#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1d8b h LEU 12 N 0.00 0.88 -3.62 -4.62 3.38 -2.05 -3.01 115.31 106.27 1d8b h LEU 12 Ca 0.00 -0.38 -0.45 0.00 0.09 0.00 0.00 57.88 57.15 1d8b h LEU 12 Cb 0.00 -0.24 -0.22 0.00 0.09 0.00 0.00 40.66 40.29 1d8b h LEU 12 CO 0.00 1.05 0.57 0.59 0.09 0.00 0.00 178.44 180.74 1d8b n ASN 13 N -4.25 5.33 -0.07 -0.43 3.02 -1.26 -4.52 115.26 113.08 1d8b n ASN 13 Ca -0.01 -3.32 -0.12 0.00 -0.03 0.00 0.00 54.58 51.10 1d8b n ASN 13 Cb 0.40 -0.89 -0.06 0.00 -0.61 0.00 0.00 39.78 38.63 1d8b n ASN 13 CO 0.00 0.00 0.00 -1.13 -2.62 0.00 0.00 177.26 173.51 1d8b h ASN 14 N 1.24 0.42 0.17 6.41 -0.73 -1.96 -1.06 115.58 120.08 1d8b h ASN 14 Ca 0.47 -0.40 -0.12 0.00 1.87 0.00 0.00 56.30 58.12 1d8b h ASN 14 Cb 1.63 -0.12 -0.01 0.00 0.27 0.00 0.00 38.32 40.09 1d8b h ASN 14 CO 1.01 0.73 -0.43 0.25 -0.37 0.00 0.00 177.43 178.62 1d8b h LEU 15 N 0.11 0.34 -0.89 0.34 6.46 -1.86 -1.48 115.31 118.34 1d8b h LEU 15 Ca 0.05 -0.15 -0.10 0.00 -0.12 0.00 0.00 57.88 57.56 1d8b h LEU 15 Cb 0.56 -0.10 -0.01 0.00 -0.73 0.00 0.00 40.66 40.38 1d8b h LEU 15 CO 0.03 0.73 -0.23 -0.09 -0.62 0.00 0.00 178.44 178.26 1d8b h ARG 16 N 0.27 0.55 -0.48 1.25 9.65 -1.86 -0.51 114.38 123.26 1d8b h ARG 16 Ca 0.02 -0.21 -0.05 0.00 -1.10 0.00 0.00 59.98 58.65 1d8b h ARG 16 Cb 0.86 -0.03 -0.02 0.00 -1.39 0.00 0.00 29.97 29.39 1d8b h ARG 16 CO 0.07 0.74 0.11 1.98 2.80 0.00 0.00 179.97 185.67 1d8b h MET 17 N 0.49 0.78 -0.56 0.20 4.05 -0.75 0.66 114.93 119.80 1d8b h MET 17 Ca 0.07 -0.19 0.00 0.00 -0.28 0.00 0.00 59.70 59.30 1d8b h MET 17 Cb 0.66 -0.10 -0.03 0.00 -0.80 0.00 0.00 31.60 31.34 1d8b h MET 17 CO 0.05 0.76 0.36 1.15 0.23 0.00 0.00 176.91 179.46 1d8b h THR 18 N 0.66 1.15 -0.38 -0.77 2.02 -0.82 0.23 112.91 115.00 1d8b h THR 18 Ca 0.15 -0.30 -0.04 0.00 0.77 0.00 0.00 66.41 66.99 1d8b h THR 18 Cb 0.34 0.35 -0.02 0.00 -1.74 0.00 0.00 68.15 67.09 1d8b h THR 18 CO 0.00 0.15 0.07 0.22 0.37 0.00 0.00 175.52 176.33 1d8b h TYR 19 N 0.76 0.66 -0.30 3.16 3.20 -0.80 -2.33 116.97 121.32 1d8b h TYR 19 Ca 0.20 -0.09 -0.11 0.00 3.14 0.00 0.00 58.73 61.87 1d8b h TYR 19 Cb -0.06 -0.18 -0.01 0.00 1.54 0.00 0.00 36.73 38.01 1d8b h TYR 19 CO -0.03 0.66 -0.28 1.49 -1.64 0.00 0.00 178.16 178.37 1d8b h GLU 20 N 0.47 0.61 -0.21 1.82 4.81 -0.56 -1.48 114.58 120.04 1d8b h GLU 20 Ca 0.12 -0.25 -0.04 0.00 -0.13 0.00 0.00 59.36 59.05 1d8b h GLU 20 Cb 0.35 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.69 1d8b h GLU 20 CO 0.01 0.82 -0.06 -0.09 -0.73 0.00 0.00 179.01 178.96 1d8b h ARG 21 N 0.53 0.32 -0.01 1.92 1.12 -0.39 0.19 114.38 118.06 1d8b h ARG 21 Ca 0.07 -0.07 -0.18 0.00 -1.11 0.00 0.00 59.98 58.69 1d8b h ARG 21 Cb 0.75 -0.05 -0.01 0.00 -0.01 0.00 0.00 29.97 