#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oyv s ALA 2 N 0.00 2.32 0.18 3.14 0.00 -1.26 -5.14 121.76 121.00 1oyv s ALA 2 Ca 0.00 -1.36 0.08 0.00 0.00 0.00 0.00 51.96 50.68 1oyv s ALA 2 Cb 0.00 -0.44 -0.04 0.00 0.00 0.00 0.00 23.12 22.64 1oyv s ALA 2 CO 0.00 0.54 -0.16 0.00 0.00 0.00 0.00 175.76 176.13 1oyv s THR 4 N -2.48 2.20 -0.13 0.00 -4.23 -1.26 -4.86 115.64 104.88 1oyv s THR 4 Ca 0.19 0.15 0.00 0.00 -1.18 0.00 0.00 61.69 60.85 1oyv s THR 4 Cb -0.03 -3.10 0.12 0.00 1.34 0.00 0.00 72.50 70.83 1oyv s THR 4 CO 0.07 0.02 1.72 0.54 -0.54 0.00 0.00 174.62 176.43 1oyv n ARG 5 N 3.23 1.35 -3.08 3.99 5.12 -1.26 -4.88 116.66 121.12 1oyv n ARG 5 Ca 0.12 -0.72 -0.29 0.00 -1.93 0.00 0.00 57.85 55.03 1oyv n ARG 5 Cb 0.37 -1.28 -0.03 0.00 -1.16 0.00 0.00 32.46 30.36 1oyv n ARG 5 CO 0.00 0.00 0.00 -1.83 -1.93 0.00 0.00 177.63 173.87 1oyv s GLU 6 N -0.82 3.66 -0.20 5.56 1.03 -1.26 -5.05 118.70 121.62 1oyv s GLU 6 Ca 0.14 0.17 -0.18 0.00 0.03 0.00 0.00 54.97 55.14 1oyv s GLU 6 Cb 0.11 -2.52 -0.03 0.00 -0.80 0.00 0.00 34.13 30.89 1oyv s GLU 6 CO 0.01 0.07 0.49 0.00 -1.33 0.00 0.00 175.26 174.49 1oyv s GLY 8 N 1.12 1.60 -0.44 0.00 0.00 -1.15 -4.78 107.32 103.68 1oyv s GLY 8 Ca 0.23 -0.43 0.08 0.00 0.00 0.00 0.00 44.72 44.59 1oyv s GLY 8 CO 0.09 0.04 1.03 -2.01 0.00 0.00 0.00 173.10 172.26 1oyv n ASN 9 N -3.44 3.84 -4.86 1.64 5.15 -1.26 -2.45 115.26 113.89 1oyv n ASN 9 Ca 0.07 -3.49 -0.31 0.00 -0.60 0.00 0.00 54.58 50.25 1oyv n ASN 9 Cb 0.58 -0.50 -0.01 0.00 -0.53 0.00 0.00 39.78 39.32 1oyv n ASN 9 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1oyv s LEU 10 N -3.39 3.47 -0.12 1.20 1.43 -1.26 -4.60 118.68 115.40 1oyv s LEU 10 Ca 0.44 1.48 -0.08 0.00 -1.03 0.00 0.00 54.13 54.93 1oyv s LEU 10 Cb 0.39 -4.46 -0.07 0.00 0.03 0.00 0.00 46.19 42.08 1oyv s LEU 10 CO -0.13 -0.70 0.16 1.23 0.23 0.00 0.00 176.35 177.13 1oyv h GLY 11 N 0.39 0.00 -1.23 -3.19 0.00 0.14 -3.37 103.07 95.81 1oyv h GLY 11 Ca -0.46 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 46.87 1oyv h GLY 11 CO 0.62 0.00 0.28 -0.11 0.00 0.00 0.00 176.54 177.33 1oyv s PHE 12 N -1.81 0.08 0.01 5.60 -0.71 -0.90 -4.97 117.98 115.29 1oyv s PHE 12 Ca -0.07 -0.73 0.02 0.00 -1.04 0.00 0.00 56.93 55.10 1oyv s PHE 12 Cb -0.00 0.82 -0.01 0.00 -1.21 0.00 0.00 43.02 42.62 1oyv s PHE 12 CO 0.20 -1.52 -0.06 0.20 -1.34 0.00 0.00 175.22 172.70 1oyv s GLY 13 N -3.06 0.33 -0.16 1.99 0.00 -1.26 -1.52 107.32 103.63 1oyv s GLY 13 Ca 0.15 -0.42 0.02 0.00 0.00 0.00 0.00 44.72 44.47 1oyv s GLY 13 CO 0.11 -0.42 -0.20 -0.42 0.00 0.00 0.00 173.10 172.17 1oyv s ILE 14 N -0.62 2.03 -0.41 0.90 -1.09 -0.49 -4.93 121.20 116.58 1oyv s ILE 14 Ca -0.03 -0.93 0.03 0.00 -2.23 0.00 0.00 60.65 57.49 1oyv s ILE 14 Cb -0.05 -1.82 0.11 0.00 -1.58 0.00 0.00 42.46 39.13 1oyv s ILE 14 CO -0.00 0.54 0.15 0.00 -1.23 0.00 0.00 174.94 174.39 