#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 0.50 -3.28 4.31 3.38 -2.04 -3.13 115.31 115.04 1d8b h LEU 12 Ca 0.00 -0.27 -0.27 0.00 0.09 0.00 0.00 57.88 57.43 1d8b h LEU 12 Cb 0.00 -0.14 -0.12 0.00 0.09 0.00 0.00 40.66 40.48 1d8b h LEU 12 CO 0.00 0.96 0.35 -0.46 0.09 0.00 0.00 178.44 179.37 1d8b n ASN 13 N -3.94 5.65 0.25 -0.43 6.94 -1.26 -4.39 115.26 118.09 1d8b n ASN 13 Ca -0.03 -2.91 0.10 0.00 -0.02 0.00 0.00 54.58 51.71 1d8b n ASN 13 Cb 0.60 -0.97 0.64 0.00 -2.36 0.00 0.00 39.78 37.69 1d8b n ASN 13 CO 0.00 0.00 0.00 -1.13 -1.03 0.00 0.00 177.26 175.10 1d8b h ASN 14 N 1.19 0.00 0.10 0.53 -0.73 -1.87 -2.10 115.58 112.69 1d8b h ASN 14 Ca 0.26 0.00 -0.01 0.00 1.87 0.00 0.00 56.30 58.41 1d8b h ASN 14 Cb 1.12 0.00 -0.00 0.00 0.27 0.00 0.00 38.32 39.71 1d8b h ASN 14 CO 0.62 0.15 -0.07 0.25 -0.37 0.00 0.00 177.43 178.01 1d8b h LEU 15 N 0.00 0.00 -1.19 0.34 6.46 -1.89 -2.00 115.31 117.02 1d8b h LEU 15 Ca -0.00 0.00 -0.05 0.00 -0.12 0.00 0.00 57.88 57.71 1d8b h LEU 15 Cb 0.33 0.00 -0.02 0.00 -0.73 0.00 0.00 40.66 40.24 1d8b h LEU 15 CO 0.02 0.07 0.04 -0.09 -0.62 0.00 0.00 178.44 177.86 1d8b h ARG 16 N 0.00 0.60 -0.28 1.25 2.43 -1.74 -1.83 114.38 114.81 1d8b h ARG 16 Ca -0.00 -0.12 -0.12 0.00 -0.81 0.00 0.00 59.98 58.93 1d8b h ARG 16 Cb 0.13 -0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 29.58 1d8b h ARG 16 CO 0.01 0.59 -0.33 1.98 -1.51 0.00 0.00 179.97 180.71 1d8b h MET 17 N 0.58 0.61 -0.38 0.20 4.05 -1.51 -1.34 114.93 117.14 1d8b h MET 17 Ca 0.13 -0.28 -0.00 0.00 -0.28 0.00 0.00 59.70 59.26 1d8b h MET 17 Cb 0.30 -0.01 -0.02 0.00 -0.80 0.00 0.00 31.60 31.07 1d8b h MET 17 CO 0.01 0.86 0.23 1.15 0.23 0.00 0.00 176.91 179.38 1d8b h THR 18 N 0.52 1.13 -0.69 -0.77 2.02 -1.29 -0.33 112.91 113.50 1d8b h THR 18 Ca 0.06 -0.31 -0.05 0.00 0.77 0.00 0.00 66.41 66.88 1d8b h THR 18 Cb 0.82 0.64 -0.03 0.00 -1.74 0.00 0.00 68.15 67.84 1d8b h THR 18 CO 0.07 0.13 0.23 0.22 0.37 0.00 0.00 175.52 176.55 1d8b h TYR 19 N 0.50 1.07 -0.14 3.16 3.20 -1.15 -2.32 116.97 121.29 1d8b h TYR 19 Ca 0.14 -0.09 -0.01 0.00 3.14 0.00 0.00 58.73 61.91 1d8b h TYR 19 Cb 0.02 -0.32 -0.01 0.00 1.54 0.00 0.00 36.73 37.96 1d8b h TYR 19 CO -0.03 0.84 0.05 0.93 -1.64 0.00 0.00 178.16 178.31 1d8b h GLU 20 N 1.01 0.21 -0.22 1.82 5.08 -0.64 0.19 114.58 122.03 1d8b h GLU 20 Ca 0.23 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.55 1d8b h GLU 20 Cb 0.26 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.46 1d8b h GLU 20 CO -0.01 0.30 0.14 -0.09 -1.00 0.00 0.00 179.01 178.35 1d8b h ARG 21 N 0.06 0.29 0.02 2.33 2.43 -0.93 0.14 114.38 118.72 1d8b h ARG 21 Ca 0.05 -0.02 -0.27 0.00 -0.81 0.00 0.00 59.98 58.93 1d8b h ARG 