#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nyn n SER 2 N 0.00 0.00 -3.99 7.83 2.88 -1.26 -5.14 113.62 113.94 1nyn n SER 2 Ca 0.00 0.00 -0.19 0.00 -1.33 0.00 0.00 58.87 57.35 1nyn n SER 2 Cb 0.00 0.00 -0.15 0.00 -0.75 0.00 0.00 64.21 63.31 1nyn n SER 2 CO 0.00 0.00 0.00 0.42 -1.23 0.00 0.00 175.04 174.23 1nyn s THR 3 N 0.00 0.70 0.48 2.46 -4.23 -1.26 -5.15 115.64 108.65 1nyn s THR 3 Ca 0.00 -0.33 -0.03 0.00 -1.18 0.00 0.00 61.69 60.15 1nyn s THR 3 Cb 0.00 -0.63 -0.01 0.00 1.34 0.00 0.00 72.50 73.20 1nyn s THR 3 CO 0.00 0.22 0.75 0.68 -0.54 0.00 0.00 174.62 175.73 1nyn s VAL 4 N 0.15 4.27 0.01 2.29 -7.23 -1.26 -4.82 120.40 113.82 1nyn s VAL 4 Ca -0.02 -0.17 -0.01 0.00 -1.81 0.00 0.00 61.98 59.96 1nyn s VAL 4 Cb -0.07 -3.62 -0.04 0.00 0.56 0.00 0.00 36.38 33.21 1nyn s VAL 4 CO 0.00 -0.53 0.17 -0.89 -0.31 0.00 0.00 175.10 173.54 1nyn s THR 5 N -2.70 5.27 -0.06 5.32 2.01 -0.36 -4.96 115.64 120.15 1nyn s THR 5 Ca 0.49 -0.28 0.04 0.00 0.31 0.00 0.00 61.69 62.24 1nyn s THR 5 Cb -0.10 -3.49 -0.02 0.00 0.01 0.00 0.00 72.50 68.90 1nyn s THR 5 CO 0.41 0.27 -0.19 -0.54 -0.69 0.00 0.00 174.62 173.89 1nyn s LYS 6 N -2.07 2.64 -0.16 4.92 1.02 -1.26 -0.99 119.74 123.84 1nyn s LYS 6 Ca 0.29 -0.79 0.01 0.00 0.02 0.00 0.00 55.97 55.50 1nyn s LYS 6 Cb -0.13 -2.32 0.01 0.00 -0.52 0.00 0.00 37.83 34.88 1nyn s LYS 6 CO 0.20 0.46 -0.19 0.71 -0.92 0.00 0.00 175.35 175.62 1nyn s TYR 7 N -0.33 2.76 0.41 3.18 1.51 -0.68 -4.70 117.35 119.50 1nyn s TYR 7 Ca 0.02 -1.38 -0.03 0.00 -1.01 0.00 0.00 57.07 54.68 1nyn s TYR 7 Cb -0.13 -1.89 -0.04 0.00 -0.11 0.00 0.00 41.96 39.80 1nyn s TYR 7 CO 0.02 -0.66 0.66 -0.06 -1.11 0.00 0.00 175.55 174.41 1nyn s PHE 8 N 1.05 3.53 -0.36 2.71 0.40 -1.25 -0.50 117.98 123.56 1nyn s PHE 8 Ca -0.01 0.59 0.03 0.00 -0.60 0.00 0.00 56.93 56.94 1nyn s PHE 8 Cb -0.14 -2.10 0.15 0.00 0.51 0.00 0.00 43.02 41.43 1nyn s PHE 8 CO -0.06 -0.06 0.36 -0.47 0.70 0.00 0.00 175.22 175.68 1nyn s TYR 9 N -2.50 -0.25 -0.24 0.36 5.04 0.39 -1.01 117.35 119.14 1nyn s TYR 9 Ca 0.44 -0.82 -0.34 0.00 -2.44 0.00 0.00 57.07 53.90 1nyn s TYR 9 Cb -0.10 -0.44 -0.11 0.00 0.35 0.00 0.00 41.96 41.66 1nyn s TYR 9 CO 0.40 -0.96 2.07 1.17 -1.34 0.00 0.00 175.55 176.89 1nyn n LYS 10 N 4.31 1.57 -0.04 4.97 3.00 -1.26 -1.85 118.16 128.86 1nyn n LYS 10 Ca 0.10 0.50 0.00 0.00 -0.00 0.00 0.00 58.31 58.91 1nyn n LYS 10 Cb 0.45 -2.63 0.00 0.00 0.00 0.00 0.00 35.03 32.85 1nyn n LYS 10 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1nyn