#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1d8b n LEU 12 N 0.00 7.36 -1.76 4.31 4.77 -1.26 -4.74 117.00 125.69 1d8b n LEU 12 Ca 0.00 -4.91 -0.13 0.00 -0.03 0.00 0.00 56.01 50.94 1d8b n LEU 12 Cb 0.00 -1.37 0.05 0.00 -2.33 0.00 0.00 43.42 39.77 1d8b n LEU 12 CO 0.00 1.81 1.09 -3.20 -1.33 0.00 0.00 177.39 175.76 1d8b n ASN 13 N 2.14 5.47 0.09 -1.43 5.15 -1.26 -4.45 115.26 120.97 1d8b n ASN 13 Ca 0.50 -2.90 -0.06 0.00 -0.60 0.00 0.00 54.58 51.51 1d8b n ASN 13 Cb 0.29 -0.94 -0.03 0.00 -0.53 0.00 0.00 39.78 38.57 1d8b n ASN 13 CO 0.00 0.00 0.00 -1.13 1.40 0.00 0.00 177.26 177.53 1d8b h ASN 14 N 1.13 -0.28 -0.47 1.20 -0.73 -1.93 -2.49 115.58 112.01 1d8b h ASN 14 Ca 0.26 -0.05 -0.04 0.00 1.87 0.00 0.00 56.30 58.35 1d8b h ASN 14 Cb 1.18 0.07 -0.03 0.00 0.27 0.00 0.00 38.32 39.81 1d8b h ASN 14 CO 0.62 0.20 0.17 0.25 -0.37 0.00 0.00 177.43 178.30 1d8b h LEU 15 N -1.07 0.71 -0.87 0.34 6.46 -1.90 0.61 115.31 119.59 1d8b h LEU 15 Ca -0.03 -0.10 -0.06 0.00 -0.12 0.00 0.00 57.88 57.56 1d8b h LEU 15 Cb 0.31 -0.18 -0.03 0.00 -0.73 0.00 0.00 40.66 40.03 1d8b h LEU 15 CO 0.06 0.67 0.13 -0.09 -0.62 0.00 0.00 178.44 178.59 1d8b h ARG 16 N 0.76 0.97 -0.10 1.25 2.43 -1.86 -1.02 114.38 116.82 1d8b h ARG 16 Ca 0.18 -0.22 -0.13 0.00 -0.81 0.00 0.00 59.98 58.99 1d8b h ARG 16 Cb 0.21 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 29.62 1d8b h ARG 16 CO -0.01 0.88 -0.53 1.98 -1.51 0.00 0.00 179.97 180.78 1d8b h MET 17 N 0.93 0.28 0.01 0.20 4.05 -0.89 -1.10 114.93 118.41 1d8b h MET 17 Ca 0.20 -0.17 -0.00 0.00 -0.28 0.00 0.00 59.70 59.45 1d8b h MET 17 Cb 0.35 0.02 0.00 0.00 -0.80 0.00 0.00 31.60 31.17 1d8b h MET 17 CO 0.00 0.74 -0.01 1.15 0.23 0.00 0.00 176.91 179.02 1d8b h THR 18 N 0.22 1.13 -0.50 -0.77 2.02 -0.18 0.36 112.91 115.18 1d8b h THR 18 Ca 0.01 -0.42 -0.06 0.00 0.77 0.00 0.00 66.41 66.71 1d8b h THR 18 Cb 1.00 1.41 -0.02 0.00 -1.74 0.00 0.00 68.15 68.80 1d8b h THR 18 CO 0.08 0.11 0.09 0.22 0.37 0.00 0.00 175.52 176.39 1d8b h TYR 19 N -0.20 0.88 -0.33 3.16 3.20 -1.17 -1.77 116.97 120.75 1d8b h TYR 19 Ca -0.00 -0.12 -0.13 0.00 3.14 0.00 0.00 58.73 61.62 1d8b h TYR 19 Cb 0.19 -0.24 -0.01 0.00 1.54 0.00 0.00 36.73 38.21 1d8b h TYR 19 CO -0.01 0.80 -0.31 0.93 -1.64 0.00 0.00 178.16 177.92 1d8b h GLU 20 N 0.71 0.70 -0.27 1.82 5.08 -1.09 -0.73 114.58 120.79 1d8b h GLU 20 Ca 0.15 -0.32 -0.09 0.00 -1.00 0.00 0.00 59.36 58.11 1d8b h GLU 20 Cb 0.39 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.61 1d8b h GLU 20 CO 0.01 0.92 -0.20 -0.09 -1.00 0.00 0.00 179.01 178.65 1d8b h ARG 21 N 0.59 0.50 -0.35 2.33 2.43 -0.16 -1.07 114.38 118.65 1d8b h ARG 21 Ca 0.07 -0.17 -0.14 0.00 -0.81 0.00 0.00 59.98 58.92 1d8b h ARG 21 