#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2osq n LEU 8 N 0.00 -1.46 -4.80 -4.62 -0.00 -1.26 -4.80 117.00 100.06 2osq n LEU 8 Ca 0.00 -0.43 -0.25 0.00 -0.00 0.00 0.00 56.01 55.33 2osq n LEU 8 Cb 0.00 -1.08 -0.05 0.00 -0.00 0.00 0.00 43.42 42.29 2osq n LEU 8 CO 0.00 -3.72 -0.09 -0.44 -0.00 0.00 0.00 177.39 173.14 2osq s SER 9 N -2.48 4.55 -0.15 1.45 0.01 -1.25 -4.99 113.70 110.84 2osq s SER 9 Ca 0.64 -1.11 -0.26 0.00 1.31 0.00 0.00 55.95 56.52 2osq s SER 9 Cb -0.18 -0.21 -0.25 0.00 0.21 0.00 0.00 66.02 65.60 2osq s SER 9 CO 0.60 -0.72 0.63 -1.13 0.41 0.00 0.00 173.24 173.04 2osq h ASN 10 N 1.20 0.04 -3.14 2.44 -1.24 -1.96 -3.44 115.58 109.48 2osq h ASN 10 Ca -0.41 -0.87 -0.59 0.00 0.71 0.00 0.00 56.30 55.13 2osq h ASN 10 Cb 1.27 -0.01 -0.40 0.00 0.73 0.00 0.00 38.32 39.91 2osq h ASN 10 CO 0.65 1.16 -0.78 0.42 -1.29 0.00 0.00 177.43 177.60 2osq s THR 11 N -2.27 0.87 0.00 -3.57 -4.23 -1.26 -4.36 115.64 100.81 2osq s THR 11 Ca -0.21 -2.07 0.00 0.00 -1.18 0.00 0.00 61.69 58.23 2osq s THR 11 Cb -0.00 -1.62 0.00 0.00 1.34 0.00 0.00 72.50 72.21 2osq s THR 11 CO 0.68 -0.89 0.00 -1.14 -0.54 0.00 0.00 174.62 172.72 2osq n ARG 12 N 3.93 0.00 -4.61 3.99 3.00 -1.26 -4.41 116.66 117.30 2osq n ARG 12 Ca 0.08 0.00 -0.32 0.00 -0.00 0.00 0.00 57.85 57.61 2osq n ARG 12 Cb 0.36 0.00 -0.17 0.00 0.00 0.00 0.00 32.46 32.66 2osq n ARG 12 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.63 177.12 2osq s LEU 13 N 0.00 2.03 -0.23 6.15 1.43 0.10 -0.05 118.68 128.11 2osq s LEU 13 Ca 0.00 -0.57 -0.16 0.00 -1.03 0.00 0.00 54.13 52.37 2osq s LEU 13 Cb 0.00 -1.37 -0.04 0.00 0.03 0.00 0.00 46.19 44.81 2osq s LEU 13 CO 0.00 0.06 0.40 0.12 0.23 0.00 0.00 176.35 177.16 2osq s PHE 14 N 0.86 3.31 0.36 0.29 5.36 0.14 -0.61 117.98 127.70 2osq s PHE 14 Ca -0.07 0.54 0.07 0.00 -0.96 0.00 0.00 56.93 56.51 2osq s PHE 14 Cb -0.15 -2.56 -0.01 0.00 -0.34 0.00 0.00 43.02 39.95 2osq s PHE 14 CO -0.02 -0.12 0.43 0.08 -1.46 0.00 0.00 175.22 174.12 2osq s VAL 15 N 1.71 3.53 0.86 3.12 1.01 0.11 -1.51 120.40 129.24 2osq s VAL 15 Ca 0.18 -1.15 -0.12 0.00 0.00 0.00 0.00 61.98 60.89 2osq s VAL 15 Cb -0.15 -3.21 0.11 0.00 0.00 0.00 0.00 36.38 33.12 2osq s VAL 15 CO 0.09 -0.11 1.14 0.00 0.00 0.00 0.00 175.10 176.21 2osq s ARG 16 N -4.15 1.57 -0.02 2.72 1.70 -0.65 -2.06 118.95 118.06 2osq s ARG 16 Ca 0.46 0.32 -0.30 0.00 -0.47 0.00 0.00 55.73 55.74 2osq s ARG 16 Cb -0.08 -1.89 -0.05 0.00 -0.57 0.00 0.00 34.95 