1oyv n PRO 16 N 3.83 0.48 -4.41 0.00 -0.02 -1.22 -4.87 135.00 128.80 1oyv n PRO 16 Ca 0.04 -0.43 -0.33 0.00 -2.02 0.00 0.00 63.50 60.75 1oyv n PRO 16 Cb 0.38 -2.87 -0.15 0.00 -0.02 0.00 0.00 33.50 30.84 1oyv n PRO 16 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 1oyv s ARG 17 N 8.39 3.26 0.42 -0.52 3.52 -1.26 -4.96 118.95 127.80 1oyv s ARG 17 Ca 1.06 -0.72 -0.26 0.00 -0.13 0.00 0.00 55.73 55.69 1oyv s ARG 17 Cb -0.39 -2.70 -0.09 0.00 -1.56 0.00 0.00 34.95 30.21 1oyv s ARG 17 CO 0.26 -0.01 1.32 -1.54 -0.81 0.00 0.00 175.30 174.52 1oyv s SER 18 N 0.91 6.22 0.22 -2.12 1.04 -1.26 -4.97 113.70 113.73 1oyv s SER 18 Ca -0.03 2.69 -0.22 0.00 0.48 0.00 0.00 55.95 58.87 1oyv s SER 18 Cb -0.15 -2.64 0.06 0.00 0.10 0.00 0.00 66.02 63.39 1oyv s SER 18 CO -0.01 -0.91 0.94 -1.83 0.98 0.00 0.00 173.24 172.40 1oyv s GLU 19 N -2.29 1.48 0.00 4.02 -1.05 -1.09 -4.93 118.70 114.84 1oyv s GLU 19 Ca 0.58 -0.90 0.00 0.00 -0.15 0.00 0.00 54.97 54.50 1oyv s GLU 19 Cb -0.39 0.45 0.00 0.00 -0.44 0.00 0.00 34.13 33.75 1oyv s GLU 19 CO 0.50 -0.69 0.00 0.41 0.95 0.00 0.00 175.26 176.43 1oyv n GLY 20 N -0.56 0.79 3.58 -3.83 0.00 -1.26 -0.49 105.19 103.41 1oyv n GLY 20 Ca -0.05 -1.86 -0.09 0.00 0.00 0.00 0.00 46.02 44.02 1oyv n GLY 20 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1oyv s SER 21 N -1.05 -0.09 0.16 1.61 1.04 -0.86 -4.68 113.70 109.84 1oyv s SER 21 Ca 0.00 -0.92 -0.16 0.00 0.48 0.00 0.00 55.95 55.35 1oyv s SER 21 Cb 0.00 0.58 0.10 0.00 0.10 0.00 0.00 66.02 66.80 1oyv s SER 21 CO 0.00 -1.13 1.72 -0.65 0.98 0.00 0.00 173.24 174.16 1oyv h PRO 22 N 2.26 0.18 -0.01 4.02 0.11 -1.88 -1.68 132.00 135.01 1oyv h PRO 22 Ca -0.26 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.84 1oyv h PRO 22 Cb 1.25 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1oyv h PRO 22 CO 0.36 0.12 -0.04 1.28 -0.21 0.00 0.00 178.00 179.51 1oyv n LEU 23 N -5.11 0.56 -3.14 2.35 4.32 -1.26 -4.21 117.00 110.50 1oyv n LEU 23 Ca 0.02 -0.12 -0.21 0.00 -0.02 0.00 0.00 56.01 55.68 1oyv n LEU 23 Cb 0.18 -0.07 -0.05 0.00 -1.62 0.00 0.00 43.42 41.86 1oyv n LEU 23 CO 0.23 0.10 -0.23 -3.20 -1.22 0.00 0.00 177.39 173.07 1oyv n ASN 24 N -0.68 -0.03 -4.77 -1.43 4.05 -0.67 -5.13 115.26 106.59 1oyv n ASN 24 Ca 0.19 -2.83 -0.40 0.00 0.45 0.00 0.00 54.58 52.00 1oyv n ASN 24 Cb 0.24 -0.36 -0.01 0.00 1.23 0.00 0.00 39.78 40.88 1oyv n ASN 24 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 177.26 172.05 1oyv s PRO 25 N -1.21 4.03 0.71 1.20 0.04 -0.97 -2.02 135.00 136.77 1oyv s PRO 25 Ca 0.35 2.21 -0.07 0.00 0.04 0.00 0.00 61.00 63.53 1oyv s PRO 25 Cb 0.21 -2.82 0.06 0.00 0.04 0.00 0.00 34.50 31.99 1oyv s PRO 25 CO -0.12 -0.46 1.02 0.96 0.04 0.00 0.00 177.00 178.45 1oyv s ILE 26 N -1.23 2.36 -0.23 0.56 -4.36 0.13 -4.94 121.20 113.49 1oyv s ILE 26 Ca 0.55 -0.21 -0.02 0.00 -0.26 0.00 0.00 60.65 60.71 