Cb 0.83 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 30.33 1d8b h ARG 21 CO 0.07 0.67 -0.36 -0.07 -1.51 0.00 0.00 179.97 178.77 1d8b h LEU 22 N 0.45 0.84 -0.28 3.80 3.38 -1.03 -0.76 115.31 121.71 1d8b h LEU 22 Ca 0.07 -0.37 -0.03 0.00 0.09 0.00 0.00 57.88 57.64 1d8b h LEU 22 Cb 0.60 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.10 1d8b h LEU 22 CO 0.04 1.11 0.04 -0.09 0.09 0.00 0.00 178.44 179.64 1d8b h ARG 23 N 0.66 0.46 -0.24 1.13 2.43 -0.64 0.18 114.38 118.38 1d8b h ARG 23 Ca 0.06 -0.13 -0.11 0.00 -0.81 0.00 0.00 59.98 58.99 1d8b h ARG 23 Cb 0.91 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.40 1d8b h ARG 23 CO 0.08 0.58 -0.33 1.49 -1.51 0.00 0.00 179.97 180.28 1d8b h GLU 24 N 0.28 0.50 -0.19 0.20 4.22 -1.17 -2.64 114.58 115.77 1d8b h GLU 24 Ca 0.08 -0.22 -0.14 0.00 0.08 0.00 0.00 59.36 59.17 1d8b h GLU 24 Cb 0.34 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.57 1d8b h GLU 24 CO 0.01 0.77 -0.47 1.25 -2.18 0.00 0.00 179.01 178.39 1d8b h LEU 25 N 0.43 0.54 -1.11 1.64 6.46 -0.89 -0.13 115.31 122.25 1d8b h LEU 25 Ca 0.05 -0.26 -0.05 0.00 -0.12 0.00 0.00 57.88 57.51 1d8b h LEU 25 Cb 0.78 -0.15 -0.02 0.00 -0.73 0.00 0.00 40.66 40.53 1d8b h LEU 25 CO 0.06 0.93 0.12 0.28 -0.62 0.00 0.00 178.44 179.21 1d8b h SER 26 N 0.40 0.69 0.63 1.25 0.02 -0.36 0.31 113.55 116.50 1d8b h SER 26 Ca 0.02 -0.12 -0.24 0.00 -0.84 0.00 0.00 61.79 60.62 1d8b h SER 26 Cb 0.97 -0.18 -0.00 0.00 0.14 0.00 0.00 62.40 63.33 1d8b h SER 26 CO 0.09 0.69 -1.08 -0.07 -1.14 0.00 0.00 176.83 175.32 1d8b h LEU 27 N 0.72 0.34 0.37 5.07 4.07 -1.26 -1.22 115.31 123.41 1d8b h LEU 27 Ca 0.16 -0.33 -0.02 0.00 0.08 0.00 0.00 57.88 57.78 1d8b h LEU 27 Cb 0.27 -0.11 0.00 0.00 1.08 0.00 0.00 40.66 41.91 1d8b h LEU 27 CO -0.00 1.20 -0.18 -1.13 -1.08 0.00 0.00 178.44 177.25 1d8b h ASN 28 N 0.09 -0.42 -0.72 -0.43 -0.73 -0.56 -1.53 115.58 111.28 1d8b h ASN 28 Ca -0.09 -0.08 -0.05 0.00 1.87 0.00 0.00 56.30 57.96 1d8b h ASN 28 Cb 1.77 0.11 -0.03 0.00 0.27 0.00 0.00 38.32 40.44 1d8b h ASN 28 CO 0.17 0.02 0.26 -0.07 -0.37 0.00 0.00 177.43 177.45 1d8b h LEU 29 N -1.07 1.03 0.16 0.34 3.38 -0.53 -1.11 115.31 117.51 1d8b h LEU 29 Ca -0.05 -0.17 -0.00 0.00 0.09 0.00 0.00 57.88 57.75 1d8b h LEU 29 Cb 0.47 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.95 1d8b h LEU 29 CO 0.08 0.93 -0.11 1.23 0.09 0.00 0.00 178.44 180.66 1d8b h GLY 30 N 1.11 -0.27 2.00 0.83 0.00 -1.29 -1.59 103.07 103.86 1d8b h GLY 30 Ca 0.24 0.13 0.00 0.00 0.00 0.00 0.00 47.33 47.70 1d8b h GLY 30 CO -0.01 -0.12 0.00 -2.01 0.00 0.00 0.00 176.54 174.40 1d8b n ASN 31 N -5.23 0.60 -0.21 0.19 2.85 -0.57 0.15 115.26 113.04 1d8b n ASN 31 Ca -0.08 0.63 0.13 0.00 -0.11 