#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nyn s SER 2 N 0.00 -1.07 0.10 6.12 0.15 -1.26 -5.15 113.70 112.59 1nyn s SER 2 Ca 0.00 -0.08 0.10 0.00 0.70 0.00 0.00 55.95 56.67 1nyn s SER 2 Cb 0.00 1.77 -0.04 0.00 -1.71 0.00 0.00 66.02 66.04 1nyn s SER 2 CO 0.00 -0.30 -0.25 0.42 1.20 0.00 0.00 173.24 174.31 1nyn s THR 3 N 2.64 2.33 0.00 6.45 -4.23 -1.26 -5.13 115.64 116.44 1nyn s THR 3 Ca 0.11 -1.60 0.00 0.00 -1.18 0.00 0.00 61.69 59.01 1nyn s THR 3 Cb -0.10 -2.00 0.00 0.00 1.34 0.00 0.00 72.50 71.73 1nyn s THR 3 CO -0.25 0.18 0.00 1.33 -0.54 0.00 0.00 174.62 175.34 1nyn n VAL 4 N 1.15 0.00 -4.56 2.29 0.24 -1.26 -5.01 118.33 111.19 1nyn n VAL 4 Ca -0.17 0.00 -0.22 0.00 -2.04 0.00 0.00 64.34 61.91 1nyn n VAL 4 Cb 0.53 0.00 -0.14 0.00 -1.47 0.00 0.00 33.84 32.75 1nyn n VAL 4 CO 0.00 0.00 0.00 -0.89 -2.14 0.00 0.00 176.83 173.80 1nyn s THR 5 N -2.54 1.19 -0.18 3.34 2.01 0.22 -4.97 115.64 114.72 1nyn s THR 5 Ca 0.00 -0.82 -0.08 0.00 0.31 0.00 0.00 61.69 61.10 1nyn s THR 5 Cb 0.00 -1.03 -0.04 0.00 0.01 0.00 0.00 72.50 71.44 1nyn s THR 5 CO 0.00 0.20 0.09 -0.54 -0.69 0.00 0.00 174.62 173.67 1nyn s LYS 6 N -0.72 3.93 -0.32 4.92 1.02 -1.26 -0.44 119.74 126.87 1nyn s LYS 6 Ca 0.04 -0.29 -0.12 0.00 0.02 0.00 0.00 55.97 55.62 1nyn s LYS 6 Cb -0.07 -3.25 -0.03 0.00 -0.52 0.00 0.00 37.83 33.97 1nyn s LYS 6 CO 0.00 0.36 0.23 0.71 -0.92 0.00 0.00 175.35 175.74 1nyn s TYR 7 N 0.14 3.23 0.09 3.18 1.51 -1.12 -4.94 117.35 119.44 1nyn s TYR 7 Ca 0.06 -0.11 -0.15 0.00 -1.01 0.00 0.00 57.07 55.86 1nyn s TYR 7 Cb -0.12 -2.46 -0.06 0.00 -0.11 0.00 0.00 41.96 39.21 1nyn s TYR 7 CO -0.00 -0.31 0.50 -0.06 -1.11 0.00 0.00 175.55 174.57 1nyn s PHE 8 N 1.75 3.67 -0.28 2.71 0.40 -1.26 -2.08 117.98 122.88 1nyn s PHE 8 Ca 0.07 1.05 -0.01 0.00 -0.60 0.00 0.00 56.93 57.44 1nyn s PHE 8 Cb -0.17 -2.35 0.09 0.00 0.51 0.00 0.00 43.02 41.10 1nyn s PHE 8 CO 0.11 0.52 0.08 -0.47 0.70 0.00 0.00 175.22 176.16 1nyn s TYR 9 N -1.30 1.52 -0.91 0.36 5.04 -0.56 -0.68 117.35 120.81 1nyn s TYR 9 Ca 0.32 -1.52 -0.24 0.00 -2.44 0.00 0.00 57.07 53.20 1nyn s TYR 9 Cb -0.16 -1.53 0.05 0.00 0.35 0.00 0.00 41.96 40.67 1nyn s TYR 9 CO 0.18 -0.82 1.34 0.21 -1.34 0.00 0.00 175.55 175.12 1nyn s LYS 10 N 1.68 3.45 0.00 4.97 2.20 -1.26 -2.77 119.74 128.02 1nyn s LYS 10 Ca 0.07 -0.92 0.00 0.00 -0.36 0.00 0.00 55.97 54.76 1nyn s LYS 10 Cb -0.17 -4.92 0.00 0.00 -1.51 0.00 0.00 37.83 31.23 1nyn s LYS 10 CO -0.22 -2.13 0.00 0.41 -0.36 0.00 0.00 175.35 173.05 1nyn n GLY 11 N 6.24 -0.47 0.00 5.54 0.00 -1.00 -4.96 105.19 110.54 1nyn n GLY 11 Ca 0.22 -1.54 0.00 0.00 0.00 0.00 0.00 46.02 44.70 1nyn n GLY 11 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1nyn n GLU 12 N 0.00 0.00 -0.00 1.61 1.02 -1.26 -4.46 120.64 117.55 1nyn n GLU 12 Ca 0.00 0.19 0.00 0.00 -0.02 0.00 0.00 57.16 57.33 1nyn n GLU 12 Cb 0.00 -0.79 -0.01 0.00 -0.02 0.00 0.00 31.44 30.63 1nyn n GLU 12 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1nyn n ASN 13 N -0.48 1.86 -4.86 1.62 4.05 -1.26 -5.02 115.26 111.18 1nyn n ASN 13 Ca 0.00 -0.32 -0.34 0.00 0.45 0.00 0.00 54.58 54.37 1nyn n ASN 13 Cb 0.00 1.01 -0.06 0.00 1.23 0.00 0.00 39.78 41.97 1nyn n ASN 13 CO 0.00 0.00 0.00 -0.89 -3.05 0.00 0.00 177.26 173.32 1nyn s THR 14 N -1.45 4.90 -0.23 -0.44 2.01 -1.26 -5.07 115.64 114.10 1nyn s THR 14 Ca 0.00 0.65 -0.00 0.00 0.31 0.00 0.00 61.69 62.64 1nyn s THR 14 Cb 0.01 -3.67 0.03 0.00 0.01 0.00 0.00 72.50 68.87 1nyn s THR 14 CO 0.03 0.08 -0.11 -0.62 -0.69 0.00 0.00 174.62 173.32 1nyn s ASP 15 N -2.04 4.00 0.14 3.53 2.15 -1.26 -2.37 116.67 120.81 1nyn s ASP 15 Ca 0.43 -0.88 0.06 0.00 0.43 0.00 0.00 52.55 52.58 1nyn s ASP 15 Cb -0.13 -1.59 -0.04 0.00 -0.30 0.00 0.00 42.92 40.86 1nyn s ASP 15 CO 0.20 -0.10 0.03 -0.76 -0.17 0.00 0.00 175.17 174.37 1nyn s LEU 16 N 1.28 3.47 -0.12 -1.34 1.43 -1.11 -4.24 118.68 118.04 1nyn s LEU 16 Ca 0.00 -0.25 -0.03 0.00 -1.03 0.00 0.00 54.13 52.82 1nyn s LEU 16 Cb -0.16 -2.15 0.05 0.00 0.03 0.00 0.00 46.19 43.95 1nyn s LEU 16 CO -0.07 0.12 0.05 -0.63 0.23 0.00 0.00 176.35 176.05 1nyn s ILE 17 N -1.55 0.15 0.18 -0.59 1.01 0.43 -1.50 121.20 119.32 1nyn s ILE 17 Ca 0.27 -0.06 0.02 0.00 0.00 0.00 0.00 60.65 60.89 1nyn s ILE 17 Cb -0.10 -0.57 0.03 0.00 0.01 0.00 0.00 42.46 41.82 1nyn s ILE 17 CO 0.19 -0.04 0.25 1.33 0.00 0.00 0.00 174.94 176.67 1nyn n VAL 18 N 5.20 0.00 -3.40 2.92 0.24 -0.88 -2.56 118.33 119.84 1nyn n VAL 18 Ca -0.07 -0.51 -0.20 0.00 -2.04 0.00 0.00 64.34 61.53 1nyn n VAL 18 Cb 0.49 -0.99 -0.02 0.00 -1.47 0.00 0.00 33.84 31.85 1nyn n VAL 18 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 1nyn s PHE 19 N -0.24 2.76 -0.15 6.34 0.40 -1.26 -2.80 117.98 123.02 1nyn s PHE 19 Ca 0.18 -0.45 -0.30 0.00 -0.60 0.00 0.00 56.93 55.76 1nyn s PHE 19 Cb -0.01 -2.21 0.12 0.00 0.51 0.00 0.00 43.02 41.43 1nyn s PHE 19 CO 0.11 -0.19 0.97 0.00 0.70 0.00 0.00 175.22 176.81 1nyn s ALA 20 N -2.42 -1.92 -0.11 5.36 0.00 0.42 -4.58 121.76 118.51 1nyn s ALA 20 Ca 0.50 1.57 -0.04 0.00 0.00 0.00 0.00 51.96 54.00 1nyn s ALA 20 Cb -0.06 -0.68 -0.02 0.00 0.00 0.00 0.00 23.12 22.37 1nyn s ALA 20 CO 0.29 -0.31 -0.02 0.00 0.00 0.00 0.00 175.76 175.73 1nyn h ALA 21 N 2.63 0.00 -2.31 0.00 0.00 -1.76 0.64 119.26 118.46 1nyn h ALA 21 Ca -0.19 -0.16 -0.08 0.00 0.00 0.00 0.00 54.91 54.48 1nyn h ALA 21 Cb 1.16 0.14 -0.22 0.00 0.00 0.00 0.00 17.79 18.87 1nyn h ALA 21 CO 0.31 0.14 -0.03 -1.54 0.00 0.00 0.00 179.25 178.13 1nyn s SER 22 N -5.64 -0.56 0.44 0.00 1.04 -1.26 -2.90 113.70 104.82 1nyn s SER 22 Ca -0.05 0.95 0.17 0.00 0.48 0.00 0.00 55.95 57.51 1nyn s SER 22 Cb 0.00 0.96 1.10 0.00 0.10 0.00 0.00 66.02 68.19 1nyn s SER 22 CO 0.09 -0.30 1.91 1.05 0.98 0.00 0.00 173.24 176.96 1nyn h GLU 23 N 4.68 0.36 0.29 4.02 4.11 -1.96 -2.45 114.58 123.63 1nyn h GLU 23 Ca -0.28 -0.02 -0.01 0.00 0.07 0.00 0.00 59.36 59.12 1nyn h GLU 23 Cb 1.17 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 30.32 1nyn h GLU 23 CO 0.22 0.24 -0.31 1.49 0.07 0.00 0.00 179.01 180.71 1nyn h GLU 24 N 0.37 -0.58 -0.58 1.06 4.81 -2.00 -2.16 114.58 115.51 1nyn h GLU 24 Ca 0.39 0.04 0.08 0.00 -0.13 0.00 0.00 59.36 59.73 1nyn h GLU 24 Cb 0.97 0.13 -0.10 0.00 0.63 0.00 0.00 28.75 30.38 1nyn h GLU 24 CO -0.12 -0.39 -0.49 -0.07 -0.73 0.00 0.00 179.01 177.21 1nyn h LEU 25 N -0.60 -1.70 -0.99 1.64 3.38 -1.86 0.33 115.31 115.52 1nyn h LEU 25 Ca -0.04 0.26 0.29 0.00 0.09 0.00 0.00 57.88 58.48 1nyn h LEU 25 Cb 0.53 0.74 -0.18 0.00 0.09 0.00 0.00 40.66 41.83 1nyn h LEU 25 CO -0.05 -0.35 0.09 0.58 0.09 0.00 0.00 178.44 178.80 1nyn h VAL 26 N -0.26 0.02 -0.59 1.22 2.07 -1.34 1.97 116.25 119.35 1nyn h VAL 26 Ca 0.14 -0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.66 1nyn h VAL 26 Cb 0.56 0.01 -0.03 0.00 -1.52 0.00 0.00 31.29 30.31 1nyn h VAL 26 CO -0.69 0.00 0.36 -0.78 0.02 0.00 0.00 177.57 176.48 1nyn h ASP 27 N 0.01 0.70 0.61 0.57 1.82 0.31 -0.07 116.42 120.38 1nyn h ASP 27 Ca 0.63 -0.03 -0.02 0.00 -0.39 0.00 0.00 57.03 57.21 1nyn h ASP 27 Cb 1.35 -0.18 -0.00 0.00 0.68 0.00 0.00 39.33 41.18 1nyn h ASP 27 CO -0.90 0.53 -0.11 -0.33 -1.61 0.00 0.00 179.24 176.82 1nyn h GLU 28 N 0.81 0.00 0.00 0.28 5.08 0.36 -2.46 114.58 118.65 1nyn h GLU 28 Ca 0.21 0.00 -0.22 0.00 -1.00 0.00 0.00 59.36 58.36 1nyn h GLU 28 Cb -0.04 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.17 1nyn h GLU 28 CO -0.04 0.11 -1.24 -0.92 -1.00 0.00 0.00 179.01 175.92 1nyn h TYR 29 N 0.00 0.00 -0.85 4.33 3.20 -0.29 -3.16 116.97 120.20 1nyn h TYR 29 Ca -0.00 0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.85 1nyn h TYR 29 Cb 0.45 0.00 -0.04 0.00 1.54 0.00 0.00 36.73 38.68 1nyn h TYR 29 CO 0.00 0.87 0.44 -0.07 -1.64 0.00 0.00 178.16 177.76 1nyn h LEU 30 N 0.00 1.08 -0.43 2.82 3.38 -0.86 -1.15 115.31 120.16 1nyn h LEU 30 Ca -0.13 -0.11 -0.18 0.00 0.09 0.00 0.00 57.88 57.55 1nyn h LEU 30 Cb 1.77 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 42.24 1nyn h LEU 30 CO 0.09 0.89 -0.77 0.50 0.09 0.00 0.00 178.44 179.24 1nyn h LYS 31 N 1.20 0.21 -2.42 1.13 3.64 -1.65 -3.36 116.57 115.33 1nyn h LYS 31 Ca 0.30 -0.19 -0.60 0.00 -1.27 0.00 0.00 60.65 58.88 1nyn h LYS 31 Cb 0.07 0.05 -0.41 0.00 -0.41 0.00 0.00 32.23 31.52 1nyn h LYS 31 CO -0.04 0.88 -0.70 -1.71 -2.27 0.00 0.00 179.45 175.61 1nyn n ASN 32 N -3.74 2.69 -4.63 4.20 5.15 -0.91 -5.07 115.26 112.95 1nyn n ASN 32 Ca -0.03 -3.18 -0.43 0.00 -0.60 0.00 0.00 54.58 50.34 1nyn n ASN 32 Cb 0.73 -0.68 -0.02 0.00 -0.53 0.00 0.00 39.78 39.28 1nyn n ASN 32 CO 0.00 0.00 0.00 -2.16 1.40 0.00 0.00 177.26 176.50 1nyn s PRO 33 N -1.81 3.87 0.00 1.20 0.04 -0.48 -4.70 135.00 133.11 1nyn s PRO 33 Ca 0.35 1.20 0.00 0.00 0.04 0.00 0.00 61.00 62.59 1nyn s PRO 33 Cb 0.09 -3.90 0.00 0.00 0.04 0.00 0.00 34.50 30.73 1nyn s PRO 33 CO -0.08 -1.18 0.00 0.43 0.04 0.00 0.00 177.00 176.21 1nyn n SER 34 N 7.77 0.00 0.00 6.66 7.64 -1.26 -5.08 113.62 129.35 1nyn n SER 34 Ca 0.15 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.03 1nyn n SER 34 Cb 0.47 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.67 1nyn n SER 34 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1nyn n ILE 35 N 0.00 0.00 -0.07 0.44 3.06 -1.26 -4.92 119.36 116.61 1nyn n ILE 35 Ca 0.00 0.00 -0.11 0.00 -2.50 0.00 0.00 62.75 60.14 1nyn n ILE 35 Cb 0.00 0.00 -0.10 0.00 0.54 0.00 0.00 39.64 40.08 1nyn n ILE 35 CO 0.00 0.00 0.00 1.23 -2.50 0.00 0.00 176.55 175.28 1nyn h GLY 36 N 0.00 0.00 1.84 4.50 0.00 -1.98 -3.25 103.07 104.18 1nyn h GLY 36 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1nyn h GLY 36 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 176.54 177.71 1nyn n LYS 37 N -4.63 0.04 0.17 4.80 4.81 -1.26 -2.81 118.16 119.28 1nyn n LYS 37 Ca -0.10 0.30 -0.14 0.00 -0.87 0.00 0.00 58.31 57.51 1nyn n LYS 37 Cb 0.38 -1.50 -0.08 0.00 0.02 0.00 0.00 35.03 33.85 1nyn n LYS 37 CO 0.00 0.00 0.00 1.25 1.17 0.00 0.00 177.40 179.82 1nyn h LEU 38 N 0.00 -0.37 -1.33 3.14 5.85 -1.91 -2.07 115.31 118.61 1nyn h LEU 38 Ca 0.00 -0.13 0.00 0.00 0.84 0.00 0.00 57.88 58.59 1nyn h LEU 38 Cb 0.11 0.10 -0.00 0.00 0.37 0.00 0.00 40.66 41.24 1nyn h LEU 38 CO 0.00 -0.06 0.56 0.77 -0.34 0.00 0.00 178.44 179.36 1nyn h SER 39 N -0.70 0.00 0.12 1.25 4.64 -1.68 0.29 113.55 117.48 1nyn h SER 39 Ca -0.04 0.00 -0.25 0.00 -0.47 0.00 0.00 61.79 61.03 1nyn h SER 39 Cb 0.48 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.58 1nyn h SER 39 CO 0.07 0.00 -1.21 -0.33 -0.87 0.00 0.00 176.83 174.49 1nyn h GLU 40 N 0.00 0.26 0.00 4.77 4.39 -1.55 -3.40 114.58 119.04 1nyn h GLU 40 Ca 0.00 -0.44 0.00 0.00 0.34 0.00 0.00 59.36 59.26 1nyn h GLU 40 Cb 1.12 0.16 0.00 0.00 -0.10 0.00 0.00 28.75 29.94 1nyn h GLU 40 CO -0.00 1.21 0.00 0.28 -1.16 0.00 0.00 179.01 179.34 1nyn n VAL 41 N -4.00 0.00 -2.12 3.13 0.31 0.96 -4.64 118.33 111.97 1nyn n VAL 41 Ca -0.21 1.12 -0.42 0.00 -0.01 0.00 0.00 64.34 64.82 1nyn n VAL 41 Cb 0.87 -2.09 -0.03 0.00 -0.91 0.00 0.00 33.84 31.68 1nyn n VAL 41 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1nyn s VAL 42 N -2.18 3.18 -0.08 2.52 1.01 -0.85 -3.51 120.40 120.49 1nyn s VAL 42 Ca 0.00 0.84 -0.00 0.00 0.00 0.00 0.00 61.98 62.82 1nyn s VAL 42 Cb 0.00 -3.54 -0.25 0.00 0.00 0.00 0.00 36.38 32.59 1nyn s VAL 42 CO 0.00 0.06 0.50 -0.08 0.00 0.00 0.00 175.10 175.58 1nyn h GLU 43 N 6.86 0.18 -4.57 2.72 4.57 -1.83 -3.43 114.58 119.09 1nyn h GLU 43 Ca -0.42 -0.31 -0.62 0.00 -1.18 0.00 0.00 59.36 56.82 1nyn h GLU 43 Cb 1.21 0.12 -0.37 0.00 -0.16 0.00 0.00 28.75 29.54 1nyn h GLU 43 CO 0.88 0.97 -0.80 -0.51 -1.18 0.00 0.00 179.01 178.37 1nyn s LEU 44 N -6.73 2.57 -1.14 1.64 1.02 -1.26 -5.03 118.68 109.75 1nyn s LEU 44 Ca -0.16 -1.06 -0.25 0.00 0.02 0.00 0.00 54.13 52.69 1nyn s LEU 44 Cb 0.07 -1.28 -0.15 0.00 0.02 0.00 0.00 46.19 44.85 1nyn s LEU 44 CO 0.80 -0.18 2.02 -0.36 0.02 0.00 0.00 176.35 178.65 1nyn s PHE 45 N 1.34 1.60 -0.01 0.29 0.40 -1.26 -4.77 117.98 115.57 1nyn s PHE 45 Ca -0.04 1.34 -0.28 0.00 -0.60 0.00 0.00 56.93 57.35 1nyn s PHE 45 Cb -0.18 -3.68 0.10 0.00 0.51 0.00 0.00 43.02 39.77 1nyn s PHE 45 CO -0.07 -0.95 0.83 -2.00 0.70 0.00 0.00 175.22 173.73 1nyn s GLU 46 N 7.41 0.89 -0.14 0.44 2.56 -1.26 -5.13 118.70 123.47 1nyn s GLU 46 Ca 0.75 -0.20 -0.01 0.00 0.00 0.00 0.00 54.97 55.51 1nyn s GLU 46 Cb -0.03 0.41 -0.02 0.00 2.00 0.00 0.00 34.13 36.50 1nyn s GLU 46 CO 0.16 -0.36 -0.11 0.08 -0.56 0.00 0.00 175.26 174.47 1nyn s VAL 47 N -2.69 3.25 0.26 3.70 1.01 -1.26 -4.67 120.40 120.00 1nyn s VAL 47 Ca 0.01 -0.59 0.09 0.00 0.00 0.00 0.00 61.98 61.50 1nyn s VAL 47 Cb -0.01 -2.38 -0.04 0.00 0.00 0.00 0.00 36.38 33.95 1nyn s VAL 47 CO -0.06 0.51 0.03 -0.36 0.00 0.00 0.00 175.10 175.22 1nyn s PHE 48 N 0.40 2.76 0.21 5.22 0.08 -1.06 -2.76 117.98 122.82 1nyn s PHE 48 Ca -0.09 -0.21 0.00 0.00 0.12 0.00 0.00 56.93 56.76 1nyn s PHE 48 Cb -0.15 -1.22 -0.05 0.00 -0.57 0.00 0.00 43.02 41.03 1nyn s PHE 48 CO 0.05 0.61 0.09 0.95 -0.10 0.00 0.00 175.22 176.81 1nyn s THR 49 N -2.30 0.36 0.98 0.64 -4.23 -1.14 -0.43 115.64 109.52 1nyn s THR 49 Ca 0.32 -1.99 -0.16 0.00 -1.18 0.00 0.00 61.69 58.68 1nyn s THR 49 Cb -0.07 -2.45 -0.04 0.00 1.34 0.00 0.00 72.50 71.28 1nyn s THR 49 CO 0.21 -0.12 -0.19 -2.65 -0.54 0.00 0.00 174.62 171.32 1nyn n PRO 50 N -0.33 -0.27 0.00 3.99 -0.02 -1.26 -3.44 135.00 133.68 1nyn n PRO 50 Ca -0.01 -0.06 0.00 0.00 -2.02 0.00 0.00 63.50 61.41 1nyn n PRO 50 Cb 0.65 -1.47 0.00 0.00 -0.02 0.00 0.00 33.50 32.66 1nyn n PRO 50 CO 0.00 0.00 0.00 0.94 1.98 0.00 0.00 175.50 178.42 1nyn n GLN 51 N 0.09 0.00 -2.98 -0.52 7.27 -1.26 -4.32 117.38 115.66 1nyn n GLN 51 Ca 0.02 0.02 -0.01 0.00 0.07 0.00 0.00 57.00 57.10 1nyn n GLN 51 Cb 0.56 -0.20 0.00 0.00 2.41 0.00 0.00 30.24 33.01 1nyn n GLN 51 CO 0.00 0.00 0.00 -0.51 0.07 0.00 0.00 177.06 176.62 1nyn s ASP 52 N -1.42 -1.34 0.98 1.69 1.01 -1.26 -4.97 116.67 111.36 1nyn s ASP 52 Ca 0.00 -1.06 0.00 0.00 0.71 0.00 0.00 52.55 52.20 1nyn s ASP 52 Cb 0.00 1.73 0.00 0.00 1.01 0.00 0.00 42.92 45.66 1nyn s ASP 52 CO 0.00 -0.11 0.00 0.61 0.21 0.00 0.00 175.17 175.88 1nyn n GLY 53 N 3.71 0.85 3.64 0.21 0.00 -1.26 -4.75 105.19 107.59 1nyn n GLY 53 Ca 0.13 -0.65 -0.43 0.00 0.00 0.00 0.00 46.02 45.08 1nyn n GLY 53 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1nyn s ARG 54 N 0.00 3.86 -0.24 1.61 1.81 -1.26 -4.91 118.95 119.82 1nyn s ARG 54 Ca 0.00 2.03 -0.36 0.00 -1.72 0.00 0.00 55.73 55.68 1nyn s ARG 54 Cb 0.00 -4.10 0.15 0.00 -0.45 0.00 0.00 34.95 30.55 1nyn s ARG 54 CO 0.00 -1.24 1.29 0.20 -0.68 0.00 0.00 175.30 174.86 1nyn s GLY 55 N 4.66 -0.22 0.00 -3.53 0.00 -1.26 -5.00 107.32 101.97 1nyn s GLY 55 Ca 0.79 1.83 0.00 0.00 0.00 0.00 0.00 44.72 47.35 1nyn s GLY 55 CO 0.33 0.63 0.00 0.00 0.00 0.00 0.00 173.10 174.06 1nyn n ALA 56 N 0.01 