1oyv s ILE 26 Cb -0.39 -3.04 0.01 0.00 1.25 0.00 0.00 42.46 40.29 1oyv s ILE 26 CO 0.51 -0.04 -0.07 0.00 0.24 0.00 0.00 174.94 175.58 1oyv s ILE 28 N 1.38 0.00 0.12 0.00 2.07 -1.26 -4.96 121.20 118.54 1oyv s ILE 28 Ca 0.03 -0.24 0.02 0.00 -1.41 0.00 0.00 60.65 59.05 1oyv s ILE 28 Cb -0.15 -1.94 -0.04 0.00 0.13 0.00 0.00 42.46 40.45 1oyv s ILE 28 CO -0.05 0.00 -0.06 0.54 -1.91 0.00 0.00 174.94 173.46 1oyv s ASN 29 N -2.93 1.22 0.46 4.50 2.20 -1.26 -1.36 114.94 117.77 1oyv s ASN 29 Ca 0.14 -1.04 0.22 0.00 -0.94 0.00 0.00 52.86 51.24 1oyv s ASN 29 Cb 0.04 0.09 1.21 0.00 -2.00 0.00 0.00 41.25 40.59 1oyv s ASN 29 CO -0.04 -0.47 1.87 0.00 -2.94 0.00 0.00 177.10 175.53 1oyv n SER 32 N -5.16 0.00 -4.72 0.00 3.41 -0.99 -3.11 113.62 103.05 1oyv n SER 32 Ca -0.10 0.01 -0.31 0.00 -0.26 0.00 0.00 58.87 58.22 1oyv n SER 32 Cb 0.27 -0.31 0.13 0.00 -0.26 0.00 0.00 64.21 64.04 1oyv n SER 32 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1oyv s GLY 33 N -2.62 1.66 -0.11 5.00 0.00 -0.27 -4.80 107.32 106.17 1oyv s GLY 33 Ca 0.21 0.23 -0.10 0.00 0.00 0.00 0.00 44.72 45.07 1oyv s GLY 33 CO 0.38 0.65 0.21 -0.19 0.00 0.00 0.00 173.10 174.16 1oyv s TYR 34 N -2.83 3.58 0.45 1.90 2.02 -1.26 -1.54 117.35 119.68 1oyv s TYR 34 Ca 0.63 0.61 -0.25 0.00 -0.37 0.00 0.00 57.07 57.69 1oyv s TYR 34 Cb -0.19 -2.10 -0.08 0.00 -0.40 0.00 0.00 41.96 39.20 1oyv s TYR 34 CO 0.57 0.59 1.37 0.15 -1.57 0.00 0.00 175.55 176.67 1oyv s LYS 35 N -0.65 3.68 0.00 -0.62 1.02 0.49 -1.61 119.74 122.04 1oyv s LYS 35 Ca 0.16 2.29 0.00 0.00 0.02 0.00 0.00 55.97 58.44 1oyv s LYS 35 Cb -0.13 -2.61 0.00 0.00 -0.52 0.00 0.00 37.83 34.57 1oyv s LYS 35 CO 0.05 -0.78 0.00 0.41 -0.92 0.00 0.00 175.35 174.11 1oyv n GLY 36 N 0.62 1.90 3.66 -3.33 0.00 -1.26 -4.89 105.19 101.88 1oyv n GLY 36 Ca 0.06 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.76 1oyv n GLY 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oyv s ASN 38 N -1.82 3.61 -0.07 0.00 0.01 0.12 -0.72 114.94 116.07 1oyv s ASN 38 Ca 0.21 -0.42 0.05 0.00 -0.71 0.00 0.00 52.86 51.99 1oyv s ASN 38 Cb -0.11 -0.56 -0.01 0.00 0.41 0.00 0.00 41.25 40.97 1oyv s ASN 38 CO 0.13 0.29 -0.21 -0.31 -1.51 0.00 0.00 177.10 175.48 1oyv s TYR 39 N -0.81 2.55 0.32 2.20 1.51 -0.02 -0.80 117.35 122.30 1oyv s TYR 39 Ca 0.13 -0.62 0.09 0.00 -1.01 0.00 0.00 57.07 55.66 1oyv s TYR 39 Cb -0.10 -1.65 -0.06 0.00 -0.11 0.00 0.00 41.96 40.04 1oyv s TYR 39 CO 0.03 -0.15 -0.09 0.71 -1.11 0.00 0.00 175.55 174.94 1oyv s TYR 40 N -0.17 2.25 0.60 2.71 2.02 -0.58 -1.08 117.35 123.09 1oyv s TYR 40 Ca -0.02 -0.55 -0.01 0.00 -0.37 0.00 0.00 57.07 56.12 1oyv s TYR 40 Cb -0.14 -1.26 0.12 0.00 -0.40 0.00 0.00 41.96 40.28 1oyv s TYR 40 CO 0.04 0.50 0.82 0.27 -1.57 0.00 0.00 175.55 175.61 1oyv n ASN 41 N -0.71 1.05 0.32 2.29 0.23 -0.68 -0.62 115.26 117.14 1oyv n ASN 41 Ca -0.05 -1.90 0.19 