n GLY 11 N 5.60 -0.25 0.15 3.14 0.00 0.21 -4.90 105.19 109.12 1nyn n GLY 11 Ca 0.33 -1.72 -0.14 0.00 0.00 0.00 0.00 46.02 44.48 1nyn n GLY 11 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1nyn h GLU 12 N 0.00 0.43 0.00 1.61 4.39 -1.92 -3.42 114.58 115.67 1nyn h GLU 12 Ca 0.00 -0.26 0.00 0.00 0.34 0.00 0.00 59.36 59.44 1nyn h GLU 12 Cb 0.00 0.03 0.00 0.00 -0.10 0.00 0.00 28.75 28.68 1nyn h GLU 12 CO 0.00 0.85 -0.75 0.09 -1.16 0.00 0.00 179.01 178.04 1nyn n ASN 13 N -4.44 2.49 -5.01 1.42 4.13 -1.26 -5.08 115.26 107.50 1nyn n ASN 13 Ca -0.06 0.00 -0.20 0.00 1.68 0.00 0.00 54.58 55.99 1nyn n ASN 13 Cb 0.43 0.00 0.05 0.00 -1.54 0.00 0.00 39.78 38.72 1nyn n ASN 13 CO 0.00 0.00 0.00 0.28 0.28 0.00 0.00 177.26 177.82 1nyn s THR 14 N -1.79 2.14 -0.16 3.41 -1.32 -1.26 -5.11 115.64 111.55 1nyn s THR 14 Ca 0.00 -1.07 0.01 0.00 -1.21 0.00 0.00 61.69 59.42 1nyn s THR 14 Cb 0.00 -2.21 0.00 0.00 -1.51 0.00 0.00 72.50 68.78 1nyn s THR 14 CO 0.00 0.00 -0.17 -0.62 -2.21 0.00 0.00 174.62 171.62 1nyn s ASP 15 N -4.59 3.50 -0.20 8.08 -1.08 -1.26 -0.62 116.67 120.49 1nyn s ASP 15 Ca 0.57 -0.52 -0.08 0.00 -0.52 0.00 0.00 52.55 52.01 1nyn s ASP 15 Cb -0.05 -1.53 -0.04 0.00 -1.46 0.00 0.00 42.92 39.83 1nyn s ASP 15 CO 0.36 0.07 0.09 -0.76 0.52 0.00 0.00 175.17 175.45 1nyn s LEU 16 N 0.88 3.87 0.18 -1.34 1.43 -0.77 -4.33 118.68 118.60 1nyn s LEU 16 Ca -0.04 0.07 0.07 0.00 -1.03 0.00 0.00 54.13 53.19 1nyn s LEU 16 Cb -0.15 -2.00 -0.04 0.00 0.03 0.00 0.00 46.19 44.03 1nyn s LEU 16 CO -0.02 0.13 0.05 -0.63 0.23 0.00 0.00 176.35 176.10 1nyn s ILE 17 N 0.67 3.97 0.10 -0.59 1.01 0.02 -0.46 121.20 125.91 1nyn s ILE 17 Ca 0.05 -1.34 0.04 0.00 0.00 0.00 0.00 60.65 59.41 1nyn s ILE 17 Cb -0.13 -3.02 -0.03 0.00 0.01 0.00 0.00 42.46 39.29 1nyn s ILE 17 CO 0.01 -0.13 -0.12 0.68 0.00 0.00 0.00 174.94 175.39 1nyn s VAL 18 N -1.77 1.05 0.21 2.92 -7.23 0.34 -2.67 120.40 113.26 1nyn s VAL 18 Ca 0.29 -1.58 -0.02 0.00 -1.81 0.00 0.00 61.98 58.85 1nyn s VAL 18 Cb -0.09 -1.33 -0.05 0.00 0.56 0.00 0.00 36.38 35.47 1nyn s VAL 18 CO 0.20 -0.46 0.43 -0.36 -0.31 0.00 0.00 175.10 174.60 1nyn s PHE 19 N -2.14 3.48 0.10 2.82 0.40 -1.26 -1.69 117.98 119.69 1nyn s PHE 19 Ca 0.05 0.44 -0.12 0.00 -0.60 0.00 0.00 56.93 56.69 1nyn s PHE 19 Cb -0.05 -1.93 0.02 0.00 0.51 0.00 0.00 43.02 41.57 1nyn s PHE 19 CO 0.01 0.34 0.29 0.00 0.70 0.00 0.00 175.22 176.56 1nyn s ALA 20 N -1.89 -0.58 0.00 5.36 0.00 -0.16 -4.62 121.76 119.87 1nyn s ALA 20 Ca 