32.36 2osq s ARG 16 CO 0.30 -1.91 1.47 -1.25 -1.08 0.00 0.00 175.30 172.82 2osq s PRO 17 N -5.32 4.25 0.36 3.89 0.04 -1.26 -3.98 135.00 132.97 2osq s PRO 17 Ca 0.63 2.02 -0.01 0.00 0.04 0.00 0.00 61.00 63.68 2osq s PRO 17 Cb -0.14 -3.67 -0.04 0.00 0.04 0.00 0.00 34.50 30.69 2osq s PRO 17 CO 0.52 -0.66 0.59 -0.06 0.04 0.00 0.00 177.00 177.43 2osq s PHE 18 N 2.84 3.51 0.00 0.56 0.40 -1.26 -4.96 117.98 119.07 2osq s PHE 18 Ca 0.66 0.48 0.00 0.00 -0.60 0.00 0.00 56.93 57.47 2osq s PHE 18 Cb -0.32 -2.00 0.00 0.00 0.51 0.00 0.00 43.02 41.21 2osq s PHE 18 CO 0.27 0.07 0.00 -0.35 0.70 0.00 0.00 175.22 175.90 2osq n PRO 19 N -1.71 0.82 0.25 0.24 -0.04 -1.26 -4.51 135.00 128.79 2osq n PRO 19 Ca -0.03 0.00 0.16 0.00 -0.04 0.00 0.00 63.50 63.59 2osq n PRO 19 Cb 0.56 0.00 0.72 0.00 -0.04 0.00 0.00 33.50 34.74 2osq n PRO 19 CO 0.00 0.00 0.00 1.37 -0.04 0.00 0.00 175.50 176.83 2osq h LEU 20 N 0.00 0.00 -2.32 1.53 -0.00 -2.04 0.46 115.31 112.94 2osq h LEU 20 Ca 0.00 0.00 -0.08 0.00 -0.00 0.00 0.00 57.88 57.80 2osq h LEU 20 Cb 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 40.66 40.61 2osq h LEU 20 CO 0.00 0.00 0.10 0.47 -0.00 0.00 0.00 178.44 179.01 2osq n ASP 21 N -3.11 3.04 -4.56 0.17 8.00 -1.26 -4.81 116.55 114.02 2osq n ASP 21 Ca 0.02 -2.47 -0.39 0.00 0.71 0.00 0.00 54.79 52.65 2osq n ASP 21 Cb 0.53 -0.60 -0.03 0.00 -0.02 0.00 0.00 41.12 41.00 2osq n ASP 21 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2osq s VAL 22 N -1.54 3.85 0.32 2.53 0.11 0.16 -4.71 120.40 121.12 2osq s VAL 22 Ca 0.22 -0.61 -0.04 0.00 -2.93 0.00 0.00 61.98 58.63 2osq s VAL 22 Cb 0.17 -4.92 -0.00 0.00 -1.53 0.00 0.00 36.38 30.10 2osq s VAL 22 CO 0.05 -1.82 0.44 0.00 -3.33 0.00 0.00 175.10 170.45 2osq s GLN 23 N 5.29 1.80 0.51 1.54 -2.07 -1.26 -4.88 119.66 120.58 2osq s GLN 23 Ca 0.48 -1.68 0.29 0.00 -1.82 0.00 0.00 55.36 52.64 2osq s GLN 23 Cb -0.02 0.43 1.26 0.00 -1.09 0.00 0.00 33.01 33.60 2osq s GLN 23 CO -0.06 -0.73 1.96 1.05 -1.32 0.00 0.00 175.29 176.18 2osq h GLU 24 N 2.17 0.00 -0.41 9.60 4.11 -1.93 -3.02 114.58 125.10 2osq h GLU 24 Ca -0.28 0.00 0.04 0.00 0.07 0.00 0.00 59.36 59.19 2osq h GLU 24 Cb 1.24 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.45 2osq h GLU 24 CO 0.39 0.11 0.17 1.03 0.07 0.00 0.00 179.01 180.78 2osq h SER 25 N 0.00 0.22 -0.07 3.06 0.87 -1.96 0.35 113.55 116.02 2osq h SER 25 Ca -0.00 0.04 -0.24 0.00 -1.23 0.00 0.00 61.79 60.35 2osq h SER 25 Cb 0.55 0.00 0.02 0.00 -0.44 0.00 0.00 62.40 62.53 2osq h SER 25 CO 0.01 0.17 -0.89 1.05 -0.53 0.00 0.00 176.83 176.64 2osq h GLU 26 N 0.36 0.72 -0.32 2.24 4.11 -1.82 -0.96 114.58 118.92 2osq h GLU 26 Ca 0.19 -0.69 -0.03 0.00 0.07 0.00 0.00 59.36 58.89 2osq h GLU 26 Cb 0.14 0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.54 2osq h GLU 26 CO -0.16 1.28 0.05 -0.07 0.07 0.00 0.00 179.01 180.18 2osq h LEU 27 N 0.42 0.43 0.18 3.06 3.38 -1.36 0.20 115.31 121.61 2osq h LEU 27 Ca -0.09 -0.06 -0.26 0.00 0.09 0.00 0.00 57.88 57.56 2osq h LEU 27 Cb 1.54 -0.11 0.02 0.00 0.09 0.00 0.00 40.66 42.20 2osq h LEU 27 CO 0.18 0.45 -1.21 0.78 0.09 0.00 0.00 178.44 178.74 2osq h ASN 28 N 0.46 0.58 0.99 -0.43 2.35 -0.32 -0.95 115.58 118.26 2osq h ASN 28 Ca 0.11 -0.92 0.00 0.00 -0.55 0.00 0.00 56.30 54.93 2osq h ASN 28 Cb 0.22 -0.19 0.00 0.00 0.05 0.00 0.00 38.32 38.40 2osq h ASN 28 CO -0.00 1.57 0.00 1.05 -1.65 0.00 0.00 177.43 178.40 2osq h GLU 29 N -0.16 0.00 0.00 0.81 -0.00 -0.99 0.50 114.58 114.74 2osq h GLU 29 Ca -0.22 0.00 -0.13 0.00 -0.00 0.00 0.00 59.36 59.01 2osq h GLU 29 Cb 1.87 0.00 -0.02 0.00 -0.00 0.00 0.00 28.75 30.60 2osq h GLU 29 CO 0.18 0.00 -1.17 -0.89 -0.00 0.00 0.00 179.01 177.13 2osq n ILE 30 N -2.87 1.48 1.86 -1.06 5.41 0.68 -4.36 119.36 120.51 2osq n ILE 30 Ca 0.01 0.04 0.15 0.00 1.00 0.00 0.00 62.75 63.95 2osq n ILE 30 Cb 0.30 -2.22 0.79 0.00 -0.71 0.00 0.00 39.64 37.79 2osq n ILE 30 CO 0.00 0.00 0.00 0.49 0.00 0.00 0.00 176.55 177.04 2osq n PHE 31 N -4.47 0.01 0.35 1.39 3.01 -0.36 -4.15 117.46 113.24 2osq n PHE 31 Ca -0.23 -0.00 -0.17 0.00 1.01 0.00 0.00 57.45 58.06 2osq n PHE 31 Cb 0.53 0.00 -0.09 0.00 -0.01 0.00 0.00 39.48 39.91 2osq n PHE 31 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 2osq h GLY 32 N 5.02 -1.24 -5.57 1.37 0.00 -0.14 -3.23 103.07 99.29 2osq h GLY 32 Ca 0.00 0.53 -0.35 0.00 0.00 0.00 0.00 47.33 47.51 2osq h GLY 32 CO 0.00 -0.40 2.40 -1.55 0.00 0.00 0.00 176.54 176.99 2osq n PRO 33 N -5.23 1.80 0.00 4.80 -0.04 -1.26 -3.08 135.00 131.99 2osq n PRO 33 Ca -0.13 -1.36 0.00 0.00 -0.04 0.00 0.00 63.50 61.97 2osq n PRO 33 Cb 0.44 -2.42 0.00 0.00 -0.04 0.00 0.00 33.50 31.48 2osq n PRO 33 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 2osq n PHE 34 N 4.50 -0.20 0.00 0.54 3.72 -1.22 -5.09 117.46 119.71 2osq n PHE 34 Ca 0.39 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.79 2osq n PHE 34 Cb 0.13 0.09 0.00 0.00 -0.94 0.00 0.00 39.48 38.76 2osq n PHE 