30.64 1d8b h ARG 21 CO 0.06 0.40 -0.81 -0.07 -3.11 0.00 0.00 179.97 176.44 1d8b h LEU 22 N 0.31 0.22 -0.32 3.80 3.38 -1.04 -1.87 115.31 119.79 1d8b h LEU 22 Ca 0.07 -0.17 -0.16 0.00 0.09 0.00 0.00 57.88 57.71 1d8b h LEU 22 Cb 0.31 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 40.99 1d8b h LEU 22 CO 0.01 0.94 -0.40 -0.09 0.09 0.00 0.00 178.44 178.99 1d8b h ARG 23 N 0.11 0.84 -0.33 1.13 2.43 -0.19 0.19 114.38 118.56 1d8b h ARG 23 Ca -0.03 -0.48 -0.11 0.00 -0.81 0.00 0.00 59.98 58.55 1d8b h ARG 23 Cb 1.42 0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.98 1d8b h ARG 23 CO 0.12 1.11 -0.25 1.49 -1.51 0.00 0.00 179.97 180.94 1d8b h GLU 24 N 0.63 0.66 -0.03 0.20 4.57 -0.65 -2.35 114.58 117.61 1d8b h GLU 24 Ca 0.04 -0.26 -0.19 0.00 -1.18 0.00 0.00 59.36 57.77 1d8b h GLU 24 Cb 1.00 -0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 29.55 1d8b h GLU 24 CO 0.10 0.84 -0.79 1.25 -1.18 0.00 0.00 179.01 179.23 1d8b h LEU 25 N 0.57 0.34 -1.05 1.64 6.46 -1.23 -2.37 115.31 119.67 1d8b h LEU 25 Ca 0.08 -0.25 -0.05 0.00 -0.12 0.00 0.00 57.88 57.55 1d8b h LEU 25 Cb 0.73 -0.10 -0.03 0.00 -0.73 0.00 0.00 40.66 40.53 1d8b h LEU 25 CO 0.06 1.00 0.16 0.28 -0.62 0.00 0.00 178.44 179.32 1d8b h SER 26 N 0.17 0.78 0.67 1.25 0.02 -0.32 0.18 113.55 116.30 1d8b h SER 26 Ca -0.04 -0.13 -0.21 0.00 -0.84 0.00 0.00 61.79 60.58 1d8b h SER 26 Cb 1.38 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 63.71 1d8b h SER 26 CO 0.13 0.75 -0.93 -0.07 -1.14 0.00 0.00 176.83 175.56 1d8b h LEU 27 N 0.82 0.21 0.42 5.07 4.07 -1.39 -1.21 115.31 123.30 1d8b h LEU 27 Ca 0.18 -0.19 -0.02 0.00 0.08 0.00 0.00 57.88 57.93 1d8b h LEU 27 Cb 0.26 -0.07 0.00 0.00 1.08 0.00 0.00 40.66 41.94 1d8b h LEU 27 CO -0.01 1.03 -0.20 -1.13 -1.08 0.00 0.00 178.44 177.05 1d8b h ASN 28 N 0.08 -0.48 0.17 -0.43 -0.73 -0.86 -2.58 115.58 110.75 1d8b h ASN 28 Ca -0.05 -0.11 -0.10 0.00 1.87 0.00 0.00 56.30 57.92 1d8b h ASN 28 Cb 1.59 0.12 -0.01 0.00 0.27 0.00 0.00 38.32 40.30 1d8b h ASN 28 CO 0.14 -0.08 -0.35 -0.07 -0.37 0.00 0.00 177.43 176.70 1d8b h LEU 29 N -0.96 0.27 -1.28 0.34 3.38 -0.78 -1.99 115.31 114.29 1d8b h LEU 29 Ca -0.06 -0.10 -0.01 0.00 0.09 0.00 0.00 57.88 57.80 1d8b h LEU 29 Cb 0.56 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.21 1d8b h LEU 29 CO 0.10 0.61 0.32 1.23 0.09 0.00 0.00 178.44 180.78 1d8b h GLY 30 N 1.12 0.87 1.21 0.83 0.00 -1.24 -0.80 103.07 105.06 1d8b h GLY 30 Ca 0.03 -0.38 0.00 0.00 0.00 0.00 0.00 47.33 46.98 1d8b h GLY 30 CO 0.06 0.36 -0.60 3.45 0.00 0.00 0.00 176.54 179.81 1d8b h ASN 31 N 0.82 0.00 0.09 0.19 -1.07 -1.22 0.36 115.58 114.76 1d8b h ASN 31 Ca 0.21 -0.19 0.00 0.00 0.07 0.00 0.00 56.30 56.39 1d8b h ASN 31 Cb 0.02 