1n8v n TRP 94 CO 0.00 0.00 0.00 -0.09 -2.02 0.00 0.00 177.69 175.58 1n8v h ARG 95 N 0.18 -0.41 -0.39 -0.99 2.43 -1.93 -1.42 114.38 111.85 1n8v h ARG 95 Ca 0.00 0.03 -0.10 0.00 -0.81 0.00 0.00 59.98 59.10 1n8v h ARG 95 Cb 0.09 0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.72 1n8v h ARG 95 CO 0.00 -0.27 -0.16 -0.22 -1.51 0.00 0.00 179.97 177.80 1n8v h LYS 96 N -0.43 0.73 -0.47 0.20 3.64 -1.88 -1.35 116.57 117.01 1n8v h LYS 96 Ca 0.01 -0.26 0.00 0.00 -1.27 0.00 0.00 60.65 59.13 1n8v h LYS 96 Cb 0.42 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.16 1n8v h LYS 96 CO -0.07 0.85 0.30 0.87 -2.27 0.00 0.00 179.45 179.13 1n8v h LYS 97 N 0.65 0.63 -0.20 1.90 1.57 -1.80 -0.02 116.57 119.30 1n8v h LYS 97 Ca 0.10 -0.05 -0.20 0.00 -1.87 0.00 0.00 60.65 58.64 1n8v h LYS 97 Cb 0.64 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 32.81 1n8v h LYS 97 CO 0.04 0.44 -0.66 1.88 -0.57 0.00 0.00 179.45 180.58 1n8v h TYR 98 N 0.64 0.96 -0.55 -1.35 0.05 -1.10 -2.71 116.97 112.90 1n8v h TYR 98 Ca 0.17 -0.38 -0.06 0.00 0.05 0.00 0.00 58.73 58.51 1n8v h TYR 98 Cb -0.05 -0.16 -0.02 0.00 1.01 0.00 0.00 36.73 37.50 1n8v h TYR 98 CO -0.04 1.19 0.11 0.93 -1.05 0.00 0.00 178.16 179.30 1n8v h GLU 99 N 0.53 0.87 -0.59 4.88 5.08 -1.02 -0.89 114.58 123.44 1n8v h GLU 99 Ca -0.02 -0.19 -0.09 0.00 -1.00 0.00 0.00 59.36 58.06 1n8v h GLU 99 Cb 1.26 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 30.37 1n8v h GLU 99 CO 0.13 0.79 0.01 -0.44 -1.00 0.00 0.00 179.01 178.51 1n8v h ASP 100 N 0.83 0.99 -0.37 1.42 3.32 -0.95 -1.68 116.42 119.98 1n8v h ASP 100 Ca 0.18 -0.27 -0.04 0.00 0.02 0.00 0.00 57.03 56.92 1n8v h ASP 100 Cb 0.34 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.61 1n8v h ASP 100 CO 0.00 1.04 0.08 0.03 -1.72 0.00 0.00 179.24 178.67 1n8v h ARG 101 N 0.93 0.61 -0.95 3.56 -0.00 -1.13 -3.00 114.38 114.40 1n8v h ARG 101 Ca 0.17 -0.15 0.00 0.00 -0.50 0.00 0.00 59.98 59.50 1n8v h ARG 101 Cb 0.53 -0.08 -0.05 0.00 0.00 0.00 0.00 29.97 30.38 1n8v h ARG 101 CO 0.03 0.65 0.61 0.00 0.00 0.00 0.00 179.97 181.26 1n8v h ALA 102 N 0.93 1.21 0.00 0.04 0.00 -0.94 -3.52 119.26 116.98 1n8v h ALA 102 Ca 0.12 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1n8v h ALA 102 Cb 0.33 -0.39 0.00 0.00 0.00 0.00 0.00 17.79 17.73 1n8v h ALA 102 CO 0.00 0.63 0.00 0.36 0.00 0.00 0.00 179.25 180.24