21 Cb 0.18 -0.06 0.02 0.00 -0.42 0.00 0.00 29.97 29.68 1d8b h ARG 21 CO -0.00 0.19 -1.07 -0.07 -1.51 0.00 0.00 179.97 177.51 1d8b h LEU 22 N 0.30 0.90 -0.56 3.80 3.38 -1.01 -2.07 115.31 120.04 1d8b h LEU 22 Ca 0.08 -0.73 -0.14 0.00 0.09 0.00 0.00 57.88 57.18 1d8b h LEU 22 Cb -0.03 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.43 1d8b h LEU 22 CO -0.02 1.54 -0.35 -0.09 0.09 0.00 0.00 178.44 179.61 1d8b h ARG 23 N 0.38 0.78 -0.15 1.13 9.65 0.21 0.23 114.38 126.61 1d8b h ARG 23 Ca -0.14 -0.38 -0.18 0.00 -1.10 0.00 0.00 59.98 58.19 1d8b h ARG 23 Cb 1.72 -0.00 -0.00 0.00 -1.39 0.00 0.00 29.97 30.30 1d8b h ARG 23 CO 0.21 1.00 -0.63 0.93 2.80 0.00 0.00 179.97 184.28 1d8b h GLU 24 N 0.65 0.53 -0.05 0.20 4.39 -0.82 -2.31 114.58 117.17 1d8b h GLU 24 Ca 0.06 -0.38 -0.23 0.00 0.34 0.00 0.00 59.36 59.16 1d8b h GLU 24 Cb 0.89 0.06 0.01 0.00 -0.10 0.00 0.00 28.75 29.61 1d8b h GLU 24 CO 0.08 1.00 -0.89 1.25 -1.16 0.00 0.00 179.01 179.28 1d8b h LEU 25 N 0.39 0.73 -1.04 1.33 6.46 -1.23 -2.22 115.31 119.72 1d8b h LEU 25 Ca -0.01 -0.54 -0.05 0.00 -0.12 0.00 0.00 57.88 57.16 1d8b h LEU 25 Cb 1.20 -0.22 -0.02 0.00 -0.73 0.00 0.00 40.66 40.89 1d8b h LEU 25 CO 0.12 1.33 0.09 0.28 -0.62 0.00 0.00 178.44 179.64 1d8b h SER 26 N 0.36 0.73 0.75 1.25 0.02 -0.51 0.86 113.55 117.01 1d8b h SER 26 Ca -0.08 -0.14 -0.17 0.00 -0.84 0.00 0.00 61.79 60.57 1d8b h SER 26 Cb 1.52 -0.19 -0.02 0.00 0.14 0.00 0.00 62.40 63.85 1d8b h SER 26 CO 0.17 0.74 -0.79 -0.07 -1.14 0.00 0.00 176.83 175.75 1d8b h LEU 27 N 0.75 0.03 0.17 5.07 4.07 -1.41 -1.34 115.31 122.66 1d8b h LEU 27 Ca 0.16 -0.02 -0.01 0.00 0.08 0.00 0.00 57.88 58.09 1d8b h LEU 27 Cb 0.32 -0.01 0.00 0.00 1.08 0.00 0.00 40.66 42.06 1d8b h LEU 27 CO 0.00 0.80 -0.08 -1.13 -1.08 0.00 0.00 178.44 176.95 1d8b h ASN 28 N 0.01 -0.20 -0.59 -0.43 -0.73 -0.74 -2.85 115.58 110.06 1d8b h ASN 28 Ca -0.01 0.01 -0.03 0.00 1.87 0.00 0.00 56.30 58.14 1d8b h ASN 28 Cb 1.39 0.05 -0.03 0.00 0.27 0.00 0.00 38.32 40.00 1d8b h ASN 28 CO 0.10 -0.01 0.29 -0.07 -0.37 0.00 0.00 177.43 177.37 1d8b h LEU 29 N -0.50 0.80 -1.03 0.34 3.38 -0.99 0.32 115.31 117.63 1d8b h LEU 29 Ca -0.02 -0.09 -0.04 0.00 0.09 0.00 0.00 57.88 57.82 1d8b h LEU 29 Cb 0.18 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.70 1d8b h LEU 29 CO 0.04 0.69 0.21 1.23 0.09 0.00 0.00 178.44 180.70 1d8b h GLY 30 N 0.97 0.97 0.49 0.83 0.00 -1.37 -1.83 103.07 103.14 1d8b h GLY 30 Ca 0.22 -0.53 0.00 0.00 0.00 0.00 0.00 47.33 47.02 1d8b h GLY 30 CO -0.03 0.50 -1.05 -2.01 0.00 0.00 0.00 176.54 173.95 1d8b n ASN 31 N -4.30 0.62 -0.04 0.19 5.15 -1.06 -1.38 115.26 114.45 1d8b n ASN 31 Ca 0.05 -0.32 0.12 0.00 -0.60 0.00 0.00 54.58 53.83 