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.27 1d8b h ASN 31 CO -0.03 0.09 -0.19 -1.14 0.07 0.00 0.00 177.43 176.23 1d8b n ARG 32 N -2.16 1.30 -3.63 4.14 0.63 -0.74 -4.80 116.66 111.40 1d8b n ARG 32 Ca 0.03 -0.86 -0.29 0.00 -0.92 0.00 0.00 57.85 55.81 1d8b n ARG 32 Cb 0.44 -1.48 -0.04 0.00 0.45 0.00 0.00 32.46 31.84 1d8b n ARG 32 CO 0.00 0.00 0.00 -1.64 -2.51 0.00 0.00 177.63 173.48 1d8b s MET 33 N -2.29 3.57 -0.22 -0.14 -1.94 -0.38 -5.04 119.30 112.86 1d8b s MET 33 Ca 0.28 -0.19 0.02 0.00 -1.71 0.00 0.00 55.69 54.08 1d8b s MET 33 Cb 0.20 -2.81 0.04 0.00 2.01 0.00 0.00 34.83 34.27 1d8b s MET 33 CO 0.45 0.39 -0.14 0.08 -0.01 0.00 0.00 175.02 175.79 1d8b s VAL 34 N -1.83 2.03 0.57 -6.03 1.01 -1.26 -1.94 120.40 112.95 1d8b s VAL 34 Ca 0.40 -1.25 -0.07 0.00 0.00 0.00 0.00 61.98 61.07 1d8b s VAL 34 Cb -0.11 -2.01 -0.01 0.00 0.00 0.00 0.00 36.38 34.24 1d8b s VAL 34 CO 0.28 0.23 0.90 -2.16 0.00 0.00 0.00 175.10 174.35 1d8b s PRO 35 N 1.23 3.22 -0.19 2.72 0.04 -1.26 -5.06 135.00 135.69 1d8b s PRO 35 Ca -0.02 0.22 -0.38 0.00 0.04 0.00 0.00 61.00 60.86 1d8b s PRO 35 Cb -0.17 -2.25 -0.14 0.00 0.04 0.00 0.00 34.50 31.98 1d8b s PRO 35 CO -0.09 -0.55 1.77 -2.30 0.04 0.00 0.00 177.00 175.87 1d8b n PRO 36 N -2.54 1.50 0.06 0.56 -0.02 -0.82 -4.87 135.00 128.87 1d8b n PRO 36 Ca 0.04 0.55 -0.16 0.00 -2.02 0.00 0.00 63.50 61.91 1d8b n PRO 36 Cb 0.56 -2.29 -0.07 0.00 -0.02 0.00 0.00 33.50 31.69 1d8b n PRO 36 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1d8b h VAL 37 N 5.19 1.36 0.00 -1.45 2.07 -1.16 -3.48 116.25 118.78 1d8b h VAL 37 Ca -0.47 -2.39 0.00 0.00 0.82 0.00 0.00 66.70 64.66 1d8b h VAL 37 Cb 1.30 2.42 0.00 0.00 -1.52 0.00 0.00 31.29 33.49 1d8b h VAL 37 CO 0.95 0.72 0.00 0.61 0.02 0.00 0.00 177.57 179.87 1d8b n GLY 38 N 1.00 1.99 3.01 2.17 0.00 -1.25 -4.48 105.19 107.64 1d8b n GLY 38 Ca -0.08 0.03 -0.43 0.00 0.00 0.00 0.00 46.02 45.53 1d8b n GLY 38 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1d8b n ASN 39 N 3.83 5.79 0.00 1.61 5.15 -1.26 -4.62 115.26 125.76 1d8b n ASN 39 Ca 0.00 -3.24 0.00 0.00 -0.60 0.00 0.00 54.58 50.74 1d8b n ASN 39 Cb 0.00 -1.38 0.00 0.00 -0.53 0.00 0.00 39.78 37.87 1d8b n ASN 39 CO 0.00 0.00 0.00 0.33 1.40 0.00 0.00 177.26 178.99 1d8b n PHE 40 N 2.64 0.00 -4.05 1.20 7.35 -1.26 -4.48 117.46 118.86 1d8b n PHE 40 Ca 0.32 0.00 -0.35 0.00 -0.76 0.00 0.00 57.45 56.66 1d8b n PHE 40 Cb 0.35 -0.13 -0.12 0.00 0.35 0.00 0.00 39.48 39.93 1d8b n PHE 40 CO 0.00 0.00 0.00 1.41 -0.76 0.00 0.00 176.76 177.41 1d8b s MET 41 N -1.53 3.67 0.48 -4.13 1.75 -1.26 -5.08 119.30 113.20 1d8b s MET 41 Ca 0.00 -0.50 -0.22 0.00 -1.25 0.00 0.00 55.69 53.72 1d8b s MET 41 Cb 0.00 -3.11 -0.09 0.00 2.84 0.00 0.00 34.83 34.47 1d8b s MET 41 CO 0.00 0.03 0.95 -2.30 -0.65 0.00 0.00 175.02 173.05 1d8b n PRO 42 N 4.20 1.15 -0.25 4.11 -0.02 -1.26 -4.68 135.00 138.24 1d8b n PRO 42 Ca -0.17 0.42 0.03 0.00 -2.02 0.00 0.00 63.50 61.76 1d8b n PRO 42 Cb 0.52 -2.04 0.16 0.00 -0.02 0.00 0.00 33.50 32.12 1d8b n PRO 42 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 1d8b h ASP 43 N 1.13 0.33 -0.86 2.55 3.58 -1.98 0.17 116.42 121.34 1d8b h ASP 43 Ca -0.46 0.09 -0.02 0.00 0.42 0.00 0.00 57.03 57.06 1d8b h ASP 43 Cb 1.35 0.05 -0.04 0.00 1.72 0.00 0.00 39.33 42.41 1d8b h ASP 43 CO 0.54 0.16 0.47 0.28 -2.88 0.00 0.00 179.24 177.81 1d8b h SER 44 N 0.49 1.09 -0.05 2.28 0.02 -2.00 -1.98 113.55 113.40 1d8b h SER 44 Ca 0.38 -0.10 -0.17 0.00 -0.84 0.00 0.00 61.79 61.06 1d8b h SER 44 Cb 0.51 -0.28 -0.00 0.00 0.14 0.00 0.00 62.40 62.77 1d8b h SER 44 CO -0.35 0.88 -0.56 0.40 -1.14 0.00 0.00 176.83 176.07 1d8b h ILE 45 N 1.21 1.31 -0.60 3.27 1.08 -1.51 -2.66 117.51 119.61 1d8b h ILE 45 Ca 0.30 -1.79 -0.02 0.00 -0.39 0.00 0.00 64.86 62.97 1d8b h ILE 45 Cb 0.04 1.74 -0.03 0.00 -3.07 0.00 0.00 36.82 35.50 1d8b h ILE 45 CO -0.05 0.56 0.31 -0.07 -0.69 0.00 0.00 178.15 178.21 1d8b h LEU 46 N 0.49 0.75 0.01 1.44 3.38 -0.36 -0.09 115.31 120.92 1d8b h LEU 46 Ca 0.01 -0.06 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 1d8b h LEU 46 Cb 1.12 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.68 1d8b h LEU 46 CO 0.11 0.62 -0.00 0.11 0.09 0.00 0.00 178.44 179.37 1d8b h LYS 47 N 0.84 -0.01 -0.57 1.13 1.57 -1.23 -0.99 116.57 117.31 1d8b h LYS 47 Ca 0.21 0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 58.89 1d8b h LYS 47 Cb 0.06 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.35 1d8b h LYS 47 CO -0.03 0.47 -0.04 1.57 -0.57 0.00 0.00 179.45 180.85 1d8b h LYS 48 N -0.49 1.02 0.00 3.15 2.10 -1.34 0.05 116.57 121.06 1d8b h LYS 48 Ca -0.00 -0.34 -0.10 0.00 -2.00 0.00 0.00 60.65 58.21 1d8b h LYS 48 Cb 0.48 -0.09 -0.01 0.00 -0.90 0.00 0.00 32.23 31.72 1d8b h LYS 48 CO 0.00 1.02 -0.46 0.00 -2.00 0.00 0.00 179.45 178.02 1d8b h MET 49 N 0.93 0.00 0.04 0.07 -0.00 -1.06 -0.27 114.93 114.63 1d8b h MET 49 Ca 0.16 0.00 -0.23 0.00 -0.00 0.00 0.00 59.70 59.63 1d8b h MET 49 Cb 0.59 0.00 -0.02 0.00 -0.00 0.00 0.00 31.60 32.17 1d8b h MET 49 CO 0.04 0.46 -1.10 0.00 -0.00 0.00 0.00 176.91 176.30 1d8b h ALA 50 N 1.54 0.28 0.18 -3.00 0.00 -0.82 0.16 119.26 117.60 1d8b h ALA 50 Ca -0.00 -0.92 -0.31 0.00 0.00 0.00 0.00 54.91 53.67 1d8b h ALA 50 Cb 0.81 -0.09 0.03 0.00 0.00 0.00 0.00 17.79 18.55 1d8b h ALA 50 CO 0.06 1.17 -1.34 0.00 0.00 0.00 0.00 179.25 179.14 1d8b h ALA 51 N 0.86 -0.08 0.08 0.00 0.00 -0.77 -3.35 119.26 116.00 1d8b h ALA 51 Ca -0.06 -0.81 -0.33 0.00 0.00 0.00 0.00 54.91 53.72 1d8b h ALA 51 Cb 1.84 0.14 -0.03 0.00 