0.00 0.00 54.58 55.15 1d8b n ASN 31 Cb 0.15 -0.76 0.46 0.00 1.24 0.00 0.00 39.78 40.87 1d8b n ASN 31 CO 0.00 0.00 0.00 -1.14 -2.11 0.00 0.00 177.26 174.01 1d8b n ARG 32 N -2.14 0.81 -3.20 1.20 0.63 -0.43 -4.72 116.66 108.81 1d8b n ARG 32 Ca 0.03 -0.42 -0.21 0.00 -0.92 0.00 0.00 57.85 56.33 1d8b n ARG 32 Cb 0.25 -1.49 0.01 0.00 0.45 0.00 0.00 32.46 31.68 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 -2.48 3.06 -0.16 -0.14 1.75 -0.72 -5.03 119.30 115.58 1d8b s MET 33 Ca 0.26 -0.76 -0.02 0.00 -1.25 0.00 0.00 55.69 53.92 1d8b s MET 33 Cb 0.20 -2.68 0.05 0.00 2.84 0.00 0.00 34.83 35.23 1d8b s MET 33 CO 0.50 -0.14 0.02 0.08 -0.65 0.00 0.00 175.02 174.83 1d8b s VAL 34 N -2.38 0.58 0.62 10.11 1.01 -1.26 -1.92 120.40 127.15 1d8b s VAL 34 Ca 0.47 -0.42 -0.15 0.00 0.00 0.00 0.00 61.98 61.88 1d8b s VAL 34 Cb -0.10 -0.96 -0.03 0.00 0.00 0.00 0.00 36.38 35.29 1d8b s VAL 34 CO 0.35 -0.06 1.06 -2.16 0.00 0.00 0.00 175.10 174.28 1d8b s PRO 35 N 1.85 3.21 0.19 2.72 0.04 -1.26 -5.08 135.00 136.67 1d8b s PRO 35 Ca 0.01 1.16 -0.32 0.00 0.04 0.00 0.00 61.00 61.88 1d8b s PRO 35 Cb -0.16 -2.02 -0.12 0.00 0.04 0.00 0.00 34.50 32.24 1d8b s PRO 35 CO -0.07 -0.89 1.71 -0.35 0.04 0.00 0.00 177.00 177.44 1d8b n PRO 36 N -2.28 2.68 -3.04 0.56 -0.04 -0.81 -4.95 135.00 127.12 1d8b n PRO 36 Ca 0.09 0.97 -0.41 0.00 -0.04 0.00 0.00 63.50 64.10 1d8b n PRO 36 Cb 0.53 -2.81 -0.06 0.00 -0.04 0.00 0.00 33.50 31.13 1d8b n PRO 36 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1d8b s VAL 37 N 1.26 4.94 -0.07 0.52 1.01 0.12 -4.87 120.40 123.32 1d8b s VAL 37 Ca 0.76 1.27 0.13 0.00 0.00 0.00 0.00 61.98 64.15 1d8b s VAL 37 Cb -0.53 -3.99 -0.09 0.00 0.00 0.00 0.00 36.38 31.77 1d8b s VAL 37 CO 0.34 0.01 1.17 1.23 0.00 0.00 0.00 175.10 177.84 1d8b h GLY 38 N 8.90 0.00 -5.70 4.51 0.00 -1.91 -3.36 103.07 105.51 1d8b h GLY 38 Ca -0.26 0.00 -0.60 0.00 0.00 0.00 0.00 47.33 46.47 1d8b h GLY 38 CO 0.80 0.00 -0.61 -2.01 0.00 0.00 0.00 176.54 174.73 1d8b n ASN 39 N -3.15 4.20 -0.01 0.19 5.15 -1.26 -4.90 115.26 115.47 1d8b n ASN 39 Ca -0.03 -3.58 -0.10 0.00 -0.60 0.00 0.00 54.58 50.27 1d8b n ASN 39 Cb 0.85 -0.61 -0.04 0.00 -0.53 0.00 0.00 39.78 39.44 1d8b n ASN 39 CO 0.00 0.00 0.00 0.15 1.40 0.00 0.00 177.26 178.81 1d8b h PHE 40 N 3.52 -0.07 -3.35 1.20 3.57 -1.78 -3.42 116.94 116.61 1d8b h PHE 40 Ca 0.16 0.01 -0.29 0.00 3.53 0.00 0.00 57.97 61.38 1d8b h PHE 40 Cb 0.57 0.05 -0.34 0.00 2.79 0.00 0.00 35.95 39.02 1d8b h PHE 40 CO 0.79 -0.06 -0.68 1.41 -2.23 0.00 0.00 178.31 177.55 1d8b s MET 41 N -6.20 0.01 0.40 1.11 1.75 -1.26 -5.04 119.30 110.07 1d8b s MET 41 Ca -0.13 0.32 -0.26 0.00 -1.25 0.00 0.00 55.69 54.36 1d8b s MET 41 Cb 0.09 -0.27 -0.10 0.00 2.84 