0.00 -0.53 0.00 0.00 54.58 52.29 1oyv n ASN 41 Cb 0.63 -0.54 1.01 0.00 -2.08 0.00 0.00 39.78 38.80 1oyv n ASN 41 CO 0.00 0.00 0.00 0.77 -0.93 0.00 0.00 177.26 177.10 1oyv h SER 42 N -0.53 0.00 -0.69 0.53 4.64 -1.89 -0.81 113.55 114.80 1oyv h SER 42 Ca -0.27 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.05 1oyv h SER 42 Cb 0.99 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.08 1oyv h SER 42 CO 0.29 0.00 0.00 0.49 -0.87 0.00 0.00 176.83 176.74 1oyv n PHE 43 N -3.09 1.02 -1.05 4.77 3.72 -1.26 -4.68 117.46 116.90 1oyv n PHE 43 Ca -0.02 -0.52 -0.02 0.00 -0.05 0.00 0.00 57.45 56.84 1oyv n PHE 43 Cb 0.23 -0.04 -0.01 0.00 -0.94 0.00 0.00 39.48 38.72 1oyv n PHE 43 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1oyv n GLY 44 N 1.48 0.52 3.72 1.37 0.00 -0.31 -5.01 105.19 106.97 1oyv n GLY 44 Ca 0.24 -0.42 -0.39 0.00 0.00 0.00 0.00 46.02 45.44 1oyv n GLY 44 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1oyv s LYS 45 N -1.24 4.42 0.42 1.61 2.20 -1.26 -4.80 119.74 121.09 1oyv s LYS 45 Ca 0.00 0.80 -0.26 0.00 -0.36 0.00 0.00 55.97 56.15 1oyv s LYS 45 Cb 0.00 -3.45 -0.10 0.00 -1.51 0.00 0.00 37.83 32.78 1oyv s LYS 45 CO 0.00 0.08 1.40 0.34 -0.36 0.00 0.00 175.35 176.81 1oyv n PHE 46 N 3.77 2.63 0.00 4.03 7.35 -1.26 -1.69 117.46 132.29 1oyv n PHE 46 Ca -0.02 0.46 0.00 0.00 -0.76 0.00 0.00 57.45 57.13 1oyv n PHE 46 Cb 0.51 -2.46 0.00 0.00 0.35 0.00 0.00 39.48 37.89 1oyv n PHE 46 CO 0.00 0.00 0.00 -0.89 -0.76 0.00 0.00 176.76 175.11 1oyv n ILE 47 N -0.01 0.00 0.00 -2.13 2.08 -0.24 -4.88 119.36 114.18 1oyv n ILE 47 Ca 0.04 0.00 0.00 0.00 0.56 0.00 0.00 62.75 63.35 1oyv n ILE 47 Cb 0.40 -0.48 0.00 0.00 -0.75 0.00 0.00 39.64 38.81 1oyv n ILE 47 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1oyv s GLU 49 N -2.00 2.74 0.20 0.00 2.12 -1.26 -0.84 118.70 119.66 1oyv s GLU 49 Ca 0.00 -0.75 -0.32 0.00 0.36 0.00 0.00 54.97 54.25 1oyv s GLU 49 Cb 0.00 -2.65 -0.14 0.00 0.26 0.00 0.00 34.13 31.60 1oyv s GLU 49 CO 0.00 0.55 1.33 0.41 -0.54 0.00 0.00 175.26 177.02 1oyv n GLY 50 N 0.50 0.54 0.08 -1.50 0.00 0.10 -4.90 105.19 100.01 1oyv n GLY 50 Ca -0.09 0.53 0.11 0.00 0.00 0.00 0.00 46.02 46.57 1oyv n GLY 50 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1oyv n GLU 51 N 2.08 0.52 -3.89 1.61 1.02 -0.47 -3.02 120.64 118.49 1oyv n GLU 51 Ca 0.14 0.06 -0.23 0.00 -0.02 0.00 0.00 57.16 57.11 1oyv n GLU 51 Cb 0.28 -1.73 -0.05 0.00 -0.02 0.00 0.00 31.44 29.91 1oyv n GLU 51 CO 0.00 0.00 0.00 -1.54 1.18 0.00 0.00 177.13 176.77 1oyv s SER 52 N -4.87 4.77 0.05 1.62 1.04 -0.59 -4.82 113.70 110.90 1oyv s SER 52 Ca 0.00 -0.85 0.03 0.00 0.48 0.00 0.00 55.95 55.61 1oyv s SER 52 Cb 0.11 -0.60 -0.02 0.00 0.10 0.00 0.00 66.02 65.61 1oyv s SER 52 CO 0.80 -0.52 -0.10 1.51 0.98 0.00 0.00 173.24 175.90 1oyv s ASP 53 N -3.98 1.18 0.07 7.02 -4.77 -1.26 -0.38 116.67 114.54 