0.00 0.00 0.00 17.79 19.75 1d8b h ALA 51 CO 0.15 0.68 -1.79 0.82 0.00 0.00 0.00 179.25 179.11 1d8b h ILE 52 N 0.21 0.82 -5.87 0.00 5.03 -1.16 -3.49 117.51 113.05 1d8b h ILE 52 Ca -0.22 -2.57 -0.18 0.00 -0.12 0.00 0.00 64.86 61.77 1d8b h ILE 52 Cb 2.02 2.54 0.00 0.00 -3.03 0.00 0.00 36.82 38.35 1d8b h ILE 52 CO 0.25 0.74 -0.41 0.18 -0.68 0.00 0.00 178.15 178.24 1d8b n LEU 53 N -3.33 -5.04 -4.59 1.44 4.77 0.55 -4.86 117.00 105.95 1d8b n LEU 53 Ca -0.23 -0.38 -0.42 0.00 -0.03 0.00 0.00 56.01 54.94 1d8b n LEU 53 Cb 1.05 -2.71 -0.02 0.00 -2.33 0.00 0.00 43.42 39.41 1d8b n LEU 53 CO 0.45 -0.60 1.33 -2.84 -1.33 0.00 0.00 177.39 174.41 1d8b s PRO 54 N -3.68 3.41 0.39 3.23 0.02 -1.26 -4.86 135.00 132.25 1d8b s PRO 54 Ca 0.01 0.95 0.21 0.00 0.02 0.00 0.00 61.00 62.19 1d8b s PRO 54 Cb -0.00 -4.11 0.26 0.00 0.02 0.00 0.00 34.50 30.67 1d8b s PRO 54 CO 0.80 -1.77 1.55 0.52 -0.33 0.00 0.00 177.00 177.77 1d8b h MET 55 N 11.55 0.00 -5.62 5.54 2.86 -1.92 -3.46 114.93 123.88 1d8b h MET 55 Ca -0.29 0.00 -0.62 0.00 -2.06 0.00 0.00 59.70 56.73 1d8b h MET 55 Cb 1.12 0.00 -0.11 0.00 0.06 0.00 0.00 31.60 32.67 1d8b h MET 55 CO 1.10 0.14 -0.51 0.54 1.06 0.00 0.00 176.91 179.24 1d8b s ASN 56 N -6.26 4.21 0.13 1.22 2.20 -1.26 -5.03 114.94 110.14 1d8b s ASN 56 Ca 0.06 -1.36 0.26 0.00 -0.94 0.00 0.00 52.86 50.88 1d8b s ASN 56 Cb 0.06 -0.03 0.67 0.00 -2.00 0.00 0.00 41.25 39.94 1d8b s ASN 56 CO 0.69 -0.68 1.60 0.47 -2.94 0.00 0.00 177.10 176.24 1d8b n ASP 57 N -1.24 0.63 -0.04 3.54 9.92 -1.26 -3.80 116.55 124.31 1d8b n ASP 57 Ca -0.08 0.32 -0.14 0.00 -0.53 0.00 0.00 54.79 54.36 1d8b n ASP 57 Cb 0.66 -0.30 -0.09 0.00 -0.64 0.00 0.00 41.12 40.75 1d8b n ASP 57 CO 0.00 0.00 0.00 0.28 0.13 0.00 0.00 177.20 177.61 1d8b h SER 58 N 0.00 0.34 0.26 -2.24 0.02 -1.98 -3.05 113.55 106.90 1d8b h SER 58 Ca 0.00 -0.59 -0.01 0.00 -0.84 0.00 0.00 61.79 60.35 1d8b h SER 58 Cb 0.68 -0.10 -0.00 0.00 0.14 0.00 0.00 62.40 63.12 1d8b h SER 58 CO 0.00 0.87 -0.06 0.00 -1.14 0.00 0.00 176.83 176.49 1d8b h ALA 59 N 0.48 1.29 0.00 3.77 0.00 -1.96 -1.96 119.26 120.88 1d8b h ALA 59 Ca -0.00 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 1d8b h ALA 59 Cb 0.83 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.60 1d8b h ALA 59 CO 0.05 0.08 -0.08 0.74 0.00 0.00 0.00 179.25 180.04 1d8b h PHE 60 N 0.00 0.00 0.00 0.00 0.04 -1.63 -2.15 116.94 113.20 1d8b h PHE 60 Ca -0.00 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.75 1d8b h PHE 60 Cb 0.21 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.35 1d8b h PHE 60 CO 0.00 0.08 -0.11 0.00 -0.60 0.00 0.00 178.31 177.68 1d8b h ALA 61 N 1.92 1.35 -0.01 2.45 0.00 -1.45 -1.53 119.26 121.99 1d8b h ALA 61 Ca -0.00 