34 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2osq n GLY 35 N 0.21 -0.43 3.56 1.37 0.00 -1.18 -4.71 105.19 104.02 2osq n GLY 35 Ca 0.00 -1.12 -0.27 0.00 0.00 0.00 0.00 46.02 44.63 2osq n GLY 35 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2osq s PRO 36 N -2.00 2.54 -0.19 1.61 0.04 -1.26 -4.87 135.00 130.87 2osq s PRO 36 Ca 0.00 -0.51 -0.28 0.00 0.04 0.00 0.00 61.00 60.25 2osq s PRO 36 Cb 0.00 -5.11 -0.05 0.00 0.04 0.00 0.00 34.50 29.38 2osq s PRO 36 CO 0.00 -3.53 2.11 0.00 0.04 0.00 0.00 177.00 175.62 2osq s MET 37 N 6.88 3.32 0.11 4.56 0.23 -1.26 -1.06 119.30 132.07 2osq s MET 37 Ca 0.70 2.03 -0.19 0.00 -1.03 0.00 0.00 55.69 57.20 2osq s MET 37 Cb -0.05 -4.31 -0.06 0.00 -1.53 0.00 0.00 34.83 28.88 2osq s MET 37 CO 0.03 -1.89 1.66 -0.22 -2.03 0.00 0.00 175.02 172.57 2osq h LYS 38 N 14.02 0.38 -3.76 3.16 1.63 -1.18 -3.44 116.57 127.37 2osq h LYS 38 Ca -0.41 -0.06 -0.09 0.00 -0.85 0.00 0.00 60.65 59.24 2osq h LYS 38 Cb 1.23 -0.06 -0.12 0.00 -0.60 0.00 0.00 32.23 32.67 2osq h LYS 38 CO 0.97 0.40 -0.25 -2.00 -3.45 0.00 0.00 179.45 175.12 2osq s GLU 39 N -5.62 1.20 -0.17 1.90 2.56 0.03 -4.98 118.70 113.62 2osq s GLU 39 Ca -0.13 -1.10 -0.09 0.00 0.00 0.00 0.00 54.97 53.65 2osq s GLU 39 Cb 0.08 0.41 0.06 0.00 2.00 0.00 0.00 34.13 36.68 2osq s GLU 39 CO 0.72 -0.45 0.40 0.14 -0.56 0.00 0.00 175.26 175.50 2osq s VAL 40 N -3.95 -0.11 -0.09 3.70 -7.23 -1.26 -0.83 120.40 110.64 2osq s VAL 40 Ca 0.15 0.11 0.03 0.00 -1.81 0.00 0.00 61.98 60.46 2osq s VAL 40 Cb 0.02 -0.60 -0.01 0.00 0.56 0.00 0.00 36.38 36.35 2osq s VAL 40 CO -0.01 0.04 -0.19 -0.54 -0.31 0.00 0.00 175.10 174.09 2osq s LYS 41 N 1.56 2.92 -0.20 4.82 -0.14 0.11 -5.00 119.74 123.81 2osq s LYS 41 Ca -0.08 -0.80 -0.02 0.00 -1.36 0.00 0.00 55.97 53.70 2osq s LYS 41 Cb -0.09 -2.37 0.06 0.00 -1.68 0.00 0.00 37.83 33.75 2osq s LYS 41 CO -0.12 0.32 0.03 0.42 -0.76 0.00 0.00 175.35 175.23 2osq s ILE 42 N 0.03 0.64 0.09 2.17 1.09 -1.26 0.10 121.20 124.05 2osq s ILE 42 Ca -0.07 -0.64 0.08 0.00 -1.10 0.00 0.00 60.65 58.92 2osq s ILE 42 Cb -0.15 -1.12 -0.03 0.00 -1.06 0.00 0.00 42.46 40.10 2osq s ILE 42 CO 0.05 -0.20 -0.22 -0.76 -0.10 0.00 0.00 174.94 173.71 2osq s LEU 43 N 1.80 2.26 -0.71 2.97 1.43 -0.65 -4.93 118.68 120.84 2osq s LEU 43 Ca -0.01 -0.64 -0.26 0.00 -1.03 0.00 0.00 54.13 52.19 2osq s LEU 43 Cb -0.17 -0.96 -0.09 0.00 0.03 0.00 0.00 46.19 45.00 2osq s LEU 43 CO -0.08 0.11 2.26 0.20 0.23 0.00 0.00 176.35 