1d8b n ASN 31 Cb 0.19 0.86 0.33 0.00 -0.53 0.00 0.00 39.78 40.63 1d8b n ASN 31 CO 0.00 0.00 0.00 -1.14 1.40 0.00 0.00 177.26 177.52 1d8b n ARG 32 N -1.88 0.16 -3.42 1.20 0.63 0.08 -4.79 116.66 108.64 1d8b n ARG 32 Ca 0.02 -0.08 -0.38 0.00 -0.92 0.00 0.00 57.85 56.49 1d8b n ARG 32 Cb 0.42 -1.50 -0.06 0.00 0.45 0.00 0.00 32.46 31.77 1d8b n ARG 32 CO 0.00 0.00 0.00 1.41 -2.51 0.00 0.00 177.63 176.53 1d8b s MET 33 N -2.90 4.19 -0.15 -0.14 1.75 -0.70 -5.04 119.30 116.30 1d8b s MET 33 Ca 0.14 0.36 0.01 0.00 -1.25 0.00 0.00 55.69 54.96 1d8b s MET 33 Cb 0.18 -3.36 0.02 0.00 2.84 0.00 0.00 34.83 34.51 1d8b s MET 33 CO 0.64 0.35 -0.18 0.08 -0.65 0.00 0.00 175.02 175.27 1d8b s VAL 34 N 0.03 1.81 0.51 10.11 1.01 -1.26 -0.93 120.40 131.68 1d8b s VAL 34 Ca 0.23 -0.80 -0.21 0.00 0.00 0.00 0.00 61.98 61.21 1d8b s VAL 34 Cb -0.15 -1.65 -0.07 0.00 0.00 0.00 0.00 36.38 34.51 1d8b s VAL 34 CO 0.10 0.50 1.13 -2.16 0.00 0.00 0.00 175.10 174.67 1d8b s PRO 35 N 1.24 3.54 0.32 2.72 0.04 -1.26 -5.10 135.00 136.51 1d8b s PRO 35 Ca 0.02 1.62 -0.28 0.00 0.04 0.00 0.00 61.00 62.40 1d8b s PRO 35 Cb -0.14 -2.14 -0.13 0.00 0.04 0.00 0.00 34.50 32.14 1d8b s PRO 35 CO -0.09 -0.70 1.25 -2.30 0.04 0.00 0.00 177.00 175.21 1d8b n PRO 36 N -1.00 1.99 0.16 0.56 -0.02 -0.11 -4.90 135.00 131.68 1d8b n PRO 36 Ca 0.10 0.70 0.02 0.00 -2.02 0.00 0.00 63.50 62.29 1d8b n PRO 36 Cb 0.50 -2.25 0.26 0.00 -0.02 0.00 0.00 33.50 32.00 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 2.51 1.24 0.00 -1.45 2.07 -1.41 -3.47 116.25 115.74 1d8b h VAL 37 Ca -0.45 -1.76 0.00 0.00 0.82 0.00 0.00 66.70 65.31 1d8b h VAL 37 Cb 1.29 1.98 0.00 0.00 -1.52 0.00 0.00 31.29 33.04 1d8b h VAL 37 CO 0.64 0.48 0.00 0.61 0.02 0.00 0.00 177.57 179.32 1d8b n GLY 38 N 0.08 1.58 2.60 2.17 0.00 -1.26 -4.54 105.19 105.83 1d8b n GLY 38 Ca -0.01 -0.05 -0.28 0.00 0.00 0.00 0.00 46.02 45.68 1d8b n GLY 38 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1d8b s ASN 39 N 0.00 2.89 0.25 1.61 3.84 -1.26 -4.97 114.94 117.30 1d8b s ASN 39 Ca 0.00 -3.18 -0.03 0.00 0.21 0.00 0.00 52.86 49.85 1d8b s ASN 39 Cb 0.00 -0.89 0.46 0.00 -0.55 0.00 0.00 41.25 40.27 1d8b s ASN 39 CO 0.00 -0.17 1.76 0.15 -2.79 0.00 0.00 177.10 176.05 1d8b h PHE 40 N 5.82 0.69 -2.60 0.43 3.57 -1.80 -3.39 116.94 119.66 1d8b h PHE 40 Ca 0.17 0.03 -0.19 0.00 3.53 0.00 0.00 57.97 61.52 1d8b h PHE 40 Cb 0.87 -0.19 -0.31 0.00 2.79 0.00 0.00 35.95 39.11 1d8b h PHE 40 CO 0.44 0.18 -0.49 1.41 -2.23 0.00 0.00 178.31 177.61 1d8b s MET 41 N -6.01 0.22 0.47 1.11 1.75 -1.26 -5.04 119.30 110.55 1d8b s MET 41 Ca -0.12 0.74 -0.24 0.00 -1.25 0.00 0.00 55.69 54.82 1d8b s MET 41 Cb 0.20 -0.13 -0.08 0.00 2.84 0.00 0.00 34.83 