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1d8b h ALA 61 Cb 0.18 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1d8b h ALA 61 CO 0.01 0.14 0.00 0.25 0.00 0.00 0.00 179.25 179.65 1d8b n THR 62 N -3.73 0.01 0.07 0.00 -2.24 -0.81 -3.04 114.28 104.55 1d8b n THR 62 Ca -0.02 -0.06 -0.11 0.00 -2.27 0.00 0.00 64.05 61.60 1d8b n THR 62 Cb 0.22 -0.25 -0.13 0.00 -2.10 0.00 0.00 70.33 68.08 1d8b n THR 62 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1d8b h LEU 63 N 0.48 0.16 0.00 3.22 3.38 -1.42 -3.48 115.31 117.65 1d8b h LEU 63 Ca 0.00 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 57.79 1d8b h LEU 63 Cb 0.10 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 40.80 1d8b h LEU 63 CO 0.00 1.14 0.00 0.61 0.09 0.00 0.00 178.44 180.28 1d8b n GLY 64 N 1.43 1.78 1.38 0.83 0.00 -1.17 -4.62 105.19 104.83 1d8b n GLY 64 Ca -0.04 -0.02 -0.06 0.00 0.00 0.00 0.00 46.02 45.90 1d8b n GLY 64 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1d8b n THR 65 N 0.00 1.73 -3.98 2.61 -2.24 -1.26 -4.71 114.28 106.43 1d8b n THR 65 Ca 0.00 -0.58 -0.32 0.00 -2.27 0.00 0.00 64.05 60.87 1d8b n THR 65 Cb 0.00 -1.06 -0.14 0.00 -2.10 0.00 0.00 70.33 67.03 1d8b n THR 65 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 1d8b s VAL 66 N -0.78 2.48 0.78 2.28 -7.23 -1.26 -5.02 120.40 111.66 1d8b s VAL 66 Ca 0.12 -2.12 -0.13 0.00 -1.81 0.00 0.00 61.98 58.04 1d8b s VAL 66 Cb 0.10 -2.72 0.18 0.00 0.56 0.00 0.00 36.38 34.51 1d8b s VAL 66 CO 0.01 -0.49 0.96 -0.62 -0.31 0.00 0.00 175.10 174.66 1d8b n GLU 67 N 4.36 -1.39 -0.36 4.82 -0.58 -1.26 -4.61 120.64 121.63 1d8b n GLU 67 Ca -0.01 -1.49 0.06 0.00 -0.42 0.00 0.00 57.16 55.30 1d8b n GLU 67 Cb 0.42 -1.08 0.23 0.00 -0.57 0.00 0.00 31.44 30.43 1d8b n GLU 67 CO 0.00 0.00 0.00 0.22 -0.48 0.00 0.00 177.13 176.87 1d8b h ASP 68 N -1.56 0.92 0.44 1.62 3.58 -1.98 0.26 116.42 119.69 1d8b h ASP 68 Ca -0.32 0.05 -0.12 0.00 0.42 0.00 0.00 57.03 57.05 1d8b h ASP 68 Cb 0.91 -0.14 -0.01 0.00 1.72 0.00 0.00 39.33 41.80 1d8b h ASP 68 CO 0.22 0.50 -0.54 0.07 -2.88 0.00 0.00 179.24 176.61 1d8b h LYS 69 N 0.99 0.11 0.02 0.28 -0.00 -1.99 -0.34 116.57 115.64 1d8b h LYS 69 Ca 0.48 -0.06 -0.25 0.00 -0.00 0.00 0.00 60.65 60.82 1d8b h LYS 69 Cb 0.45 0.01 0.01 0.00 -0.00 0.00 0.00 32.23 32.70 1d8b h LYS 69 CO -0.26 0.62 -1.02 1.88 -0.00 0.00 0.00 179.45 180.68 1d8b h TYR 70 N 0.08 0.80 -0.16 0.07 -1.99 -1.45 -2.92 116.97 111.40 1d8b h TYR 70 Ca -0.00 -0.45 -0.12 0.00 2.00 0.00 0.00 58.73 60.16 1d8b h TYR 70 Cb 0.98 -0.09 -0.01 0.00 2.00 0.00 0.00 36.73 39.62 1d8b h TYR 70 CO 0.01 1.28 -0.41 0.00 -0.00 0.00 0.00 178.16 179.04 1d8b h ARG 71 N 0.29 0.37 0.60 4.88 2.47 -0.43 -2.86 114.38 119.69 1d8b h ARG 71 Ca -0.11 -0.18 -0.03 0.00 -1.26 0.00 0.00 59.98 