0.13 -3.34 3.20 0.00 -1.26 -4.87 120.51 114.37 1nyn n ALA 56 Ca 0.02 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.49 1nyn n ALA 56 Cb 0.57 0.00 0.01 0.00 0.00 0.00 0.00 19.45 20.03 1nyn n ALA 56 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1nyn n GLU 57 N 0.00 0.28 0.00 0.00 0.28 -1.26 -5.04 120.64 114.90 1nyn n GLU 57 Ca 0.00 -0.62 0.00 0.00 -0.16 0.00 0.00 57.16 56.38 1nyn n GLU 57 Cb 0.15 0.82 0.00 0.00 1.43 0.00 0.00 31.44 33.84 1nyn n GLU 57 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 1nyn n GLY 58 N -0.27 0.56 3.49 -1.84 0.00 -1.26 -4.46 105.19 101.41 1nyn n GLY 58 Ca -0.01 -1.11 -0.44 0.00 0.00 0.00 0.00 46.02 44.46 1nyn n GLY 58 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1nyn s GLU 59 N 0.00 4.05 0.00 1.61 8.01 -1.26 -4.99 118.70 126.12 1nyn s GLU 59 Ca 0.00 -2.42 0.00 0.00 0.01 0.00 0.00 54.97 52.56 1nyn s GLU 59 Cb 0.00 -5.16 0.00 0.00 -4.31 0.00 0.00 34.13 24.66 1nyn s GLU 59 CO 0.00 -1.87 0.00 1.28 0.01 0.00 0.00 175.26 174.68 1nyn n LEU 60 N 6.28 0.00 -4.79 1.80 4.77 -1.26 -4.97 117.00 118.83 1nyn n LEU 60 Ca 0.39 0.00 -0.32 0.00 -0.03 0.00 0.00 56.01 56.05 1nyn n LEU 60 Cb 0.44 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.46 1nyn n LEU 60 CO 0.65 -1.07 -0.21 -0.83 -1.33 0.00 0.00 177.39 174.61 1nyn s GLY 61 N -2.25 2.96 0.09 -0.72 0.00 -1.22 -5.01 107.32 101.17 1nyn s GLY 61 Ca 0.00 -0.39 0.08 0.00 0.00 0.00 0.00 44.72 44.42 1nyn s GLY 61 CO 0.00 -2.17 -0.21 0.00 0.00 0.00 0.00 173.10 170.72 1nyn s ALA 62 N -2.87 1.82 0.24 3.20 0.00 -1.26 -2.89 121.76 120.00 1nyn s ALA 62 Ca 0.08 -1.21 -0.09 0.00 0.00 0.00 0.00 51.96 50.73 1nyn s ALA 62 Cb 0.01 -0.27 -0.07 0.00 0.00 0.00 0.00 23.12 22.78 1nyn s ALA 62 CO 0.05 0.38 0.56 0.00 0.00 0.00 0.00 175.76 176.75 1nyn s ALA 63 N -1.07 3.56 0.53 0.00 0.00 -1.11 -4.82 121.76 118.84 1nyn s ALA 63 Ca 0.07 -0.29 0.07 0.00 0.00 0.00 0.00 51.96 51.82 1nyn s ALA 63 Cb -0.10 -2.44 0.06 0.00 0.00 0.00 0.00 23.12 20.64 1nyn s ALA 63 CO 0.04 0.47 0.73 -1.54 0.00 0.00 0.00 175.76 175.45 1nyn s SER 64 N -2.45 5.25 0.28 0.00 1.04 -1.26 -4.93 113.70 111.63 1nyn s SER 64 Ca 0.47 -0.58 0.07 0.00 0.48 0.00 0.00 55.95 56.40 1nyn s SER 64 Cb -0.11 -0.18 0.38 0.00 0.10 0.00 0.00 66.02 66.21 1nyn s SER 64 CO 0.22 -1.16 1.64 0.11 0.98 0.00 0.00 173.24 175.04 1nyn h LYS 65 N 0.28 0.17 -0.41 4.02 1.79 -1.99 -2.73 116.57 117.69 1nyn h LYS 65 Ca -0.35 -0.10 -0.07 0.00 -2.18 0.00 0.00 60.65 57.95 1nyn h LYS 65 Cb 1.28 0.01 -0.01 0.00 -1.58 0.00 0.00 32.23 31.93 1nyn h LYS 65 CO 0.43 0.65 0.00 0.00 -1.08 0.00 0.00 179.45 179.45 1nyn h ALA 66 N 1.33 0.56 0.22 3.86 0.00 -1.99 0.66 119.26 123.90 1nyn h ALA 66 Ca 0.00 -0.26 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 1nyn h ALA 66 Cb 0.96 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.60 1nyn h ALA 66 CO 0.08 0.34 -0.11 0.37 0.00 0.00 0.00 179.25 179.93 1nyn h GLN 67 N 0.57 -0.28 -0.81 0.00 4.15 -1.93 -2.89 115.11 113.91 1nyn h GLN 67 Ca 0.12 0.02 0.01 0.00 0.77 0.00 0.00 58.65 59.56 1nyn h GLN 67 Cb 0.48 0.06 -0.04 0.00 0.21 0.00 0.00 27.48 28.19 1nyn h GLN 67 CO 0.02 -0.09 0.53 0.28 -1.93 0.00 0.00 178.83 177.65 1nyn h VAL 68 N -0.43 1.21 -0.94 2.39 2.07 -1.45 -2.09 116.25 117.01 1nyn h VAL 68 Ca -0.03 -0.38 0.28 0.00 0.82 0.00 0.00 66.70 67.38 1nyn h VAL 68 Cb 0.33 0.02 -0.15 0.00 -1.52 0.00 0.00 31.29 29.97 1nyn h VAL 68 CO 0.05 0.20 0.39 -0.33 0.02 0.00 0.00 177.57 177.90 1nyn h GLU 69 N 1.09 0.25 0.00 1.57 5.08 -0.65 1.72 114.58 123.65 1nyn h GLU 69 Ca 0.30 -0.02 -0.06 0.00 -1.00 0.00 0.00 59.36 58.58 1nyn h GLU 69 Cb -0.12 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.06 1nyn h GLU 69 