37.67 1d8b s MET 41 CO 0.77 -0.37 1.25 -2.30 -0.65 0.00 0.00 175.02 173.73 1d8b n PRO 42 N 5.36 1.76 -0.33 4.11 -0.02 -1.26 -4.68 135.00 139.93 1d8b n PRO 42 Ca -0.06 0.63 0.14 0.00 -2.02 0.00 0.00 63.50 62.19 1d8b n PRO 42 Cb 0.50 -2.40 0.32 0.00 -0.02 0.00 0.00 33.50 31.90 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 1.76 0.59 -0.62 2.55 3.58 -1.98 0.21 116.42 122.50 1d8b h ASP 43 Ca -0.49 0.13 -0.03 0.00 0.42 0.00 0.00 57.03 57.06 1d8b h ASP 43 Cb 1.30 0.04 -0.03 0.00 1.72 0.00 0.00 39.33 42.36 1d8b h ASP 43 CO 0.58 0.13 0.26 0.28 -2.88 0.00 0.00 179.24 177.62 1d8b h SER 44 N 0.58 0.84 0.13 2.28 0.02 -2.00 -1.32 113.55 114.09 1d8b h SER 44 Ca 0.58 -0.16 -0.15 0.00 -0.84 0.00 0.00 61.79 61.21 1d8b h SER 44 Cb 1.02 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 63.33 1d8b h SER 44 CO -0.45 0.77 -0.56 0.40 -1.14 0.00 0.00 176.83 175.85 1d8b h ILE 45 N 0.86 1.34 -0.59 3.27 1.08 -1.34 -2.58 117.51 119.55 1d8b h ILE 45 Ca 0.21 -1.84 -0.02 0.00 -0.39 0.00 0.00 64.86 62.82 1d8b h ILE 45 Cb 0.18 1.84 -0.03 0.00 -3.07 0.00 0.00 36.82 35.74 1d8b h ILE 45 CO -0.02 0.56 0.28 -0.07 -0.69 0.00 0.00 178.15 178.22 1d8b h LEU 46 N 0.35 0.74 -0.13 1.44 3.38 -0.33 0.78 115.31 121.53 1d8b h LEU 46 Ca 0.00 -0.07 -0.10 0.00 0.09 0.00 0.00 57.88 57.81 1d8b h LEU 46 Cb 1.09 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.65 1d8b h LEU 46 CO 0.10 0.63 -0.29 0.11 0.09 0.00 0.00 178.44 179.07 1d8b h LYS 47 N 0.82 0.42 -0.27 1.13 1.57 -1.03 -1.73 116.57 117.48 1d8b h LYS 47 Ca 0.20 -0.28 -0.18 0.00 -1.87 0.00 0.00 60.65 58.52 1d8b h LYS 47 Cb 0.08 0.04 -0.00 0.00 0.08 0.00 0.00 32.23 32.43 1d8b h LYS 47 CO -0.03 0.89 -0.54 1.57 -0.57 0.00 0.00 179.45 180.77 1d8b h LYS 48 N 0.01 0.82 -0.03 3.15 2.10 -1.27 -1.62 116.57 119.73 1d8b h LYS 48 Ca -0.00 -0.52 -0.09 0.00 -2.00 0.00 0.00 60.65 58.04 1d8b h LYS 48 Cb 0.90 0.06 -0.01 0.00 -0.90 0.00 0.00 32.23 32.27 1d8b h LYS 48 CO 0.06 1.15 -0.42 0.00 -2.00 0.00 0.00 179.45 178.24 1d8b h MET 49 N 0.63 0.07 0.00 0.07 -0.00 -0.92 0.14 114.93 114.94 1d8b h MET 49 Ca 0.01 -0.03 -0.19 0.00 -0.00 0.00 0.00 59.70 59.49 1d8b h MET 49 Cb 1.14 -0.00 -0.03 0.00 -0.00 0.00 0.00 31.60 32.71 1d8b h MET 49 CO 0.12 0.48 -0.91 0.00 -0.00 0.00 0.00 176.91 176.60 1d8b h ALA 50 N 1.51 0.50 0.20 -3.00 0.00 -1.19 0.14 119.26 117.43 1d8b h ALA 50 Ca 0.00 -0.82 -0.34 0.00 0.00 0.00 0.00 54.91 53.75 1d8b h ALA 50 Cb 0.77 -0.14 0.02 0.00 0.00 0.00 0.00 17.79 18.44 1d8b h ALA 50 CO 0.06 1.12 -1.65 0.00 0.00 0.00 0.00 179.25 178.78 1d8b h ALA 51 N 1.08 0.06 0.11 0.00 0.00 -1.01 -3.38 119.26 116.12 1d8b h ALA 51 Ca -0.01 -1.05 -0.34 0.00 0.00 0.00 0.00 54.91 53.51 1d8b h ALA 51 Cb 