0.40 -0.29 0.00 0.00 0.00 0.00 0.00 51.96 52.07 1nyn s ALA 20 Cb -0.11 0.54 0.00 0.00 0.00 0.00 0.00 23.12 23.55 1nyn s ALA 20 CO 0.29 -0.55 0.25 0.00 0.00 0.00 0.00 175.76 175.75 1nyn n ALA 21 N -0.03 -0.10 -2.67 0.00 0.00 -1.03 -1.23 120.51 115.46 1nyn n ALA 21 Ca -0.16 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.17 1nyn n ALA 21 Cb 0.62 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 20.00 1nyn n ALA 21 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1nyn s SER 22 N -2.23 0.04 0.44 0.00 0.15 -1.26 -1.82 113.70 109.01 1nyn s SER 22 Ca 0.00 -1.16 0.21 0.00 0.70 0.00 0.00 55.95 55.69 1nyn s SER 22 Cb 0.00 0.48 1.03 0.00 -1.71 0.00 0.00 66.02 65.82 1nyn s SER 22 CO 0.00 -0.98 1.91 -0.08 1.20 0.00 0.00 173.24 175.29 1nyn h GLU 23 N 2.45 0.00 0.00 5.44 4.81 -1.96 -2.81 114.58 122.51 1nyn h GLU 23 Ca -0.31 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.92 1nyn h GLU 23 Cb 1.25 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.63 1nyn h GLU 23 CO 0.45 0.25 0.00 -1.91 -0.73 0.00 0.00 179.01 177.07 1nyn n GLU 24 N -3.76 0.00 -0.51 1.92 2.13 -1.26 -0.87 120.64 118.29 1nyn n GLU 24 Ca -0.01 0.26 0.42 0.00 0.66 0.00 0.00 57.16 58.49 1nyn n GLU 24 Cb 0.35 -1.13 0.71 0.00 0.27 0.00 0.00 31.44 31.65 1nyn n GLU 24 CO 0.00 0.00 0.00 -0.07 -0.41 0.00 0.00 177.13 176.65 1nyn h LEU 25 N 0.00 0.14 0.00 4.31 3.38 -1.98 -1.00 115.31 120.16 1nyn h LEU 25 Ca 0.00 0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.05 1nyn h LEU 25 Cb 0.00 0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.82 1nyn h LEU 25 CO 0.00 -0.10 0.00 0.52 0.09 0.00 0.00 178.44 178.95 1nyn n VAL 26 N -4.39 0.00 -0.33 1.22 0.31 -1.06 -2.07 118.33 112.01 1nyn n VAL 26 Ca 0.38 1.10 0.30 0.00 -0.01 0.00 0.00 64.34 66.12 1nyn n VAL 26 Cb 1.58 -2.08 0.57 0.00 -0.91 0.00 0.00 33.84 32.99 1nyn n VAL 26 CO 0.00 0.00 0.00 -0.78 -1.32 0.00 0.00 176.83 174.73 1nyn h ASP 27 N 0.00 0.36 0.71 4.52 1.82 0.11 0.22 116.42 124.16 1nyn h ASP 27 Ca 0.00 0.24 -0.03 0.00 -0.39 0.00 0.00 57.03 56.85 1nyn h ASP 27 Cb 0.00 0.24 -0.00 0.00 0.68 0.00 0.00 39.33 40.24 1nyn h ASP 27 CO 0.00 -0.36 -0.44 -0.33 -1.61 0.00 0.00 179.24 176.49 1nyn h GLU 28 N 0.08 -1.05 -0.80 0.28 4.39 -1.19 -0.40 114.58 115.89 1nyn h GLU 28 Ca 0.82 0.07 0.15 0.00 0.34 0.00 0.00 59.36 60.74 1nyn h GLU 28 Cb 2.14 0.24 -0.15 0.00 -0.10 0.00 0.00 28.75 30.88 1nyn h GLU 28 CO -0.72 -0.70 -0.28 -0.92 -1.16 0.00 0.00 179.01 175.23 1nyn h TYR 29 N -1.09 -0.69 -0.98 4.33 