0.00 0.00 34.83 37.39 1d8b s MET 41 CO 0.68 -0.21 1.30 -2.30 -0.65 0.00 0.00 175.02 173.84 1d8b n PRO 42 N 4.49 2.05 -0.34 4.11 -0.02 -1.26 -4.72 135.00 139.30 1d8b n PRO 42 Ca -0.21 0.73 0.16 0.00 -2.02 0.00 0.00 63.50 62.15 1d8b n PRO 42 Cb 0.50 -2.41 0.37 0.00 -0.02 0.00 0.00 33.50 31.95 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 2.27 0.70 -0.21 2.55 1.82 -1.99 0.21 116.42 121.77 1d8b h ASP 43 Ca -0.48 0.11 -0.03 0.00 -0.39 0.00 0.00 57.03 56.24 1d8b h ASP 43 Cb 1.29 -0.01 -0.01 0.00 0.68 0.00 0.00 39.33 41.27 1d8b h ASP 43 CO 0.61 0.20 0.03 0.77 -1.61 0.00 0.00 179.24 179.24 1d8b h SER 44 N 0.66 0.34 -0.12 2.28 4.64 -2.00 -2.33 113.55 117.02 1d8b h SER 44 Ca 0.60 -0.27 -0.10 0.00 -0.47 0.00 0.00 61.79 61.55 1d8b h SER 44 Cb 1.07 -0.09 -0.01 0.00 -0.31 0.00 0.00 62.40 63.06 1d8b h SER 44 CO -0.39 0.52 -0.25 0.40 -0.87 0.00 0.00 176.83 176.23 1d8b h ILE 45 N 0.14 1.27 -0.39 0.95 1.08 -1.45 -2.13 117.51 116.98 1d8b h ILE 45 Ca 0.06 -1.31 -0.02 0.00 -0.39 0.00 0.00 64.86 63.21 1d8b h ILE 45 Cb 0.33 1.32 -0.02 0.00 -3.07 0.00 0.00 36.82 35.38 1d8b h ILE 45 CO 0.01 0.42 0.15 -0.07 -0.69 0.00 0.00 178.15 177.97 1d8b h LEU 46 N 0.50 0.50 -0.02 1.44 3.38 -0.54 0.23 115.31 120.80 1d8b h LEU 46 Ca 0.07 -0.05 -0.03 0.00 0.09 0.00 0.00 57.88 57.96 1d8b h LEU 46 Cb 0.70 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.32 1d8b h LEU 46 CO 0.05 0.46 -0.10 0.11 0.09 0.00 0.00 178.44 179.06 1d8b h LYS 47 N 0.56 0.10 -0.49 1.13 1.57 -0.97 -1.66 116.57 116.80 1d8b h LYS 47 Ca 0.14 -0.08 -0.09 0.00 -1.87 0.00 0.00 60.65 58.74 1d8b h LYS 47 Cb 0.13 0.02 -0.02 0.00 0.08 0.00 0.00 32.23 32.43 1d8b h LYS 47 CO -0.01 0.76 -0.07 1.57 -0.57 0.00 0.00 179.45 181.13 1d8b h LYS 48 N -0.54 0.87 0.00 3.15 2.10 -1.26 -1.30 116.57 119.59 1d8b h LYS 48 Ca -0.01 -0.28 -0.11 0.00 -2.00 0.00 0.00 60.65 58.26 1d8b h LYS 48 Cb 0.78 -0.08 -0.02 0.00 -0.90 0.00 0.00 32.23 32.02 1d8b h LYS 48 CO 0.02 0.91 -0.50 0.00 -2.00 0.00 0.00 179.45 177.88 1d8b h MET 49 N 0.79 0.00 0.00 0.07 -0.00 -1.03 -1.51 114.93 113.25 1d8b h MET 49 Ca 0.14 0.00 -0.17 0.00 -0.00 0.00 0.00 59.70 59.67 1d8b h MET 49 Cb 0.57 0.00 -0.02 0.00 -0.00 0.00 0.00 31.60 32.14 1d8b h MET 49 CO 0.03 0.50 -0.81 0.00 -0.00 0.00 0.00 176.91 176.64 1d8b h ALA 50 N 1.50 0.56 0.12 -3.00 0.00 -0.88 0.18 119.26 117.73 1d8b h ALA 50 Ca -0.01 -0.74 -0.30 0.00 0.00 0.00 0.00 54.91 53.87 1d8b h ALA 50 Cb 0.94 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 18.60 1d8b h ALA 50 CO 0.07 1.01 -1.48 0.00 0.00 0.00 0.00 179.25 178.85 1d8b h ALA 51 N 1.19 0.24 0.01 0.00 0.00 -1.07 -3.39 119.26 116.23 1d8b h ALA 51 Ca -0.01 -1.07 -0.37 0.00 0.00 0.00 0.00 54.91 53.46 1d8b h