179.07 2osq s ASN 44 N -1.68 4.42 0.00 2.29 0.02 -1.26 -1.35 114.94 117.38 2osq s ASN 44 Ca 0.08 0.21 0.00 0.00 -1.02 0.00 0.00 52.86 52.12 2osq s ASN 44 Cb -0.10 -2.54 0.00 0.00 0.02 0.00 0.00 41.25 38.64 2osq s ASN 44 CO 0.04 -3.24 0.00 0.61 0.02 0.00 0.00 177.10 174.53 2osq n GLY 45 N 6.49 1.27 3.57 0.66 0.00 -1.26 -5.09 105.19 110.83 2osq n GLY 45 Ca 0.40 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 46.30 2osq n GLY 45 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2osq s PHE 46 N -0.43 -0.44 0.18 1.61 -0.12 -0.46 -3.99 117.98 114.33 2osq s PHE 46 Ca 0.00 0.76 0.09 0.00 -0.05 0.00 0.00 56.93 57.74 2osq s PHE 46 Cb 0.00 0.44 -0.04 0.00 -0.63 0.00 0.00 43.02 42.78 2osq s PHE 46 CO 0.00 -0.39 -0.19 0.00 -0.05 0.00 0.00 175.22 174.58 2osq s ALA 47 N -1.07 2.16 -0.05 1.99 0.00 -0.88 -1.64 121.76 122.28 2osq s ALA 47 Ca -0.04 -1.55 -0.06 0.00 0.00 0.00 0.00 51.96 50.31 2osq s ALA 47 Cb -0.01 -0.21 0.01 0.00 0.00 0.00 0.00 23.12 22.91 2osq s ALA 47 CO 0.03 0.27 0.16 -0.06 0.00 0.00 0.00 175.76 176.16 2osq s PHE 48 N -2.04 -0.12 -0.08 0.00 0.08 0.12 0.09 117.98 116.02 2osq s PHE 48 Ca 0.18 0.30 -0.03 0.00 0.12 0.00 0.00 56.93 57.50 2osq s PHE 48 Cb -0.06 0.03 0.04 0.00 -0.57 0.00 0.00 43.02 42.46 2osq s PHE 48 CO 0.08 -0.15 0.06 0.54 -0.10 0.00 0.00 175.22 175.66 2osq s VAL 49 N -0.32 -0.07 -0.36 -0.44 0.11 0.22 0.09 120.40 119.63 2osq s VAL 49 Ca -0.04 0.25 -0.10 0.00 -2.93 0.00 0.00 61.98 59.16 2osq s VAL 49 Cb -0.03 -0.29 0.03 0.00 -1.53 0.00 0.00 36.38 34.55 2osq s VAL 49 CO 0.01 0.06 0.18 -0.70 -3.33 0.00 0.00 175.10 171.32 2osq s GLU 50 N 2.15 2.82 0.35 1.54 2.12 -0.01 -0.72 118.70 126.95 2osq s GLU 50 Ca 0.04 -1.08 -0.16 0.00 0.36 0.00 0.00 54.97 54.13 2osq s GLU 50 Cb -0.13 -3.67 -0.09 0.00 0.26 0.00 0.00 34.13 30.50 2osq s GLU 50 CO -0.05 -0.67 0.79 -0.06 -0.54 0.00 0.00 175.26 174.73 2osq s PHE 51 N 1.53 3.36 -1.95 5.30 0.08 -1.26 -0.77 117.98 124.27 2osq s PHE 51 Ca 0.01 1.31 0.27 0.00 0.12 0.00 0.00 56.93 58.65 2osq s PHE 51 Cb -0.19 -2.61 1.57 0.00 -0.57 0.00 0.00 43.02 41.22 2osq s PHE 51 CO 0.06 0.03 1.94 -1.91 -0.10 0.00 0.00 175.22 175.24 2osq n GLU 52 N -0.46 0.79 -3.71 0.44 4.07 -0.22 -4.50 120.64 117.05 2osq n GLU 52 Ca 0.04 0.00 -0.16 0.00 -0.06 0.00 0.00 57.16 56.98 2osq n GLU 52 Cb 0.53 -1.50 -0.16 0.00 -0.06 0.00 0.00 31.44 30.25 2osq n GLU 52 CO 0.00 0.00 0.00 -1.21 -0.06 0.00 0.00 177.13 175.86 2osq s GLU 53 N -2.05 0.01 0.37 5.31 