CO -0.06 0.17 -0.30 -0.97 -1.00 0.00 0.00 179.01 176.84 1nyn h ASN 70 N 0.26 0.00 1.34 1.42 -0.73 -1.27 0.86 115.58 117.46 1nyn h ASN 70 Ca 0.64 0.00 -0.12 0.00 1.87 0.00 0.00 56.30 58.69 1nyn h ASN 70 Cb 1.38 0.00 -0.02 0.00 0.27 0.00 0.00 38.32 39.95 1nyn h ASN 70 CO -0.64 0.30 -0.67 -0.08 -0.37 0.00 0.00 177.43 175.97 1nyn h GLU 71 N 0.00 0.00 0.00 6.67 4.57 0.25 -3.45 114.58 122.63 1nyn h GLU 71 Ca -0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 1nyn h GLU 71 Cb 0.73 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.32 1nyn h GLU 71 CO 0.04 0.50 0.00 1.19 -1.18 0.00 0.00 179.01 179.56 1nyn n PHE 72 N -3.18 0.00 -3.11 0.92 3.72 0.47 -4.97 117.46 111.30 1nyn n PHE 72 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 1nyn n PHE 72 Cb 0.76 0.36 0.00 0.00 -0.94 0.00 0.00 39.48 39.67 1nyn n PHE 72 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1nyn n GLY 73 N 1.67 -1.64 3.58 1.37 0.00 0.26 -4.98 105.19 105.45 1nyn n GLY 73 Ca 0.00 -1.27 -0.24 0.00 0.00 0.00 0.00 46.02 44.52 1nyn n GLY 73 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1nyn s LYS 74 N -1.99 2.07 0.00 1.61 2.20 -1.26 -4.39 119.74 117.98 1nyn s LYS 74 Ca 0.00 -1.50 0.00 0.00 -0.36 0.00 0.00 55.97 54.11 1nyn s LYS 74 Cb 0.00 -2.04 0.00 0.00 -1.51 0.00 0.00 37.83 34.28 1nyn s LYS 74 CO 0.00 0.36 0.00 0.41 -0.36 0.00 0.00 175.35 175.76 1nyn n GLY 75 N -0.68 3.25 0.00 5.54 0.00 -1.26 -5.05 105.19 106.99 1nyn n GLY 75 Ca -0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.95 1nyn n GLY 75 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1nyn n LYS 76 N -1.40 0.02 -4.95 1.61 5.02 -1.26 -5.08 118.16 112.12 1nyn n LYS 76 Ca 0.00 0.00 -0.27 0.00 -2.02 0.00 0.00 58.31 56.02 1nyn n LYS 76 Cb 0.00 0.00 -0.16 0.00 -0.02 0.00 0.00 35.03 34.85 1nyn n LYS 76 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1nyn s LYS 77 N -2.60 1.76 0.31 1.97 1.02 -1.26 -5.00 119.74 115.95 1nyn s LYS 77 Ca 0.00 -0.69 0.05 0.00 0.02 0.00 0.00 55.97 55.35 1nyn s LYS 77 Cb 0.00 -1.61 0.85 0.00 -0.52 0.00 0.00 37.83 36.55 1nyn s LYS 77 CO 0.00 0.36 1.53 1.51 -0.92 0.00 0.00 175.35 177.83 1nyn n ILE 78 N 2.82 -0.41 -0.16 2.17 0.00 -1.26 0.15 119.36 122.68 1nyn n ILE 78 Ca -0.16 2.12 -0.09 0.00 0.00 0.00 0.00 62.75 64.62 1nyn n ILE 78 Cb 0.53 -3.16 -0.00 0.00 0.00 0.00 0.00 39.64 37.01 1nyn n ILE 78 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 176.55 176.22 1nyn h GLU 79 N 0.00 0.71 -0.66 9.51 5.08 -2.00 -1.45 114.58 125.77 1nyn h GLU 79 Ca 0.64 -0.16 0.03 0.00 -1.00 0.00 0.00 59.36 58.86 1nyn h GLU 79 Cb 1.40 -0.10 -0.04 0.00 0.50 0.00 0.00 28.75 30.51 1nyn h GLU 79 CO -0.89 0.69 0.44 1.49 -1.00 0.00 0.00 179.01 179.74 1nyn h GLU 80 N 0.59 0.80 0.47 2.33 4.57 0.10 -2.52 114.58 120.92 1nyn h GLU 80 Ca 0.14 -0.05 -0.02 0.00 -1.18 0.00 0.00 59.36 58.25 1nyn h GLU 80 Cb 0.29 -0.18 0.00 0.00 -0.16 0.00 0.00 28.75 28.70 1nyn h GLU 80 CO -0.00 0.53 -0.23 0.28 -1.18 0.00 0.00 179.01 178.41 1nyn h VAL 81 N 0.82 0.00 -0.98 0.32 2.07 -0.59 -3.08 116.25 114.81 1nyn h VAL 81 Ca 0.26 -0.50 0.35 0.00 0.82 0.00 0.00 66.70 67.63 1nyn h VAL 81 Cb 0.02 0.00 -0.18 0.00 -1.52 0.00 0.00 31.29 29.61 1nyn h VAL 81 CO -0.07 0.00 0.32 -0.38 0.02 0.00 0.00 177.57 177.46 1nyn n ILE 82 N -5.09 -0.41 0.26 4.57 5.41 -0.59 0.22 119.36 123.74 1nyn n ILE 82 Ca -0.08 2.05 -0.16 0.00 1.00 0.00 0.00 62.75 65.56 1nyn n ILE 82 Cb 0.25 -3.19 -0.08 0.00 -0.71 0.00 0.00 39.64 35.91 1nyn n ILE 82 CO 0.00 0.00 0.00 -0.78 0.00 0.00 0.00 176.55 175.77 1nyn h ASP 83 N 0.00 -0.99 -0.58 4.38 1.82 -1.43 -0.34 116.42 119.28 1nyn h ASP 83 Ca 0.73 0.08 0.15 0.00 -0.39 0.00 0.00 57.03 57.60 1nyn h ASP 83 Cb 1.80 