ALA 51 Cb 1.53 0.23 -0.07 0.00 0.00 0.00 0.00 17.79 19.49 1d8b h ALA 51 CO 0.11 1.11 -2.35 -0.89 0.00 0.00 0.00 179.25 177.23 1d8b n ILE 52 N -3.47 1.46 -3.23 0.00 -0.00 -0.59 -5.05 119.36 108.49 1d8b n ILE 52 Ca -0.15 -0.74 -0.08 0.00 -0.00 0.00 0.00 62.75 61.77 1d8b n ILE 52 Cb 1.04 -0.91 0.00 0.00 -0.00 0.00 0.00 39.64 39.77 1d8b n ILE 52 CO 0.00 0.00 0.00 0.18 -0.00 0.00 0.00 176.55 176.73 1d8b n LEU 53 N -2.99 -5.57 -4.61 1.39 4.77 0.63 -4.90 117.00 105.72 1d8b n LEU 53 Ca -0.36 -0.22 -0.43 0.00 -0.03 0.00 0.00 56.01 54.97 1d8b n LEU 53 Cb 1.09 -2.85 -0.02 0.00 -2.33 0.00 0.00 43.42 39.30 1d8b n LEU 53 CO 0.37 -0.85 1.09 -2.84 -1.33 0.00 0.00 177.39 173.83 1d8b s PRO 54 N -3.40 3.72 0.21 3.23 0.02 -1.26 -4.89 135.00 132.63 1d8b s PRO 54 Ca 0.04 0.76 0.11 0.00 0.02 0.00 0.00 61.00 61.94 1d8b s PRO 54 Cb -0.01 -3.93 -0.05 0.00 0.02 0.00 0.00 34.50 30.53 1d8b s PRO 54 CO 0.79 -1.38 1.37 0.52 -0.33 0.00 0.00 177.00 177.98 1d8b h MET 55 N 9.56 0.00 -5.37 5.54 2.86 -1.92 -3.46 114.93 122.15 1d8b h MET 55 Ca -0.24 0.00 -0.48 0.00 -2.06 0.00 0.00 59.70 56.92 1d8b h MET 55 Cb 1.08 0.00 -0.14 0.00 0.06 0.00 0.00 31.60 32.60 1d8b h MET 55 CO 1.10 0.73 -0.65 1.21 1.06 0.00 0.00 176.91 180.36 1d8b s ASN 56 N -6.58 2.57 0.53 1.22 3.84 -1.26 -5.03 114.94 110.23 1d8b s ASN 56 Ca 0.03 -1.26 0.28 0.00 0.21 0.00 0.00 52.86 52.12 1d8b s ASN 56 Cb 0.09 -0.13 1.50 0.00 -0.55 0.00 0.00 41.25 42.16 1d8b s ASN 56 CO 0.78 -0.45 2.09 -0.78 -2.79 0.00 0.00 177.10 175.94 1d8b h ASP 57 N 2.23 0.00 -0.65 -4.21 3.58 -1.98 -2.00 116.42 113.39 1d8b h ASP 57 Ca -0.40 0.00 -0.01 0.00 0.42 0.00 0.00 57.03 57.04 1d8b h ASP 57 Cb 1.24 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 42.25 1d8b h ASP 57 CO 0.68 0.10 0.39 0.28 -2.88 0.00 0.00 179.24 177.81 1d8b h SER 58 N 0.00 0.80 1.03 2.28 0.02 -1.98 -1.32 113.55 114.37 1d8b h SER 58 Ca -0.00 -0.05 -0.19 0.00 -0.84 0.00 0.00 61.79 60.71 1d8b h SER 58 Cb 0.31 -0.20 -0.03 0.00 0.14 0.00 0.00 62.40 62.62 1d8b h SER 58 CO 0.01 0.63 -1.01 0.00 -1.14 0.00 0.00 176.83 175.32 1d8b h ALA 59 N 1.51 0.50 0.00 3.77 0.00 -1.77 -3.18 119.26 120.10 1d8b h ALA 59 Ca 0.24 -0.88 -0.01 0.00 0.00 0.00 0.00 54.91 54.26 1d8b h ALA 59 Cb -0.02 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.75 1d8b h ALA 59 CO -0.04 1.13 -0.05 0.74 0.00 0.00 0.00 179.25 181.02 1d8b h PHE 60 N 0.00 0.00 -0.02 0.00 0.04 -0.70 -1.40 116.94 114.85 1d8b h PHE 60 Ca -0.06 0.00 0.01 0.00 2.80 0.00 0.00 57.97 60.72 1d8b h PHE 60 Cb 1.70 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.85 1d8b h PHE 60 CO 0.00 0.05 0.03 0.00 -0.60 0.00 0.00 178.31 177.79 1d8b h ALA 61 N 1.95 1.53 -0.44 2.45 0.00 -1.30 0.43 119.26 123.87 