0.41 -1.26 -4.98 118.70 116.50 2osq s GLU 53 Ca 0.39 0.41 0.14 0.00 -0.41 0.00 0.00 54.97 55.49 2osq s GLU 53 Cb 0.18 -0.30 0.98 0.00 -1.78 0.00 0.00 34.13 33.21 2osq s GLU 53 CO 0.32 -0.25 1.81 0.00 -0.49 0.00 0.00 175.26 176.64 2osq h ALA 54 N 7.91 2.04 0.32 5.21 0.00 -1.82 -1.24 119.26 131.68 2osq h ALA 54 Ca -0.26 0.05 -0.02 0.00 0.00 0.00 0.00 54.91 54.68 2osq h ALA 54 Cb 1.12 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.89 2osq h ALA 54 CO 0.27 -0.39 -0.15 1.49 0.00 0.00 0.00 179.25 180.48 2osq h GLU 55 N 0.52 -0.41 -0.93 0.00 4.81 -1.96 0.21 114.58 116.83 2osq h GLU 55 Ca 0.54 0.03 0.11 0.00 -0.13 0.00 0.00 59.36 59.91 2osq h GLU 55 Cb 1.17 0.09 -0.07 0.00 0.63 0.00 0.00 28.75 30.58 2osq h GLU 55 CO -0.28 -0.25 0.60 1.03 -0.73 0.00 0.00 179.01 179.38 2osq h SER 56 N -0.45 0.83 0.12 1.04 0.87 -1.53 -0.60 113.55 113.83 2osq h SER 56 Ca -0.04 0.03 -0.01 0.00 -1.23 0.00 0.00 61.79 60.54 2osq h SER 56 Cb 0.35 -0.14 0.00 0.00 -0.44 0.00 0.00 62.40 62.17 2osq h SER 56 CO 0.07 0.47 -0.06 0.00 -0.53 0.00 0.00 176.83 176.78 2osq h ALA 57 N 1.55 -0.17 -0.76 6.23 0.00 -1.07 -1.04 119.26 124.00 2osq h ALA 57 Ca 0.44 -0.23 0.16 0.00 0.00 0.00 0.00 54.91 55.28 2osq h ALA 57 Cb 0.45 0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.26 2osq h ALA 57 CO -0.20 -0.33 0.51 0.00 0.00 0.00 0.00 179.25 179.23 2osq h ALA 58 N 0.04 2.20 0.07 0.00 0.00 -0.20 -0.69 119.26 120.68 2osq h ALA 58 Ca -0.02 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.89 2osq h ALA 58 Cb 0.52 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.27 2osq h ALA 58 CO 0.03 -0.41 -0.03 0.87 0.00 0.00 0.00 179.25 179.70 2osq h LYS 59 N 0.35 -0.09 -0.86 0.00 1.79 -1.09 -3.23 116.57 113.43 2osq h LYS 59 Ca 0.37 0.01 0.22 0.00 -2.18 0.00 0.00 60.65 59.07 2osq h LYS 59 Cb 0.95 0.02 -0.05 0.00 -1.58 0.00 0.00 32.23 31.57 2osq h LYS 59 CO -0.11 0.44 0.59 0.00 -1.08 0.00 0.00 179.45 179.29 2osq h ALA 60 N -0.30 2.45 -0.72 3.86 0.00 -0.69 0.39 119.26 124.25 2osq h ALA 60 Ca -0.01 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.84 2osq h ALA 60 Cb 0.58 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.35 2osq h ALA 60 CO 0.02 -0.71 0.21 0.82 0.00 0.00 0.00 179.25 179.58 2osq h ILE 61 N 0.23 1.26 0.00 0.00 2.04 -1.20 0.33 117.51 120.17 2osq h ILE 61 Ca 0.43 -0.93 0.00 0.00 1.00 0.00 0.00 64.86 65.37 2osq h ILE 61 Cb 1.34 0.49 0.00 0.00 -0.74 0.00 0.00 36.82 37.90 2osq h ILE 61 CO -0.10 0.36 -0.60 -0.62 0.00 0.00 0.00 178.15 177.18 2osq n GLU 62 N -4.24 0.12 -0.07 2.37 -0.58 0.34 -3.24 120.64 115.34 2osq n GLU 62 Ca 0.06 0.02 -0.05 0.00 -0.42 0.00 0.00 57.16 56.77 2osq n GLU 62 Cb 0.24 -1.56 -0.02 0.00 -0.57 0.00 0.00 31.44 29.53 2osq n GLU 62 CO 0.00 0.00 0.00 0.39 -0.48 0.00 0.00 177.13 177.04 2osq n GLU 63 N -1.73 0.41 0.04 3.49 -0.58 0.11 -4.39 120.64 117.99 2osq n GLU 63 Ca 0.04 0.46 0.05 0.00 -0.42 0.00 0.00 57.16 57.29 2osq n GLU 63 Cb 0.38 -1.57 0.46 0.00 -0.57 0.00 0.00 31.44 30.14 2osq n GLU 63 CO 0.00 0.00 0.00 0.28 -0.48 0.00 0.00 177.13 176.93 2osq h VAL 64 N -0.90 1.09 -2.46 2.62 2.07 -0.55 -3.42 116.25 114.71 2osq h VAL 64 Ca 0.00 -0.16 -0.53 0.00 0.82 0.00 0.00 66.70 66.83 2osq h VAL 64 Cb 0.51 0.57 0.02 0.00 -1.52 0.00 0.00 31.29 30.87 2osq h VAL 64 CO 0.00 0.09 1.17 -2.28 0.02 0.00 0.00 177.57 176.57 2osq s HIS 65 N -5.43 1.64 0.00 1.57 5.65 -1.20 -1.44 115.29 116.08 2osq s HIS 65 Ca -0.08 -0.22 0.00 0.00 0.25 0.00 0.00 55.06 55.01 2osq s HIS 65 Cb 0.17 -4.17 0.00 0.00 -1.18 0.00 0.00 32.58 27.41 2osq s HIS 65 CO 0.72 -5.07 0.00 0.41 -0.65 0.00 0.00 174.74 170.15 2osq n GLY 66 N 4.38 0.78 2.32 1.59 0.00 -1.12 -4.92 105.19 108.23 2osq n GLY 66 Ca 0.19 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.03 2osq n GLY 66 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2osq n LYS 67 N -2.14 -0.77 -4.75 1.61 4.76 -0.52 -4.78 118.16 111.57 2osq n LYS 67 Ca 0.00 -1.24 -0.27 0.00 -2.87 0.00 0.00 58.31 53.92 2osq n LYS 67 Cb 0.00 -0.82 -0.14 0.00 -1.84 0.00 0.00 35.03 32.23 2osq n LYS 67 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 2osq s SER 68 N -3.93 2.74 -0.29 4.39 1.04 -1.26 -0.24 113.70 116.16 2osq s SER 68 Ca 0.45 -0.55 -0.17 0.00 0.48 0.00 0.00 55.95 56.16 2osq s SER 68 Cb -0.01 -0.24 0.16 0.00 0.10 0.00 0.00 66.02 66.03 2osq s SER 68 CO 0.32 0.20 1.07 0.12 0.98 0.00 0.00 173.24 175.92 2osq s PHE 69 N -0.80 -0.43 -1.37 5.02 2.19 0.32 -4.82 117.98 118.11 2osq s PHE 69 Ca 0.09 0.87 -0.07 0.00 0.33 0.00 0.00 56.93 58.16 2osq s PHE 69 Cb -0.09 0.28 0.01 0.00 -1.31 0.00 0.00 43.02 41.91 2osq s PHE 69 CO 0.02 -0.21 0.86 0.00 1.83 0.00 0.00 175.22 177.72 2osq n ALA 70 N 3.35 -1.08 -2.10 11.12 0.00 -1.26 -1.50 120.51 129.04 2osq n ALA 70 Ca -0.17 0.33 -0.20 0.00 0.00 0.00 0.00 53.44 53.39 2osq n ALA 70 Cb 0.57 -4.52 -0.04 0.00 0.00 0.00 0.00 19.45 15.46 2osq n ALA 70 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2osq n ASN 