58.40 1d8b h ARG 71 Cb 1.67 -0.00 0.01 0.00 -1.65 0.00 0.00 29.97 29.99 1d8b h ARG 71 CO 0.19 0.72 -0.29 0.00 0.56 0.00 0.00 179.97 181.15 1d8b h ARG 72 N 0.31 -0.77 0.00 0.04 -0.00 -1.05 -3.00 114.38 109.91 1d8b h ARG 72 Ca 0.03 0.05 0.00 0.00 -0.50 0.00 0.00 59.98 59.56 1d8b h ARG 72 Cb 0.85 0.18 0.00 0.00 0.00 0.00 0.00 29.97 31.00 1d8b h ARG 72 CO 0.07 -0.51 0.00 2.89 0.00 0.00 0.00 179.97 182.42 1d8b n ARG 73 N -4.77 0.16 0.17 0.04 0.00 -1.11 -2.39 116.66 108.77 1d8b n ARG 73 Ca -0.10 0.16 0.14 0.00 -0.00 0.00 0.00 57.85 58.05 1d8b n ARG 73 Cb 0.32 -1.50 0.70 0.00 -0.00 0.00 0.00 32.46 31.97 1d8b n ARG 73 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.63 178.37 1d8b h PHE 74 N 0.00 0.00 -0.37 2.89 0.04 -1.35 -1.35 116.94 116.80 1d8b h PHE 74 Ca 0.00 0.00 0.11 0.00 2.80 0.00 0.00 57.97 60.88 1d8b h PHE 74 Cb 0.06 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.20 1d8b h PHE 74 CO 0.00 0.00 0.45 1.57 -0.60 0.00 0.00 178.31 179.73 1d8b h LYS 75 N 0.00 0.00 -0.00 1.51 2.10 -1.65 0.38 116.57 118.91 1d8b h LYS 75 Ca 0.10 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.75 1d8b h LYS 75 Cb 0.41 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.74 1d8b h LYS 75 CO -0.00 0.00 -0.11 0.66 -2.00 0.00 0.00 179.45 178.00 1d8b n TYR 76 N -3.59 0.00 0.34 0.07 4.01 -0.51 -3.40 117.16 114.08 1d8b n TYR 76 Ca 0.06 0.00 0.05 0.00 -0.16 0.00 0.00 57.90 57.85 1d8b n TYR 76 Cb 0.61 -0.36 -0.06 0.00 -0.31 0.00 0.00 39.34 39.22 1d8b n TYR 76 CO 0.00 0.00 0.00 1.19 -0.46 0.00 0.00 176.86 177.59 1d8b n PHE 77 N -1.36 0.00 -0.21 -0.72 3.72 0.13 -4.64 117.46 114.38 1d8b n PHE 77 Ca 0.09 0.00 0.18 0.00 -0.05 0.00 0.00 57.45 57.67 1d8b n PHE 77 Cb 0.31 -0.06 0.51 0.00 -0.94 0.00 0.00 39.48 39.30 1d8b n PHE 77 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 176.76 177.58 1d8b h LYS 78 N 0.00 0.40 -0.03 -1.08 6.56 -1.40 0.24 116.57 121.26 1d8b h LYS 78 Ca 0.00 -0.02 -0.17 0.00 -1.06 0.00 0.00 60.65 59.40 1d8b h LYS 78 Cb 0.28 -0.09 -0.01 0.00 -0.57 0.00 0.00 32.23 31.84 1d8b h LYS 78 CO 0.00 0.26 -0.73 0.00 -2.06 0.00 0.00 179.45 176.92 1d8b h ALA 79 N 1.62 0.72 0.06 3.86 0.00 -1.82 -2.60 119.26 121.10 1d8b h ALA 79 Ca 0.42 -0.63 -0.00 0.00 0.00 0.00 0.00 54.91 54.70 1d8b h ALA 79 Cb 1.03 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.74 1d8b h ALA 79 CO -0.15 0.83 -0.03 1.15 0.00 0.00 0.00 179.25 181.05 1d8b h THR 80 N 0.12 1.26 -0.80 0.00 2.02 -1.18 -2.41 112.91 111.92 1d8b h THR 80 Ca -0.02 -1.38 0.08 0.00 0.77 0.00 0.00 66.41 65.86 1d8b h THR 80 Cb 1.29 2.12 -0.07 0.00 -1.74 0.00 0.00 68.15 69.75 1d8b h THR 80 CO 0.11 0.33 0.47 0.40 0.37 0.00 0.00 175.52 177.20 1d8b h ILE 81 N -0.73 0.95 -0.37 3.11 2.04 -0.71 0.13 117.51 