1d8b h ALA 61 Ca -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1d8b h ALA 61 Cb 0.15 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1d8b h ALA 61 CO 0.01 -0.04 0.00 0.25 0.00 0.00 0.00 179.25 179.47 1d8b n THR 62 N -3.78 0.59 0.36 0.00 -2.24 -0.53 -4.04 114.28 104.64 1d8b n THR 62 Ca -0.02 -0.64 0.04 0.00 -2.27 0.00 0.00 64.05 61.16 1d8b n THR 62 Cb 0.11 0.42 0.17 0.00 -2.10 0.00 0.00 70.33 68.93 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 0.94 2.76 0.00 3.22 4.77 0.14 -4.98 117.00 123.85 1d8b n LEU 63 Ca 0.17 -1.39 0.00 0.00 -0.03 0.00 0.00 56.01 54.76 1d8b n LEU 63 Cb 0.43 -0.50 0.00 0.00 -2.33 0.00 0.00 43.42 41.03 1d8b n LEU 63 CO 0.12 0.42 0.00 0.61 -1.33 0.00 0.00 177.39 177.21 1d8b n GLY 64 N 0.45 1.22 2.47 -0.72 0.00 -1.26 -4.51 105.19 102.85 1d8b n GLY 64 Ca 0.12 -0.65 -0.19 0.00 0.00 0.00 0.00 46.02 45.31 1d8b n GLY 64 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 1d8b n THR 65 N 0.00 -0.67 -2.73 2.61 -1.04 -1.26 -4.96 114.28 106.23 1d8b n THR 65 Ca 0.00 -2.76 -0.42 0.00 -2.04 0.00 0.00 64.05 58.83 1d8b n THR 65 Cb 0.00 -0.72 -0.03 0.00 -1.82 0.00 0.00 70.33 67.76 1d8b n THR 65 CO 0.00 0.00 0.00 0.68 -0.64 0.00 0.00 175.07 175.11 1d8b s VAL 66 N 0.04 4.84 0.76 12.58 -7.23 -1.26 -5.03 120.40 125.10 1d8b s VAL 66 Ca 0.33 2.00 -0.11 0.00 -1.81 0.00 0.00 61.98 62.38 1d8b s VAL 66 Cb 0.09 -4.29 0.05 0.00 0.56 0.00 0.00 36.38 32.78 1d8b s VAL 66 CO -0.15 0.08 1.08 -1.61 -0.31 0.00 0.00 175.10 174.19 1d8b s GLU 67 N 1.56 2.37 0.42 4.82 2.02 -1.26 -4.85 118.70 123.77 1d8b s GLU 67 Ca 0.49 0.86 0.10 0.00 0.02 0.00 0.00 54.97 56.43 1d8b s GLU 67 Cb -0.19 -1.93 0.92 0.00 0.10 0.00 0.00 34.13 33.03 1d8b s GLU 67 CO 0.22 -1.48 2.02 0.22 0.02 0.00 0.00 175.26 176.26 1d8b h ASP 68 N -0.99 0.44 0.19 -0.19 3.58 -1.99 0.11 116.42 117.58 1d8b h ASP 68 Ca -0.45 -0.00 -0.03 0.00 0.42 0.00 0.00 57.03 56.96 1d8b h ASP 68 Cb 1.24 -0.10 -0.00 0.00 1.72 0.00 0.00 39.33 42.19 1d8b h ASP 68 CO 0.57 0.30 -0.14 0.07 -2.88 0.00 0.00 179.24 177.15 1d8b h LYS 69 N 0.51 0.00 0.06 0.28 2.10 -2.00 0.58 116.57 118.10 1d8b h LYS 69 Ca 0.22 0.00 -0.23 0.00 -2.00 0.00 0.00 60.65 58.63 1d8b h LYS 69 Cb 0.21 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.54 1d8b h LYS 69 CO -0.06 0.14 -1.06 1.88 -2.00 0.00 0.00 179.45 178.36 1d8b h TYR 70 N 0.00 0.35 -0.08 0.07 0.05 -1.16 -3.12 116.97 113.09 1d8b h TYR 70 Ca -0.00 -0.23 -0.10 0.00 0.05 0.00 0.00 58.73 58.45 1d8b h TYR 70 Cb 0.28 -0.02 -0.01 0.00 1.01 0.00 0.00 36.73 37.98 1d8b h TYR 70 CO 0.00 1.12 -0.40 0.00 -1.05 0.00 0.00 178.16 177.84 1d8b h ARG 71 N 0.08 0.16 0.12 4.88 3.08 -0.32 -1.93 114.38 120.46 1d8b h ARG 71 Ca -0.08 -0.07 0.00 0.00 0.07 