1.61 0.37 -0.02 0.00 0.00 0.00 0.00 17.79 19.76 1d8b h ALA 51 CO 0.12 0.91 -1.81 0.82 0.00 0.00 0.00 179.25 179.29 1d8b h ILE 52 N 0.09 0.82 -6.02 0.00 5.03 -0.82 -3.49 117.51 113.11 1d8b h ILE 52 Ca -0.32 -2.53 -0.23 0.00 -0.12 0.00 0.00 64.86 61.66 1d8b h ILE 52 Cb 2.10 2.58 0.00 0.00 -3.03 0.00 0.00 36.82 38.47 1d8b h ILE 52 CO 0.20 0.80 -0.55 0.18 -0.68 0.00 0.00 178.15 178.10 1d8b n LEU 53 N -3.41 -4.52 -4.68 1.44 4.77 0.48 -4.90 117.00 106.18 1d8b n LEU 53 Ca -0.25 -0.44 -0.43 0.00 -0.03 0.00 0.00 56.01 54.86 1d8b n LEU 53 Cb 1.05 -2.51 -0.02 0.00 -2.33 0.00 0.00 43.42 39.61 1d8b n LEU 53 CO 0.46 -0.47 0.85 -2.84 -1.33 0.00 0.00 177.39 174.06 1d8b s PRO 54 N -3.82 4.38 0.06 3.23 0.02 -1.26 -4.96 135.00 132.65 1d8b s PRO 54 Ca 0.03 1.45 -0.19 0.00 0.02 0.00 0.00 61.00 62.30 1d8b s PRO 54 Cb -0.00 -3.57 -0.12 0.00 0.02 0.00 0.00 34.50 30.83 1d8b s PRO 54 CO 0.82 -0.40 1.38 0.52 -0.33 0.00 0.00 177.00 179.00 1d8b h MET 55 N 7.25 0.43 0.00 5.54 2.86 -1.94 -3.46 114.93 125.61 1d8b h MET 55 Ca -0.30 -0.21 -0.14 0.00 -2.06 0.00 0.00 59.70 56.99 1d8b h MET 55 Cb 1.14 0.00 -0.04 0.00 0.06 0.00 0.00 31.60 32.76 1d8b h MET 55 CO 0.88 0.76 -0.14 0.09 1.06 0.00 0.00 176.91 179.57 1d8b n ASN 56 N -4.52 -0.23 0.03 1.22 4.13 -1.26 -5.03 115.26 109.60 1d8b n ASN 56 Ca -0.05 -1.67 0.15 0.00 1.68 0.00 0.00 54.58 54.69 1d8b n ASN 56 Cb 0.36 0.53 0.62 0.00 -1.54 0.00 0.00 39.78 39.76 1d8b n ASN 56 CO 0.00 0.00 0.00 -0.78 0.28 0.00 0.00 177.26 176.76 1d8b h ASP 57 N 0.63 0.11 -0.27 6.41 3.58 -1.97 -1.50 116.42 123.41 1d8b h ASP 57 Ca -0.07 0.00 0.06 0.00 0.42 0.00 0.00 57.03 57.44 1d8b h ASP 57 Cb 0.37 -0.02 -0.06 0.00 1.72 0.00 0.00 39.33 41.33 1d8b h ASP 57 CO 0.11 0.07 -0.16 0.77 -2.88 0.00 0.00 179.24 177.14 1d8b h SER 58 N 0.12 -0.52 0.98 2.28 4.64 -1.99 -2.16 113.55 116.90 1d8b h SER 58 Ca 0.21 0.12 -0.21 0.00 -0.47 0.00 0.00 61.79 61.43 1d8b h SER 58 Cb 0.66 0.28 -0.03 0.00 -0.31 0.00 0.00 62.40 63.00 1d8b h SER 58 CO -0.02 -0.20 -1.01 0.00 -0.87 0.00 0.00 176.83 174.73 1d8b h ALA 59 N 1.05 0.34 -0.29 5.18 0.00 -1.85 -3.28 119.26 120.41 1d8b h ALA 59 Ca 0.14 -0.91 0.08 0.00 0.00 0.00 0.00 54.91 54.23 1d8b h ALA 59 Cb 0.35 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1d8b h ALA 59 CO -0.35 1.24 0.39 0.74 0.00 0.00 0.00 179.25 181.27 1d8b h PHE 60 N 0.00 0.00 -0.01 0.00 0.04 -0.64 -0.48 116.94 115.86 1d8b h PHE 60 Ca -0.02 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.76 1d8b h PHE 60 Cb 1.78 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.93 1d8b h PHE 60 CO 0.00 0.00 0.01 0.00 -0.60 0.00 0.00 178.31 177.72 1d8b h ALA 61 N 1.50 1.52 0.00 2.45 0.00 -1.55 -0.49 119.26 122.69 1d8b