71 N -2.52 -5.69 -3.85 0.00 5.03 -1.26 -4.96 115.26 102.01 2osq n ASN 71 Ca -0.05 0.17 -0.12 0.00 0.87 0.00 0.00 54.58 55.46 2osq n ASN 71 Cb 0.58 -4.81 -0.10 0.00 -1.02 0.00 0.00 39.78 34.44 2osq n ASN 71 CO 0.00 0.00 0.00 -1.10 -1.83 0.00 0.00 177.26 174.33 2osq s GLN 72 N -4.55 0.52 0.01 3.52 -1.52 -0.56 -5.13 119.66 111.93 2osq s GLN 72 Ca 0.00 -0.35 -0.30 0.00 -1.95 0.00 0.00 55.36 52.75 2osq s GLN 72 Cb 0.00 0.22 -0.06 0.00 -0.22 0.00 0.00 33.01 32.95 2osq s GLN 72 CO 0.00 -0.13 1.44 -1.25 -0.25 0.00 0.00 175.29 175.11 2osq s PRO 73 N -1.36 4.27 0.66 2.91 0.04 -1.26 -0.52 135.00 139.74 2osq s PRO 73 Ca -0.14 2.02 -0.12 0.00 0.04 0.00 0.00 61.00 62.80 2osq s PRO 73 Cb -0.07 -3.59 -0.01 0.00 0.04 0.00 0.00 34.50 30.87 2osq s PRO 73 CO 0.02 -0.61 1.05 -0.51 0.04 0.00 0.00 177.00 176.99 2osq s LEU 74 N 2.50 3.23 -0.08 -3.56 1.43 0.67 -4.91 118.68 117.97 2osq s LEU 74 Ca 0.65 1.63 -0.03 0.00 -1.03 0.00 0.00 54.13 55.35 2osq s LEU 74 Cb -0.32 -4.50 0.04 0.00 0.03 0.00 0.00 46.19 41.44 2osq s LEU 74 CO 0.27 -1.29 0.17 -1.61 0.23 0.00 0.00 176.35 174.12 2osq s GLU 75 N -4.83 0.11 -0.01 1.70 2.02 -1.26 -2.79 118.70 113.64 2osq s GLU 75 Ca 0.59 0.43 0.00 0.00 0.02 0.00 0.00 54.97 56.01 2osq s GLU 75 Cb -0.14 -0.17 0.01 0.00 0.10 0.00 0.00 34.13 33.92 2osq s GLU 75 CO 0.50 -0.18 0.00 0.08 0.02 0.00 0.00 175.26 175.68 2osq s VAL 76 N 1.34 0.05 0.24 2.63 1.01 -1.26 -1.64 120.40 122.77 2osq s VAL 76 Ca -0.08 0.03 -0.02 0.00 0.00 0.00 0.00 61.98 61.91 2osq s VAL 76 Cb -0.11 -0.08 -0.03 0.00 0.00 0.00 0.00 36.38 36.16 2osq s VAL 76 CO -0.07 0.04 0.23 0.68 0.00 0.00 0.00 175.10 175.99 2osq s VAL 77 N 0.28 0.00 -0.63 2.92 -7.23 -0.57 -4.64 120.40 110.53 2osq s VAL 77 Ca -0.02 -1.87 -0.26 0.00 -1.81 0.00 0.00 61.98 58.01 2osq s VAL 77 Cb -0.04 -2.46 -0.02 0.00 0.56 0.00 0.00 36.38 34.42 2osq s VAL 77 CO -0.01 0.00 1.84 -0.31 -0.31 0.00 0.00 175.10 176.31 2osq s TYR 78 N -3.96 1.69 -0.05 2.82 2.02 -1.26 0.26 117.35 118.87 2osq s TYR 78 Ca 0.36 0.74 -0.36 0.00 -0.37 0.00 0.00 57.07 57.44 2osq s TYR 78 Cb 0.05 -4.11 -0.14 0.00 -0.40 0.00 0.00 41.96 37.35 2osq s TYR 78 CO 0.14 -2.28 1.65 0.45 -1.57 0.00 0.00 175.55 173.95 2osq n SER 79 N 12.64 2.65 0.00 2.29 2.88 0.93 -4.59 113.62 130.42 2osq n SER 79 Ca 0.20 1.06 0.09 0.00 -1.33 0.00 0.00 58.87 58.89 2osq n SER 79 Cb 0.52 -1.27 0.53 0.00 -0.75 0.00 0.00 64.21 63.23 2osq n SER 79 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10