1oyv s ASP 53 Ca 0.43 -0.54 -0.16 0.00 -3.30 0.00 0.00 52.55 48.98 1oyv s ASP 53 Cb -0.01 -0.01 -0.05 0.00 -1.09 0.00 0.00 42.92 41.76 1oyv s ASP 53 CO 0.25 -0.13 1.27 1.55 0.70 0.00 0.00 175.17 178.81 1oyv h PRO 54 N 4.54 -0.16 -7.02 2.11 0.13 -1.97 -3.40 132.00 126.24 1oyv h PRO 54 Ca -0.37 0.01 -0.52 0.00 -0.87 0.00 0.00 66.00 64.25 1oyv h PRO 54 Cb 1.20 0.04 0.09 0.00 0.13 0.00 0.00 31.00 32.45 1oyv h PRO 54 CO 0.41 -0.10 0.53 0.15 -0.23 0.00 0.00 178.00 178.76 1oyv s LYS 55 N -4.28 3.53 -0.26 0.86 1.02 -1.26 -4.29 119.74 115.07 1oyv s LYS 55 Ca -0.07 1.94 -0.03 0.00 0.02 0.00 0.00 55.97 57.83 1oyv s LYS 55 Cb 0.04 -2.35 0.01 0.00 -0.52 0.00 0.00 37.83 35.02 1oyv s LYS 55 CO 0.30 -0.78 0.07 0.54 -0.92 0.00 0.00 175.35 174.55 1oyv n ARG 56 N -0.69 -3.61 -2.98 1.68 1.74 -1.26 -5.03 116.66 106.51 1oyv n ARG 56 Ca 0.08 2.86 -0.22 0.00 -0.77 0.00 0.00 57.85 59.80 1oyv n ARG 56 Cb 0.47 -5.06 0.01 0.00 -1.02 0.00 0.00 32.46 26.86 1oyv n ARG 56 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1oyv s PRO 57 N -1.30 2.99 0.15 5.56 0.04 -1.26 -4.42 135.00 136.76 1oyv s PRO 57 Ca -0.08 -0.58 -0.10 0.00 0.04 0.00 0.00 61.00 60.28 1oyv s PRO 57 Cb 0.01 -2.57 -0.00 0.00 0.04 0.00 0.00 34.50 31.97 1oyv s PRO 57 CO 0.75 -0.30 0.30 0.54 0.04 0.00 0.00 177.00 178.32 1oyv s ASN 58 N -4.24 0.01 0.08 6.66 4.22 -1.26 -5.10 114.94 115.30 1oyv s ASN 58 Ca 0.49 -0.75 -0.26 0.00 -2.14 0.00 0.00 52.86 50.20 1oyv s ASN 58 Cb -0.10 0.43 -0.06 0.00 1.28 0.00 0.00 41.25 42.80 1oyv s ASN 58 CO 0.37 -0.88 0.80 0.00 -2.04 0.00 0.00 177.10 175.36 1oyv s ALA 59 N -3.93 3.37 0.07 3.54 0.00 -1.26 -5.02 121.76 118.52 1oyv s ALA 59 Ca 0.13 0.35 0.03 0.00 0.00 0.00 0.00 51.96 52.47 1oyv s ALA 59 Cb 0.03 -3.03 -0.03 0.00 0.00 0.00 0.00 23.12 20.09 1oyv s ALA 59 CO -0.03 0.10 -0.09 0.00 0.00 0.00 0.00 175.76 175.74 1oyv s THR 61 N -1.87 2.74 -0.71 0.00 -4.23 -1.26 -4.91 115.64 105.40 1oyv s THR 61 Ca -0.03 0.60 -0.03 0.00 -1.18 0.00 0.00 61.69 61.05 1oyv s THR 61 Cb -0.07 -3.32 0.26 0.00 1.34 0.00 0.00 72.50 70.71 1oyv s THR 61 CO -0.00 0.03 2.27 0.49 -0.54 0.00 0.00 174.62 176.87 1oyv n PHE 62 N -0.35 2.53 -4.30 3.99 3.72 -1.26 -4.91 117.46 116.87 1oyv n PHE 62 Ca 0.06 -2.23 -0.27 0.00 -0.05 0.00 0.00 57.45 54.97 1oyv n PHE 62 Cb 0.46 -1.26 -0.10 0.00 -0.94 0.00 0.00 39.48 37.64 1oyv n PHE 62 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 176.76 177.25 1oyv s ASN 63 N -0.64 4.16 0.29 4.37 4.22 -1.26 -5.11 114.94 120.98 1oyv s ASN 63 Ca 0.54 -0.60 -0.26 0.00 -2.14 0.00 0.00 52.86 50.40 1oyv s ASN 63 Cb 0.42 -0.67 -0.10 0.00 1.28 0.00 0.00 41.25 42.19 1oyv s ASN 63 CO -0.33 0.11 0.92 0.00 -2.04 0.00 0.00 177.10 175.76 1oyv s ASP 65 N -1.52 6.30 0.55 0.00 -1.08 -0.46 -4.90 116.67 115.56 1oyv s ASP 65 Ca 0.47 -0.33 0.28 0.00 -0.52 0.00 0.00 52.55 52.45 1oyv s ASP 65 Cb -0.20 -2.29 