3.20 0.01 0.75 116.97 122.50 1nyn h TYR 29 Ca -0.09 0.08 0.04 0.00 3.14 0.00 0.00 58.73 61.89 1nyn h TYR 29 Cb 0.88 0.43 -0.06 0.00 1.54 0.00 0.00 36.73 39.52 1nyn h TYR 29 CO -0.11 -0.37 0.64 -0.07 -1.64 0.00 0.00 178.16 176.61 1nyn h LEU 30 N -0.04 1.07 0.00 2.82 3.38 -1.16 0.32 115.31 121.70 1nyn h LEU 30 Ca 0.35 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.31 1nyn h LEU 30 Cb 0.59 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.10 1nyn h LEU 30 CO -0.84 0.73 0.00 0.29 0.09 0.00 0.00 178.44 178.72 1nyn n LYS 31 N -4.46 0.23 -2.67 1.13 4.76 0.25 -4.18 118.16 113.23 1nyn n LYS 31 Ca 0.13 0.13 -0.03 0.00 -2.87 0.00 0.00 58.31 55.67 1nyn n LYS 31 Cb 0.09 -1.50 0.04 0.00 -1.84 0.00 0.00 35.03 31.82 1nyn n LYS 31 CO 0.00 0.00 0.00 -1.71 -1.37 0.00 0.00 177.40 174.32 1nyn n ASN 32 N -1.23 -1.53 -4.56 4.39 5.15 0.80 -5.06 115.26 113.22 1nyn n ASN 32 Ca 0.07 -1.08 -0.45 0.00 -0.60 0.00 0.00 54.58 52.52 1nyn n ASN 32 Cb 0.09 0.78 -0.02 0.00 -0.53 0.00 0.00 39.78 40.10 1nyn n ASN 32 CO 0.00 0.00 0.00 -2.65 1.40 0.00 0.00 177.26 176.01 1nyn n PRO 33 N 2.54 1.12 -3.12 1.20 -0.02 0.60 -4.62 135.00 132.70 1nyn n PRO 33 Ca 0.11 0.39 0.03 0.00 -2.02 0.00 0.00 63.50 62.01 1nyn n PRO 33 Cb 0.65 -1.71 -0.00 0.00 -0.02 0.00 0.00 33.50 32.41 1nyn n PRO 33 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1nyn s SER 34 N -0.65 -1.24 0.57 2.55 0.15 -1.26 -4.99 113.70 108.83 1nyn s SER 34 Ca 0.60 -0.28 0.32 0.00 0.70 0.00 0.00 55.95 57.29 1nyn s SER 34 Cb -0.72 1.66 1.42 0.00 -1.71 0.00 0.00 66.02 66.67 1nyn s SER 34 CO 0.59 -0.18 1.76 -0.29 1.20 0.00 0.00 173.24 176.32 1nyn h ILE 35 N 5.01 0.32 0.00 6.45 2.10 -2.00 1.96 117.51 131.35 1nyn h ILE 35 Ca -0.00 0.00 0.00 0.00 1.08 0.00 0.00 64.86 65.94 1nyn h ILE 35 Cb 1.19 0.43 0.00 0.00 -1.09 0.00 0.00 36.82 37.35 1nyn h ILE 35 CO 0.06 0.00 0.00 0.61 -1.08 0.00 0.00 178.15 177.74 1nyn n GLY 36 N -1.65 -1.11 0.02 8.18 0.00 -1.26 -2.97 105.19 106.40 1nyn n GLY 36 Ca 0.18 -0.07 -0.00 0.00 0.00 0.00 0.00 46.02 46.13 1nyn n GLY 36 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1nyn n LYS 37 N -1.48 1.60 -0.63 1.61 4.81 0.66 -4.55 118.16 120.18 1nyn n LYS 37 Ca 0.05 -0.04 0.48 0.00 -0.87 0.00 0.00 58.31 57.93 1nyn n LYS 37 Cb 0.21 -1.20 0.76 0.00 0.02 0.00 0.00 35.03 34.81 1nyn n LYS 37 CO 0.00 0.00 0.00 -0.11 1.17 0.00 0.00 177.40 178.46 1nyn n LEU 38 N -2.06 0.05 0.01 3.14 7.94 -0.53 -0.88 117.00 124.66 1nyn n LEU 38 Ca -0.08 1.06 -0.00 0.00 -1.11 