h ALA 61 Ca 0.14 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1d8b h ALA 61 Cb 0.91 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.70 1d8b h ALA 61 CO -0.00 -0.02 0.00 0.25 0.00 0.00 0.00 179.25 179.48 1d8b n THR 62 N -3.82 0.02 1.16 0.00 -2.24 -0.19 -2.99 114.28 106.21 1d8b n THR 62 Ca -0.03 0.00 0.14 0.00 -2.27 0.00 0.00 64.05 61.89 1d8b n THR 62 Cb 0.09 -0.52 0.59 0.00 -2.10 0.00 0.00 70.33 68.38 1d8b n THR 62 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1d8b n LEU 63 N -1.09 0.17 -0.18 3.22 4.77 -0.19 -4.90 117.00 118.79 1d8b n LEU 63 Ca 0.20 0.29 0.00 0.00 -0.03 0.00 0.00 56.01 56.47 1d8b n LEU 63 Cb 0.15 -0.36 0.00 0.00 -2.33 0.00 0.00 43.42 40.88 1d8b n LEU 63 CO 0.19 0.04 0.00 0.61 -1.33 0.00 0.00 177.39 176.90 1d8b n GLY 64 N 1.42 0.72 3.16 -0.72 0.00 -1.16 -4.72 105.19 103.88 1d8b n GLY 64 Ca 0.10 -0.14 -0.22 0.00 0.00 0.00 0.00 46.02 45.76 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 -0.40 -7.85 -2.32 2.61 -2.24 -1.25 -4.94 114.28 97.88 1d8b n THR 65 Ca 0.00 0.51 -0.36 0.00 -2.27 0.00 0.00 64.05 61.93 1d8b n THR 65 Cb 0.12 -5.60 -0.01 0.00 -2.10 0.00 0.00 70.33 62.74 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 -2.12 3.28 0.58 2.28 -7.23 -1.26 -5.01 120.40 110.91 1d8b s VAL 66 Ca 0.30 0.87 -0.17 0.00 -1.81 0.00 0.00 61.98 61.16 1d8b s VAL 66 Cb -0.05 -3.39 -0.04 0.00 0.56 0.00 0.00 36.38 33.45 1d8b s VAL 66 CO 0.82 -0.10 1.09 -1.61 -0.31 0.00 0.00 175.10 174.99 1d8b s GLU 67 N -3.00 3.27 0.41 4.82 2.02 -1.26 -4.82 118.70 120.14 1d8b s GLU 67 Ca 0.67 1.40 0.08 0.00 0.02 0.00 0.00 54.97 57.14 1d8b s GLU 67 Cb -0.24 -2.01 0.88 0.00 0.10 0.00 0.00 34.13 32.86 1d8b s GLU 67 CO 0.29 -0.88 2.04 0.22 0.02 0.00 0.00 175.26 176.95 1d8b h ASP 68 N 0.73 0.46 0.13 -0.19 3.58 -1.97 0.20 116.42 119.36 1d8b h ASP 68 Ca -0.48 -0.01 -0.02 0.00 0.42 0.00 0.00 57.03 56.94 1d8b h ASP 68 Cb 1.24 -0.11 -0.00 0.00 1.72 0.00 0.00 39.33 42.18 1d8b h ASP 68 CO 0.57 0.32 -0.11 0.07 -2.88 0.00 0.00 179.24 177.21 1d8b h LYS 69 N 0.54 0.00 0.05 0.28 2.10 -2.00 0.16 116.57 117.70 1d8b h LYS 69 Ca 0.18 0.00 -0.31 0.00 -2.00 0.00 0.00 60.65 58.52 1d8b h LYS 69 Cb 0.04 0.00 -0.03 0.00 -0.90 0.00 0.00 32.23 31.34 1d8b h LYS 69 CO -0.04 0.11 -1.72 1.88 -2.00 0.00 0.00 179.45 177.68 1d8b h TYR 70 N 0.00 0.18 -0.55 0.07 0.05 -1.43 -3.27 116.97 112.03 1d8b h TYR 70 Ca -0.00 -0.14 -0.05 0.00 0.05 0.00 0.00 58.73 58.60 1d8b h TYR 70 Cb 0.20 -0.01 -0.03 0.00 1.01 0.00 0.00 36.73 37.91 1d8b h TYR 70 CO 0.00 1.25 0.15 0.00 -1.05 0.00 0.00 178.16 178.51 1d8b h ARG 71 N 0.03 0.83 -0.10 4.88 2.47 0.10 -0.65 114.38 121.93 1d8b h ARG 71 Ca -0.30 -0.16 -0.23 0.00 -1.26 0.00 0.00 59.98 58.03 