121.92 1d8b h ILE 81 Ca -0.01 -0.28 -0.13 0.00 1.00 0.00 0.00 64.86 65.44 1d8b h ILE 81 Cb 0.60 0.06 -0.01 0.00 -0.74 0.00 0.00 36.82 36.74 1d8b h ILE 81 CO 0.01 0.15 -0.30 0.00 0.00 0.00 0.00 178.15 178.01 1d8b h ALA 82 N 1.42 0.78 -0.33 1.87 0.00 -1.53 -2.66 119.26 118.81 1d8b h ALA 82 Ca 0.37 -0.41 -0.17 0.00 0.00 0.00 0.00 54.91 54.70 1d8b h ALA 82 Cb 0.28 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 1d8b h ALA 82 CO -0.22 0.65 -0.48 0.22 0.00 0.00 0.00 179.25 179.43 1d8b h ASP 83 N 0.67 0.98 0.21 0.00 3.58 -0.85 -2.90 116.42 118.11 1d8b h ASP 83 Ca 0.08 -0.49 -0.09 0.00 0.42 0.00 0.00 57.03 56.95 1d8b h ASP 83 Cb 0.84 -0.28 -0.01 0.00 1.72 0.00 0.00 39.33 41.60 1d8b h ASP 83 CO 0.07 1.29 -0.34 -0.07 -2.88 0.00 0.00 179.24 177.31 1d8b h LEU 84 N 0.71 0.20 -0.78 2.28 3.38 -0.96 -1.23 115.31 118.90 1d8b h LEU 84 Ca 0.03 -0.07 -0.12 0.00 0.09 0.00 0.00 57.88 57.81 1d8b h LEU 84 Cb 1.08 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 41.76 1d8b h LEU 84 CO 0.11 0.54 -0.57 0.77 0.09 0.00 0.00 178.44 179.38 1d8b h SER 85 N 0.17 0.00 0.95 -0.43 4.64 -1.44 -1.53 113.55 115.91 1d8b h SER 85 Ca 0.02 0.00 -0.18 0.00 -0.47 0.00 0.00 61.79 61.16 1d8b h SER 85 Cb 0.69 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.76 1d8b h SER 85 CO 0.05 0.57 -0.87 0.50 -0.87 0.00 0.00 176.83 176.20 1d8b h LYS 86 N 0.00 0.00 0.00 4.77 3.64 -1.25 -3.16 116.57 120.57 1d8b h LYS 86 Ca -0.01 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1d8b h LYS 86 Cb 1.07 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.89 1d8b h LYS 86 CO 0.07 0.87 -0.27 0.87 -2.27 0.00 0.00 179.45 178.73 1d8b h LYS 87 N 0.00 0.00 -7.18 1.90 1.79 -1.00 -3.47 116.57 108.62 1d8b h LYS 87 Ca -0.01 0.00 -0.53 0.00 -2.18 0.00 0.00 60.65 57.94 1d8b h LYS 87 Cb 1.58 0.00 0.14 0.00 -1.58 0.00 0.00 32.23 32.37 1d8b h LYS 87 CO 0.11 0.00 0.39 0.50 -1.08 0.00 0.00 179.45 179.37 1d8b s ARG 88 N -3.14 2.38 -1.08 3.15 3.52 -0.60 -4.86 118.95 118.33 1d8b s ARG 88 Ca 0.08 1.65 -0.17 0.00 -0.13 0.00 0.00 55.73 57.17 1d8b s ARG 88 Cb 0.12 -1.87 -0.07 0.00 -1.56 0.00 0.00 34.95 31.56 1d8b s ARG 88 CO 0.65 -1.62 2.12 0.43 -0.81 0.00 0.00 175.30 176.07 1d8b n SER 89 N -2.56 3.66 -3.59 -2.12 7.64 -1.26 -4.30 113.62 111.09 1d8b n SER 89 Ca 0.12 -2.69 -0.20 0.00 1.01 0.00 0.00 58.87 57.12 1d8b n SER 89 Cb 0.51 -1.33 0.06 0.00 -1.01 0.00 0.00 64.21 62.44 1d8b n SER 89 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 1d8b n SER 90 N 6.38 -1.92 0.00 6.43 7.64 -1.26 -5.24 113.62 125.65 1d8b n SER 90 Ca 0.52 -0.72 0.00 0.00 1.01 0.00 0.00 58.87 59.68 1d8b n SER 90 Cb 0.36 -4.56 0.00 0.00 -1.01 0.00 0.00 64.21 58.99 1d8b n SER 90 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41