0.00 0.00 59.98 59.90 1d8b h ARG 71 Cb 1.76 -0.00 -0.03 0.00 0.08 0.00 0.00 29.97 31.78 1d8b h ARG 71 CO 0.17 0.54 -0.33 0.00 -1.07 0.00 0.00 179.97 179.27 1d8b h ARG 72 N 0.14 -0.48 -0.00 0.04 2.47 -0.86 -1.77 114.38 113.91 1d8b h ARG 72 Ca 0.01 0.03 0.00 0.00 -1.26 0.00 0.00 59.98 58.77 1d8b h ARG 72 Cb 0.76 0.11 0.00 0.00 -1.65 0.00 0.00 29.97 29.19 1d8b h ARG 72 CO 0.06 -0.32 -0.01 2.89 0.56 0.00 0.00 179.97 183.15 1d8b n ARG 73 N -4.31 0.72 -0.12 0.04 0.00 -1.23 -3.53 116.66 108.23 1d8b n ARG 73 Ca -0.06 -0.06 0.02 0.00 -0.00 0.00 0.00 57.85 57.76 1d8b n ARG 73 Cb 0.26 -1.50 0.32 0.00 -0.00 0.00 0.00 32.46 31.54 1d8b n ARG 73 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.63 177.98 1d8b h PHE 74 N 0.14 0.76 0.00 2.89 3.04 -0.48 -0.90 116.94 122.39 1d8b h PHE 74 Ca 0.00 0.01 -0.01 0.00 3.98 0.00 0.00 57.97 61.96 1d8b h PHE 74 Cb 0.19 -0.25 -0.00 0.00 2.56 0.00 0.00 35.95 38.44 1d8b h PHE 74 CO 0.00 0.49 -0.03 1.57 -2.02 0.00 0.00 178.31 178.32 1d8b h LYS 75 N 0.81 0.00 0.00 1.11 2.10 -1.59 -0.05 116.57 118.94 1d8b h LYS 75 Ca 0.22 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.87 1d8b h LYS 75 Cb -0.07 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.26 1d8b h LYS 75 CO -0.04 0.03 0.00 0.66 -2.00 0.00 0.00 179.45 178.09 1d8b n TYR 76 N -3.77 0.00 0.51 0.07 4.01 -0.34 -2.69 117.16 114.95 1d8b n TYR 76 Ca -0.03 0.00 0.08 0.00 -0.16 0.00 0.00 57.90 57.80 1d8b n TYR 76 Cb 0.12 -0.43 -0.11 0.00 -0.31 0.00 0.00 39.34 38.61 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 -1.43 0.00 -0.18 -0.72 3.72 -0.06 -4.50 117.46 114.29 1d8b n PHE 77 Ca 0.09 0.00 0.17 0.00 -0.05 0.00 0.00 57.45 57.65 1d8b n PHE 77 Cb 0.28 -0.15 0.52 0.00 -0.94 0.00 0.00 39.48 39.19 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 0.38 -0.20 -1.08 1.79 -1.27 0.15 116.57 116.34 1d8b h LYS 78 Ca 0.00 -0.02 -0.06 0.00 -2.18 0.00 0.00 60.65 58.39 1d8b h LYS 78 Cb 0.56 -0.08 -0.01 0.00 -1.58 0.00 0.00 32.23 31.11 1d8b h LYS 78 CO 0.00 0.25 -0.15 0.00 -1.08 0.00 0.00 179.45 178.47 1d8b h ALA 79 N 1.64 1.39 0.13 3.86 0.00 -1.79 -1.02 119.26 123.46 1d8b h ALA 79 Ca 0.39 -0.24 -0.28 0.00 0.00 0.00 0.00 54.91 54.77 1d8b h ALA 79 Cb 0.95 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.64 1d8b h ALA 79 CO -0.12 0.42 -1.42 1.15 0.00 0.00 0.00 179.25 179.27 1d8b h THR 80 N 0.30 1.06 -0.30 0.00 2.02 -1.26 -2.97 112.91 111.76 1d8b h THR 80 Ca 0.06 -2.44 0.02 0.00 0.77 0.00 0.00 66.41 64.82 1d8b h THR 80 Cb 0.45 2.77 -0.02 0.00 -1.74 0.00 0.00 68.15 69.61 1d8b h THR 80 CO 0.03 0.73 0.17 0.40 0.37 0.00 0.00 175.52 177.22 1d8b h ILE 81 N -0.23 1.02 -0.37 3.11 2.04 -0.73 0.18 117.51 122.53 1d8b h ILE 81 Ca -0.30 -0.12 -0.04 0.00 1.00 0.00 0.00 64.86 65.41 1d8b h ILE 81 Cb 1.82 0.64 -0.02 0.00 -0.74 0.00 0.00 36.82 38.52 1d8b h ILE 81 CO 0.09 0.06 0.09 0.00 0.00 0.00 0.00 178.15 178.40 1d8b h ALA 82 N 1.14 0.49 0.54 1.87 0.00 -1.34 0.02 119.26 121.98 1d8b h ALA 82 Ca 0.12 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 54.82 1d8b h ALA 82 Cb 0.01 -0.14 0.01 0.00 0.00 0.00 0.00 17.79 17.67 1d8b h ALA 82 CO -0.07 0.16 -0.26 0.22 0.00 0.00 0.00 179.25 179.30 1d8b h ASP 83 N 0.45 -0.62 0.20 0.00 3.58 -1.31 -1.45 116.42 117.27 1d8b h ASP 83 Ca 0.12 0.00 -0.03 0.00 0.42 0.00 0.00 57.03 57.54 1d8b h ASP 83 Cb 0.30 0.16 -0.00 0.00 1.72 0.00 0.00 39.33 41.51 1d8b h ASP 83 CO 0.00 -0.41 -0.13 -0.07 -2.88 0.00 0.00 179.24 175.75 1d8b h LEU 84 N -0.77 0.00 -1.00 2.28 3.38 -0.66 -0.52 115.31 118.02 1d8b h LEU 84 Ca -0.07 0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.81 1d8b h LEU 84 Cb 0.58 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.32 1d8b h LEU 84 CO 0.12 0.13 -0.38 -1.28 0.09 0.00 0.00 178.44 177.12 1d8b h SER 85 N 0.00 0.00 0.34 -0.43 0.87 -0.64 0.16 113.55 113.85 1d8b h SER 85 Ca -0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1d8b h SER 85 Cb 0.26 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.22 1d8b h SER 85 CO 0.02 0.38 -0.14 1.17 -0.53 0.00 0.00 176.83 177.73 1d8b n LYS 86 N -3.61 0.71 -0.08 2.24 3.00 -0.24 -3.70 118.16 116.48 1d8b n LYS 86 Ca -0.01 -0.29 -0.09 0.00 -0.00 0.00 0.00 58.31 57.93 1d8b n LYS 86 Cb 0.50 -1.49 -0.10 0.00 0.00 0.00 0.00 35.03 33.93 1d8b n LYS 86 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 1d8b n LYS 87 N -0.89 1.24 0.00 1.64 5.02 -0.76 -4.46 118.16 119.94 1d8b n LYS 87 Ca 0.14 0.04 0.08 0.00 -2.02 0.00 0.00 58.31 56.54 1d8b n LYS 87 Cb 0.29 -1.36 0.45 0.00 -0.02 0.00 0.00 35.03 34.39 1d8b n LYS 87 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 1d8b n ARG 88 N -2.71 0.43 -0.11 1.97 0.63 0.48 -3.05 116.66 114.31 1d8b n ARG 88 Ca -0.26 0.03 -0.01 0.00 -0.92 0.00 0.00 57.85 56.68 1d8b n ARG 88 Cb 0.91 -1.50 0.24 0.00 0.45 0.00 0.00 32.46 32.55 1d8b n ARG 88 CO 0.00 0.00 0.00 0.77 -2.51 0.00 0.00 177.63 175.89 1d8b h SER 89 N 0.00 0.71 0.00 6.15 0.02 -1.78 -3.44 113.55 115.20 1d8b h SER 89 Ca 0.00 -0.10 0.00 0.00 -0.84 0.00 0.00 61.79 60.85 1d8b h SER 89 Cb 0.03 -0.18 0.00 0.00 0.14 0.00 0.00 62.40 62.39 1d8b h SER 89 CO 0.00 0.67 0.00 -1.54 -1.14 0.00 0.00 176.83 174.82 1d8b n SER 90 N -4.31 0.00 0.00 3.07 3.41 -1.17 -5.19 113.62 109.42 1d8b n SER 90 Ca 0.04 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.65 1d8b n SER 90 Cb 0.19 0.07 0.00 0.00 -0.26 0.00 0.00 64.21 64.21 1d8b n SER 90 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04