1d8b h ARG 71 Cb 2.01 -0.13 0.01 0.00 -1.65 0.00 0.00 29.97 30.21 1d8b h ARG 71 CO 0.10 0.73 -0.83 -0.09 0.56 0.00 0.00 179.97 180.44 1d8b h ARG 72 N 0.80 0.73 -0.00 0.04 1.12 -0.84 -3.09 114.38 113.14 1d8b h ARG 72 Ca 0.18 -0.66 0.00 0.00 -1.11 0.00 0.00 59.98 58.39 1d8b h ARG 72 Cb 0.27 0.16 0.00 0.00 -0.01 0.00 0.00 29.97 30.39 1d8b h ARG 72 CO -0.00 1.26 -0.04 2.89 -3.11 0.00 0.00 179.97 180.97 1d8b n ARG 73 N -3.95 1.04 -0.09 0.20 0.00 -1.14 -3.66 116.66 109.06 1d8b n ARG 73 Ca -0.09 -0.32 0.02 0.00 -0.00 0.00 0.00 57.85 57.46 1d8b n ARG 73 Cb 0.77 -1.49 0.32 0.00 -0.00 0.00 0.00 32.46 32.06 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 0.78 0.70 -0.16 2.89 0.04 -1.02 -2.51 116.94 117.67 1d8b h PHE 74 Ca 0.00 -0.00 0.05 0.00 2.80 0.00 0.00 57.97 60.82 1d8b h PHE 74 Cb 0.26 -0.23 -0.01 0.00 2.20 0.00 0.00 35.95 38.17 1d8b h PHE 74 CO 0.00 0.48 0.29 1.57 -0.60 0.00 0.00 178.31 180.05 1d8b h LYS 75 N 0.74 0.00 0.00 1.51 5.09 -1.74 0.16 116.57 122.33 1d8b h LYS 75 Ca 0.19 0.00 0.00 0.00 0.09 0.00 0.00 60.65 60.93 1d8b h LYS 75 Cb -0.00 0.00 0.00 0.00 0.10 0.00 0.00 32.23 32.33 1d8b h LYS 75 CO -0.03 0.00 0.00 0.66 -2.09 0.00 0.00 179.45 177.99 1d8b n TYR 76 N -3.39 0.00 0.34 0.07 4.01 -0.94 -2.53 117.16 114.71 1d8b n TYR 76 Ca 0.01 0.00 0.04 0.00 -0.16 0.00 0.00 57.90 57.79 1d8b n TYR 76 Cb 0.39 -0.47 -0.05 0.00 -0.31 0.00 0.00 39.34 38.90 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 -1.47 0.00 -0.35 -0.72 3.72 0.52 -4.70 117.46 114.46 1d8b n PHE 77 Ca 0.06 0.00 0.25 0.00 -0.05 0.00 0.00 57.45 57.71 1d8b n PHE 77 Cb 0.23 -0.03 0.52 0.00 -0.94 0.00 0.00 39.48 39.27 1d8b n PHE 77 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 176.76 176.49 1d8b h LYS 78 N 0.00 0.33 0.05 -1.08 1.63 -1.21 0.42 116.57 116.72 1d8b h LYS 78 Ca 0.00 -0.02 -0.24 0.00 -0.85 0.00 0.00 60.65 59.54 1d8b h LYS 78 Cb 0.23 -0.08 -0.00 0.00 -0.60 0.00 0.00 32.23 31.78 1d8b h LYS 78 CO 0.00 0.22 -1.04 0.00 -3.45 0.00 0.00 179.45 175.18 1d8b h ALA 79 N 1.64 0.30 -0.07 5.00 0.00 -1.84 -2.94 119.26 121.35 1d8b h ALA 79 Ca 0.65 -0.79 -0.09 0.00 0.00 0.00 0.00 54.91 54.68 1d8b h ALA 79 Cb 1.70 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.46 1d8b h ALA 79 CO -0.35 0.92 -0.29 1.15 0.00 0.00 0.00 179.25 180.68 1d8b h THR 80 N 0.13 1.43 -0.50 0.00 2.02 -1.15 -1.75 112.91 113.08 1d8b h THR 80 Ca -0.09 -1.70 0.02 0.00 0.77 0.00 0.00 66.41 65.41 1d8b h THR 80 Cb 1.72 2.32 -0.03 0.00 -1.74 0.00 0.00 68.15 70.42 1d8b h THR 80 CO 0.17 0.49 0.33 0.40 0.37 0.00 0.00 175.52 177.28 1d8b h ILE 81 N -0.18 1.10 -0.01 3.11 2.04 -0.39 0.56 117.51 123.74 1d8b h ILE 81 Ca -0.02 -0.22 -0.23 0.00 1.00 0.00 0.00 64.86 