0.32 -0.03 0.00 0.68 0.00 0.00 39.33 42.10 1nyn h ASP 83 CO -0.82 -0.53 0.41 -0.07 -1.61 0.00 0.00 179.24 176.62 1nyn h LEU 84 N -0.80 0.09 0.32 2.28 3.38 -0.14 -1.71 115.31 118.72 1nyn h LEU 84 Ca -0.04 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 1nyn h LEU 84 Cb 0.70 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 41.44 1nyn h LEU 84 CO -0.03 0.05 -0.15 0.40 0.09 0.00 0.00 178.44 178.80 1nyn h ILE 85 N 0.10 0.00 -0.93 1.22 1.08 0.00 -3.13 117.51 115.86 1nyn h ILE 85 Ca 0.28 -0.23 0.27 0.00 -0.39 0.00 0.00 64.86 64.79 1nyn h ILE 85 Cb 0.97 0.00 -0.14 0.00 -3.07 0.00 0.00 36.82 34.58 1nyn h ILE 85 CO -0.03 0.00 0.35 -0.07 -0.69 0.00 0.00 178.15 177.71 1nyn h LEU 86 N -0.65 0.18 -0.57 1.44 3.38 -0.78 0.16 115.31 118.46 1nyn h LEU 86 Ca -0.04 0.20 0.11 0.00 0.09 0.00 0.00 57.88 58.23 1nyn h LEU 86 Cb 0.33 0.22 -0.11 0.00 0.09 0.00 0.00 40.66 41.19 1nyn h LEU 86 CO 0.07 -0.15 -0.30 -0.09 0.09 0.00 0.00 178.44 178.07 1nyn h ARG 87 N 0.25 -0.14 0.00 1.13 2.43 -1.30 -3.24 114.38 113.51 1nyn h ARG 87 Ca 0.62 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.80 1nyn h ARG 87 Cb 1.31 0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.89 1nyn h ARG 87 CO -0.64 -0.09 0.00 0.09 -1.51 0.00 0.00 179.97 177.82 1nyn n ASN 88 N -5.43 0.00 -1.61 -3.80 4.13 0.52 -5.04 115.26 104.02 1nyn n ASN 88 Ca 0.04 0.19 0.00 0.00 1.68 0.00 0.00 54.58 56.50 1nyn n ASN 88 Cb 0.35 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.59 1nyn n ASN 88 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1nyn n GLY 89 N 1.09 -4.89 2.60 7.41 0.00 -0.99 -4.96 105.19 105.45 1nyn n GLY 89 Ca 0.00 -0.38 -0.27 0.00 0.00 0.00 0.00 46.02 45.37 1nyn n GLY 89 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1nyn n LYS 90 N 1.35 1.26 -0.35 1.61 4.81 0.14 -4.96 118.16 122.03 1nyn n LYS 90 Ca 0.00 -3.95 0.24 0.00 -0.87 0.00 0.00 58.31 53.74 1nyn n LYS 90 Cb 0.00 -1.97 0.51 0.00 0.02 0.00 0.00 35.03 33.59 1nyn n LYS 90 CO 0.00 0.00 0.00 -1.35 1.17 0.00 0.00 177.40 177.22 1nyn h PRO 91 N 5.17 0.35 -6.76 1.64 0.11 -1.93 -3.39 132.00 127.19 1nyn h PRO 91 Ca 0.19 -0.02 -0.39 0.00 0.11 0.00 0.00 66.00 65.89 1nyn h PRO 91 Cb 0.81 -0.08 0.21 0.00 0.11 0.00 0.00 31.00 32.05 1nyn h PRO 91 CO 0.59 0.23 -0.43 -1.71 -0.21 0.00 0.00 178.00 176.47 1nyn n ASN 92 N -4.73 -2.74 -3.51 -2.05 5.15 -1.26 -3.88 115.26 102.25 1nyn n ASN 92 Ca 0.28 -0.37 -0.21 0.00 -0.60 0.00 0.00 54.58 53.69 1nyn n ASN 92 Cb 0.96 -1.02 0.06 0.00 -0.53 0.00 0.00 39.78 39.25 1nyn n ASN 92 CO 0.00 0.00 0.00 -0.24 1.40 0.00 0.00 177.26 178.42 1nyn n SER 93 N -3.58 -4.17 -3.88 1.20 2.88 -1.26 -4.94 113.62 99.86 1nyn n SER 93 Ca 0.05 -0.80 -0.13 0.00 -1.33 0.00 0.00 58.87 56.66 1nyn n SER 93 Cb 0.55 -4.43 0.04 0.00 -0.75 0.00 0.00 64.21 59.62 1nyn n SER 93 CO 0.00 0.00 0.00 1.07 -1.23 0.00 0.00 175.04 174.88 1nyn n THR 94 N -3.87 0.00 -3.07 2.46 5.66 -1.25 -5.02 114.28 109.18 1nyn n THR 94 Ca -0.17 -1.25 0.03 0.00 -3.05 0.00 0.00 64.05 59.61 1nyn n THR 94 Cb 0.64 -0.67 -0.00 0.00 -1.55 0.00 0.00 70.33 68.74 1nyn n THR 94 CO 0.00 0.00 0.00 0.28 -3.05 0.00 0.00 175.07 172.30 1nyn s THR 95 N -1.32 -0.62 0.28 1.09 -1.32 -1.26 -5.16 115.64 107.33 1nyn s THR 95 Ca 0.38 0.00 0.12 0.00 -1.21 0.00 0.00 61.69 60.98 1nyn s THR 95 Cb -0.03 -0.31 -0.05 0.00 -1.51 0.00 0.00 72.50 70.60 1nyn s THR 95 CO 0.24 0.00 -0.19 -0.94 -2.21 0.00 0.00 174.62 171.53 1nyn s SER 96 N 2.41 3.56 0.18 8.08 1.04 -1.26 -4.74 113.70 122.96 1nyn s SER 96 Ca 0.17 -1.05 -0.17 0.00 0.48 0.00 0.00 55.95 55.38 1nyn s SER 96 Cb -0.03 -0.30 0.14 0.00 0.10 0.00 0.00 66.02 65.93 1nyn s SER 96 CO -0.18 0.01 1.29 -1.54 0.98 0.00 0.00 173.24 