1.46 0.00 -1.46 0.00 0.00 42.92 40.43 1oyv s ASP 65 CO 0.25 -0.66 1.95 -0.65 0.52 0.00 0.00 175.17 176.59 1oyv h PRO 66 N 8.73 0.00 0.00 4.34 0.11 -1.95 -1.01 132.00 142.22 1oyv h PRO 66 Ca -0.26 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.85 1oyv h PRO 66 Cb 1.11 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.22 1oyv h PRO 66 CO 0.84 0.00 0.00 0.09 -0.21 0.00 0.00 178.00 178.72 1oyv n ASN 67 N -4.12 0.10 -4.47 -2.05 3.02 -1.26 -4.71 115.26 101.77 1oyv n ASN 67 Ca 0.11 0.52 -0.34 0.00 -0.03 0.00 0.00 54.58 54.84 1oyv n ASN 67 Cb 0.68 -0.55 -0.12 0.00 -0.61 0.00 0.00 39.78 39.18 1oyv n ASN 67 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1oyv s ILE 68 N -3.04 3.76 -0.17 2.41 1.01 -0.38 -3.83 121.20 120.95 1oyv s ILE 68 Ca 0.07 -0.40 -0.05 0.00 0.00 0.00 0.00 60.65 60.27 1oyv s ILE 68 Cb 0.11 -2.64 -0.09 0.00 0.01 0.00 0.00 42.46 39.85 1oyv s ILE 68 CO 0.32 0.49 -0.19 0.00 0.00 0.00 0.00 174.94 175.56 1oyv n ALA 69 N 3.60 1.77 -2.52 9.38 0.00 0.21 -4.55 120.51 128.39 1oyv n ALA 69 Ca -0.17 -0.70 -0.14 0.00 0.00 0.00 0.00 53.44 52.42 1oyv n ALA 69 Cb 0.52 0.21 -0.07 0.00 0.00 0.00 0.00 19.45 20.11 1oyv n ALA 69 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 1oyv s TYR 70 N -2.33 1.20 0.15 0.00 1.13 -1.12 0.19 117.35 116.58 1oyv s TYR 70 Ca -0.24 -1.35 0.04 0.00 -1.41 0.00 0.00 57.07 54.11 1oyv s TYR 70 Cb 0.08 -0.39 -0.04 0.00 -1.10 0.00 0.00 41.96 40.50 1oyv s TYR 70 CO 0.34 -0.87 -0.08 -1.54 -2.51 0.00 0.00 175.55 170.90 1oyv s SER 71 N -3.22 1.67 -0.06 -0.18 1.04 0.35 -1.53 113.70 111.78 1oyv s SER 71 Ca 0.35 -1.05 -0.02 0.00 0.48 0.00 0.00 55.95 55.71 1oyv s SER 71 Cb 0.03 0.02 0.04 0.00 0.10 0.00 0.00 66.02 66.20 1oyv s SER 71 CO 0.18 -0.39 0.11 -0.13 0.98 0.00 0.00 173.24 174.00 1oyv s ARG 72 N -3.78 0.04 0.00 4.02 1.81 0.02 -2.68 118.95 118.37 1oyv s ARG 72 Ca 0.18 0.36 0.00 0.00 -1.72 0.00 0.00 55.73 54.55 1oyv s ARG 72 Cb 0.04 -0.23 0.00 0.00 -0.45 0.00 0.00 34.95 34.30 1oyv s ARG 72 CO 0.01 -0.20 0.00 0.00 -0.68 0.00 0.00 175.30 174.43 1oyv n GLY 86 N 5.00 0.67 3.26 0.00 0.00 -1.08 -4.86 105.19 108.18 1oyv n GLY 86 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 46.02 45.95 1oyv n GLY 86 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oyv s THR 88 N -1.60 4.31 0.46 0.00 -1.32 -1.26 -2.91 115.64 113.31 1oyv s THR 88 Ca 0.00 1.89 0.05 0.00 -1.21 0.00 0.00 61.69 62.42 1oyv s THR 88 Cb 0.00 -4.21 -0.04 0.00 -1.51 0.00 0.00 72.50 66.74 1oyv s THR 88 CO 0.00 0.28 0.07 0.42 -2.21 0.00 0.00 174.62 173.18 1oyv s THR 89 N 0.09 1.73 0.35 5.08 -4.23 -1.26 -4.28 115.64 113.12 1oyv s THR 89 Ca 0.49 -1.91 0.03 0.00 -1.18 0.00 0.00 61.69 59.12 1oyv s THR 89 Cb -0.25 -2.64 0.23 0.00 1.34 0.00 0.00 72.50 71.18 1oyv s THR 89 CO 0.31 0.00 1.97 0.00 -0.54 0.00 0.00 174.62 176.36 1oyv h THR 92 N 0.46 0.85 -3.41 0.00 2.02 -1.74 -3.28 112.91 107.81 1oyv h THR 92 Ca -0.09 -1.93 -0.42 0.00 0.77 0.00 0.00 66.41 64.75 1oyv h THR 92 Cb 1.54 2.22 0.20 0.00 -1.74 0.00 0.00 68.15 70.37 1oyv h THR 92 CO 0.18 0.44 0.06 -0.83 0.37 0.00 0.00 175.52 175.73 1oyv s GLY 93 N -4.42 1.53 -0.11 2.16 0.00 0.35 -4.69 107.32 102.14 1oyv s GLY 93 Ca 0.02 -0.66 -0.04 0.00 0.00 0.00 0.00 44.72 44.04 1oyv s GLY 93 CO 0.72 0.18 0.05 -0.19 0.00 0.00 0.00 173.10 173.86 1oyv s TYR 94 N -2.72 3.31 0.20 1.90 2.02 -1.26 -0.77 117.35 120.03 1oyv s TYR 94 Ca 0.69 0.27 -0.30 0.00 -0.37 0.00 0.00 57.07 57.36 1oyv s TYR 94 Cb -0.15 -1.88 -0.09 0.00 -0.40 0.00 0.00 41.96 39.44 1oyv s TYR 94 CO 0.58 0.50 1.32 -1.59 -1.57 0.00 0.00 175.55 174.80 1oyv s LYS 95 N -0.72 4.37 0.00 -0.62 -2.85 0.79 -2.28 119.74 118.43 1oyv s LYS 95 Ca 0.12 2.07 0.00 0.00 -1.00 0.00 0.00 55.97 57.16 1oyv s LYS 95 Cb -0.12 -3.19 0.00 0.00 -2.06 0.00 0.00 37.83 32.46 1oyv s LYS 95 CO 0.02 -0.28 0.00 0.41 0.10 0.00 0.00 175.35 175.61 1oyv n GLY 96 N 2.41 1.15 3.11 0.59 0.00 -1.26 -4.89 105.19 106.31 1oyv n GLY 96 Ca 0.06 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.93 1oyv n GLY 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oyv s TYR 98 N -1.38 2.36 -0.10 0.00 1.51 0.12 -2.19 117.35 117.67 1oyv s TYR 98 Ca -0.06 -1.37 -0.09 0.00 -1.01 0.00 0.00 57.07 54.54 1oyv s TYR 98 Cb -0.10 -1.69 -0.04 0.00 -0.11 0.00 0.00 41.96 40.02 1oyv s TYR 98 CO 0.01 -0.71 0.20 0.71 -1.11 0.00 0.00 175.55 174.65 1oyv s TYR 99 N 1.43 3.61 0.21 2.71 2.02 0.01 -1.40 117.35 125.94 1oyv s TYR 99 Ca 0.04 0.62 0.09 0.00 -0.37 0.00 0.00 57.07 57.45 1oyv s TYR 99 Cb -0.13 -2.04 -0.05 0.00 -0.40 0.00 0.00 41.96 39.35 1oyv s TYR 99 CO -0.11 0.68 -0.17 -0.06 -1.57 0.00 0.00 175.55 174.32 1oyv s PHE 100 N -0.93 1.90 0.00 2.71 0.40 -0.58 -1.28 117.98 120.20 1oyv s PHE 100 Ca 0.17 -0.48 0.00 0.00 -0.60 0.00 0.00 56.93 56.02 1oyv s PHE 100 Cb -0.13 -0.88 0.00 0.00 0.51 0.00 0.00 43.02 42.52 1oyv s PHE 100 CO 0.06 0.44 0.00 0.41 0.70 0.00 0.00 175.22 176.83 1oyv n GLY 101 N -0.22 2.62 3.29 4.36 0.00 -1.13 0.16 105.19 114.26 1oyv n GLY 101 Ca -0.09 -2.06 -0.31 0.00 0.00 0.00 0.00 46.02 43.55 1oyv n GLY 101 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1oyv n LYS 102 N -0.22 -1.85 -3.94 1.61 4.01 -1.26 -2.12 118.16 114.38 1oyv n LYS 102 Ca 0.00 -0.52 -0.31 0.00 -0.51 0.00 0.00 58.31 56.97 1oyv n LYS 102 Cb 0.00 -1.75 -0.02 0.00 -0.51 0.00 0.00 35.03 32.75 1oyv n LYS 102 CO 0.00 0.00 0.00 -3.47 -1.11 0.00 0.00 177.40 172.82 1oyv n ASP 103 N -2.18 -1.53 0.00 4.39 2.03 -1.26 -3.30 116.55 114.70 1oyv n ASP 103 Ca 0.01 -0.97 0.00 0.00 0.52 0.00 0.00 54.79 54.35 1oyv n ASP 103 Cb 0.61 -1.18 0.00 0.00 -0.72 0.00 0.00 41.12 39.83 1oyv n ASP 103 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1oyv n GLY 104 N -1.96 0.00 3.57 0.27 0.00 -0.90 -4.86 105.19 101.31 