65.39 1d8b h ILE 81 Cb 0.94 0.41 0.01 0.00 -0.74 0.00 0.00 36.82 37.43 1d8b h ILE 81 CO 0.06 0.12 -0.95 0.00 0.00 0.00 0.00 178.15 177.38 1d8b h ALA 82 N 1.70 0.31 -0.35 1.87 0.00 -1.51 -2.19 119.26 119.09 1d8b h ALA 82 Ca 0.19 -0.69 -0.16 0.00 0.00 0.00 0.00 54.91 54.25 1d8b h ALA 82 Cb -0.01 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 17.78 1d8b h ALA 82 CO -0.05 0.77 -0.40 0.22 0.00 0.00 0.00 179.25 179.80 1d8b h ASP 83 N 0.30 0.96 0.81 0.00 3.58 -0.59 -3.02 116.42 118.45 1d8b h ASP 83 Ca -0.09 -0.48 -0.17 0.00 0.42 0.00 0.00 57.03 56.71 1d8b h ASP 83 Cb 1.58 -0.27 -0.02 0.00 1.72 0.00 0.00 39.33 42.34 1d8b h ASP 83 CO 0.17 1.24 -0.82 -0.07 -2.88 0.00 0.00 179.24 176.89 1d8b h LEU 84 N 0.70 0.01 -0.95 2.28 3.38 -0.98 -2.86 115.31 116.89 1d8b h LEU 84 Ca 0.05 -0.01 -0.09 0.00 0.09 0.00 0.00 57.88 57.93 1d8b h LEU 84 Cb 0.99 -0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.73 1d8b h LEU 84 CO 0.10 0.82 -0.42 0.77 0.09 0.00 0.00 178.44 179.80 1d8b h SER 85 N 0.00 0.00 1.02 -0.43 4.64 -1.40 0.75 113.55 118.13 1d8b h SER 85 Ca -0.01 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.22 1d8b h SER 85 Cb 1.44 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.52 1d8b h SER 85 CO 0.11 0.42 -1.03 0.11 -0.87 0.00 0.00 176.83 175.57 1d8b h LYS 86 N 0.00 0.00 0.00 4.77 1.57 -1.53 -3.39 116.57 118.00 1d8b h LYS 86 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1d8b h LYS 86 Cb 0.91 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.22 1d8b h LYS 86 CO 0.05 0.19 -1.55 1.63 -0.57 0.00 0.00 179.45 179.21 1d8b n LYS 87 N -2.88 0.61 0.16 3.15 4.76 -1.08 -4.37 118.16 118.52 1d8b n LYS 87 Ca -0.04 -0.12 0.13 0.00 -2.87 0.00 0.00 58.31 55.42 1d8b n LYS 87 Cb 0.70 -1.31 0.54 0.00 -1.84 0.00 0.00 35.03 33.11 1d8b n LYS 87 CO 0.00 0.00 0.00 0.07 -1.37 0.00 0.00 177.40 176.10 1d8b h ARG 88 N 0.00 0.00 0.00 1.97 0.11 -1.03 -1.63 114.38 113.80 1d8b h ARG 88 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1d8b h ARG 88 Cb 0.61 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.69 1d8b h ARG 88 CO 0.00 0.00 0.00 -1.13 0.10 0.00 0.00 179.97 178.94 1d8b n SER 89 N -2.41 0.00 -2.29 0.08 3.41 -1.26 -4.85 113.62 106.29 1d8b n SER 89 Ca 0.02 -1.35 -0.19 0.00 -0.26 0.00 0.00 58.87 57.09 1d8b n SER 89 Cb 0.24 0.00 0.01 0.00 -0.26 0.00 0.00 64.21 64.20 1d8b n SER 89 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1d8b n SER 90 N -0.76 -5.42 -0.21 4.04 7.64 -0.61 -5.16 113.62 113.14 1d8b n SER 90 Ca 0.11 -0.10 0.03 0.00 1.01 0.00 0.00 58.87 59.92 1d8b n SER 90 Cb 0.05 -4.40 0.02 0.00 -1.01 0.00 0.00 64.21 58.87 1d8b n SER 90 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41