173.80 1nyn n SER 97 N -0.63 -0.62 -4.54 7.02 3.41 -1.26 -3.68 113.62 113.32 1nyn n SER 97 Ca -0.05 1.46 -0.26 0.00 -0.26 0.00 0.00 58.87 59.76 1nyn n SER 97 Cb 0.60 -0.30 -0.10 0.00 -0.26 0.00 0.00 64.21 64.16 1nyn n SER 97 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1nyn n LEU 98 N -5.18 1.22 0.00 1.04 4.32 -1.26 -3.73 117.00 113.41 1nyn n LEU 98 Ca 0.07 -0.79 0.00 0.00 -0.02 0.00 0.00 56.01 55.27 1nyn n LEU 98 Cb 0.30 -1.35 0.00 0.00 -1.62 0.00 0.00 43.42 40.76 1nyn n LEU 98 CO -0.12 -1.83 0.00 1.17 -1.22 0.00 0.00 177.39 175.39 1nyn n LYS 99 N 8.29 0.00 0.18 3.23 4.81 -1.24 -4.92 118.16 128.50 1nyn n LYS 99 Ca 0.50 0.00 0.07 0.00 -0.87 0.00 0.00 58.31 58.00 1nyn n LYS 99 Cb 0.36 0.00 0.16 0.00 0.02 0.00 0.00 35.03 35.57 1nyn n LYS 99 CO 0.00 0.00 0.00 1.15 1.17 0.00 0.00 177.40 179.72 1nyn h THR 100 N 0.00 0.58 0.00 3.15 2.02 -1.89 -3.47 112.91 113.30 1nyn h THR 100 Ca 0.00 -1.68 0.00 0.00 0.77 0.00 0.00 66.41 65.50 1nyn h THR 100 Cb 0.00 2.17 0.00 0.00 -1.74 0.00 0.00 68.15 68.58 1nyn h THR 100 CO 0.00 0.31 0.00 0.29 0.37 0.00 0.00 175.52 176.49 1nyn n LYS 101 N -3.23 0.00 -2.60 6.66 4.76 -1.26 -4.84 118.16 117.65 1nyn n LYS 101 Ca 0.02 0.00 -0.05 0.00 -2.87 0.00 0.00 58.31 55.41 1nyn n LYS 101 Cb 0.62 0.00 0.02 0.00 -1.84 0.00 0.00 35.03 33.82 1nyn n LYS 101 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1nyn n GLY 102 N 0.00 0.50 2.17 0.72 0.00 -1.26 -4.90 105.19 102.42 1nyn n GLY 102 Ca 0.00 -0.43 -0.26 0.00 0.00 0.00 0.00 46.02 45.33 1nyn n GLY 102 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1nyn n GLY 103 N -0.90 3.65 3.54 -0.02 0.00 -1.26 -4.87 105.19 105.33 1nyn n GLY 103 Ca -0.02 -1.35 -0.34 0.00 0.00 0.00 0.00 46.02 44.31 1nyn n GLY 103 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1nyn s ASN 104 N 2.11 4.65 -0.38 1.61 0.01 -1.26 -4.98 114.94 116.70 1nyn s ASN 104 Ca 0.68 -0.08 -0.03 0.00 -0.71 0.00 0.00 52.86 52.73 1nyn s ASN 104 Cb 0.24 -1.41 0.22 0.00 0.41 0.00 0.00 41.25 40.72 1nyn s ASN 104 CO -0.03 0.29 1.04 0.00 -1.51 0.00 0.00 177.10 176.89 1nyn n ALA 105 N 2.74 -3.24 0.00 0.60 0.00 -1.26 -4.93 120.51 114.41 1nyn n ALA 105 Ca -0.18 -0.29 0.00 0.00 0.00 0.00 0.00 53.44 52.97 1nyn n ALA 105 Cb 0.53 -2.82 0.00 0.00 0.00 0.00 0.00 19.45 17.16 1nyn n ALA 105 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1nyn n GLY 106 N 2.42 2.76 2.29 0.00 0.00 -1.26 -4.77 105.19 106.63 1nyn n GLY 106 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 1nyn n GLY 106 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1nyn n THR 107 N -0.15-12.80 0.74 2.61 -2.24 -1.26 -4.84 114.28 96.34 1nyn n THR 107 Ca 0.00 3.08 0.12 0.00 -2.27 0.00 0.00 64.05 64.98 1nyn n THR 107 Cb 0.00 -5.73 0.30 0.00 -2.10 0.00 0.00 70.33 62.79 1nyn n THR 107 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1nyn n LYS 108 N 1.89 0.18 0.00 -0.78 5.02 -1.26 -4.75 118.16 118.46 1nyn n LYS 108 Ca 0.00 0.08 0.00 0.00 -2.02 0.00 0.00 58.31 56.37 1nyn n LYS 108 Cb 0.00 -1.64 0.00 0.00 -0.02 0.00 0.00 35.03 33.37 1nyn n LYS 108 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1nyn n ALA 109 N -1.70 0.00 -2.56 7.82 0.00 -1.26 -4.96 120.51 117.86 1nyn n ALA 109 Ca 0.05 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.35 1nyn n ALA 109 Cb 0.40 0.00 0.03 0.00 0.00 0.00 0.00 19.45 19.88 1nyn n ALA 109 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1nyn n TYR 110 N 0.00 1.97 -0.63 0.00 4.01 -1.26 -5.25 117.16 116.00 1nyn n TYR 110 Ca 0.00 -2.61 0.00 0.00 -0.16 0.00 0.00 57.90 55.13 1nyn n TYR 110 Cb 0.00 -0.27 0.00 0.00 -0.31 0.00 0.00 39.34 38.76 1nyn n TYR 110 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69