1oyv n GLY 104 Ca -0.15 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.53 1oyv n GLY 104 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1oyv s LYS 105 N 0.00 3.59 0.49 1.61 -0.14 -1.21 -4.88 119.74 119.20 1oyv s LYS 105 Ca 0.00 -0.45 -0.20 0.00 -1.36 0.00 0.00 55.97 53.95 1oyv s LYS 105 Cb 0.00 -2.96 -0.11 0.00 -1.68 0.00 0.00 37.83 33.08 1oyv s LYS 105 CO 0.00 0.36 0.55 0.34 -0.76 0.00 0.00 175.35 175.83 1oyv n PHE 106 N 3.21 -0.54 0.05 3.18 7.35 -1.26 -2.85 117.46 126.60 1oyv n PHE 106 Ca -0.17 0.52 0.00 0.00 -0.76 0.00 0.00 57.45 57.04 1oyv n PHE 106 Cb 0.53 -1.98 0.00 0.00 0.35 0.00 0.00 39.48 38.37 1oyv n PHE 106 CO 0.00 0.00 0.00 0.28 -0.76 0.00 0.00 176.76 176.28 1oyv n VAL 107 N -1.22 0.35 -3.79 -2.13 0.31 -0.40 -4.82 118.33 106.63 1oyv n VAL 107 Ca 0.11 0.12 -0.02 0.00 -0.01 0.00 0.00 64.34 64.54 1oyv n VAL 107 Cb 0.43 -1.06 0.00 0.00 -0.91 0.00 0.00 33.84 32.30 1oyv n VAL 107 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1oyv s GLU 109 N -2.60 2.44 0.84 0.00 2.12 -1.26 -0.81 118.70 119.43 1oyv s GLU 109 Ca 0.18 -0.91 -0.12 0.00 0.36 0.00 0.00 54.97 54.48 1oyv s GLU 109 Cb -0.00 -2.47 0.10 0.00 0.26 0.00 0.00 34.13 32.02 1oyv s GLU 109 CO 0.02 0.52 1.17 0.20 -0.54 0.00 0.00 175.26 176.63 1oyv s GLY 110 N -2.35 1.93 -0.00 -1.50 0.00 -0.93 -4.86 107.32 99.60 1oyv s GLY 110 Ca 0.25 0.68 0.02 0.00 0.00 0.00 0.00 44.72 45.68 1oyv s GLY 110 CO 0.17 1.09 0.06 1.18 0.00 0.00 0.00 173.10 175.60 1oyv n GLU 111 N -3.67 0.82 -2.77 2.90 1.02 -0.98 -3.32 120.64 114.63 1oyv n GLU 111 Ca 0.12 -0.02 -0.26 0.00 -0.02 0.00 0.00 57.16 56.99 1oyv n GLU 111 Cb 0.51 -1.00 0.01 0.00 -0.02 0.00 0.00 31.44 30.94 1oyv n GLU 111 CO 0.00 0.00 0.00 -1.12 1.18 0.00 0.00 177.13 177.19 1oyv s SER 112 N -2.13 6.02 0.06 1.62 0.01 0.05 -4.66 113.70 114.66 1oyv s SER 112 Ca -0.01 0.66 -0.04 0.00 1.31 0.00 0.00 55.95 57.88 1oyv s SER 112 Cb 0.01 -1.93 -0.05 0.00 0.21 0.00 0.00 66.02 64.26 1oyv s SER 112 CO 0.09 -0.67 0.28 -1.81 0.41 0.00 0.00 173.24 171.54 1oyv s ASP 113 N -4.17 6.45 0.42 2.44 1.01 -1.26 -0.15 116.67 121.42 1oyv s ASP 113 Ca 0.48 0.48 -0.25 0.00 0.71 0.00 0.00 52.55 53.97 1oyv s ASP 113 Cb -0.10 -2.05 -0.08 0.00 1.01 0.00 0.00 42.92 41.69 1oyv s ASP 113 CO 0.42 0.17 1.30 -1.61 0.21 0.00 0.00 175.17 175.66 1oyv s GLU 114 N -2.22 3.87 0.63 8.23 2.02 -1.26 -4.95 118.70 125.01 1oyv s GLU 114 Ca 0.33 2.13 -0.19 0.00 0.02 0.00 0.00 54.97 57.27 1oyv s GLU 114 Cb -0.13 -2.68 -0.02 0.00 0.10 0.00 0.00 34.13 31.40 1oyv s GLU 114 CO 0.22 -0.57 1.25 -2.30 0.02 0.00 0.00 175.26 173.87 1oyv n PRO 115 N -0.04 1.16 0.00 0.39 -0.02 -1.26 -5.19 135.00 130.04 1oyv n PRO 115 Ca 0.05 0.45 0.02 0.00 -2.02 0.00 0.00 63.50 62.00 1oyv n PRO 115 Cb 0.44 -2.48 0.02 0.00 -0.02 0.00 0.00 33.50 31.47 1oyv n PRO 115 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11