0.00 0.00 56.01 55.88 1nyn n LEU 38 Cb 0.51 -0.53 -0.00 0.00 0.53 0.00 0.00 43.42 43.93 1nyn n LEU 38 CO 0.17 -1.09 0.48 0.28 -1.11 0.00 0.00 177.39 176.12 1nyn h SER 39 N 0.00 -0.02 -1.31 1.96 0.02 -1.80 0.11 113.55 112.51 1nyn h SER 39 Ca 0.89 0.00 0.45 0.00 -0.84 0.00 0.00 61.79 62.29 1nyn h SER 39 Cb 3.41 0.01 -0.14 0.00 0.14 0.00 0.00 62.40 65.82 1nyn h SER 39 CO -0.13 -0.01 0.84 -0.33 -1.14 0.00 0.00 176.83 176.06 1nyn h GLU 40 N -0.02 0.06 0.00 3.45 5.08 -1.32 -1.61 114.58 120.21 1nyn h GLU 40 Ca -0.00 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1nyn h GLU 40 Cb 0.02 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.26 1nyn h GLU 40 CO 0.00 0.04 0.00 0.28 -1.00 0.00 0.00 179.01 178.33 1nyn n VAL 41 N -4.76 0.00 -2.97 3.13 0.31 -1.00 -4.69 118.33 108.35 1nyn n VAL 41 Ca 0.38 0.99 -0.40 0.00 -0.01 0.00 0.00 64.34 65.31 1nyn n VAL 41 Cb 1.46 -1.95 -0.04 0.00 -0.91 0.00 0.00 33.84 32.40 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 -1.94 4.99 -0.13 2.52 1.01 0.36 -2.46 120.40 124.74 1nyn s VAL 42 Ca 0.00 1.58 0.13 0.00 0.00 0.00 0.00 61.98 63.69 1nyn s VAL 42 Cb 0.00 -4.10 -0.24 0.00 0.00 0.00 0.00 36.38 32.04 1nyn s VAL 42 CO 0.00 0.24 0.32 -1.84 0.00 0.00 0.00 175.10 173.82 1nyn n GLU 43 N 3.74 0.67 -3.98 2.72 0.28 -1.26 -4.53 120.64 118.27 1nyn n GLU 43 Ca 0.00 0.15 -0.35 0.00 -0.16 0.00 0.00 57.16 56.80 1nyn n GLU 43 Cb 0.51 -1.65 -0.14 0.00 1.43 0.00 0.00 31.44 31.60 1nyn n GLU 43 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 177.13 176.46 1nyn s LEU 44 N -5.93 2.98 -1.21 -1.84 1.02 -1.26 -5.03 118.68 107.40 1nyn s LEU 44 Ca -0.11 -0.34 -0.12 0.00 0.02 0.00 0.00 54.13 53.58 1nyn s LEU 44 Cb 0.07 -1.76 0.19 0.00 0.02 0.00 0.00 46.19 44.72 1nyn s LEU 44 CO 0.81 0.00 1.48 0.49 0.02 0.00 0.00 176.35 179.15 1nyn n PHE 45 N 4.63 4.50 -3.61 0.29 3.01 -1.26 -4.75 117.46 120.27 1nyn n PHE 45 Ca -0.18 -3.29 -0.11 0.00 1.01 0.00 0.00 57.45 54.87 1nyn n PHE 45 Cb 0.51 -2.03 -0.06 0.00 -0.01 0.00 0.00 39.48 37.89 1nyn n PHE 45 CO 0.00 0.00 0.00 -2.00 1.01 0.00 0.00 176.76 175.77 1nyn s GLU 46 N 0.71 0.65 -0.19 -1.08 2.12 -1.26 -5.13 118.70 114.52 1nyn s GLU 46 Ca 0.40 0.50 -0.14 0.00 0.36 0.00 0.00 54.97 56.10 1nyn s GLU 46 Cb -0.01 0.31 -0.04 0.00 0.26 0.00 0.00 34.13 34.65 1nyn s GLU 46 CO -0.00 -0.13 0.29 0.08 -0.54 0.00 0.00 175.26 174.95 1nyn s VAL 47 N -0.28 5.29 0.17 3.70 1.01 -1.26 -4.72 120.40 124.32 1nyn s VAL 47 Ca -0.00 0.50 0.08 0.00 0.00 0.00 0.00 61.98 62.56 1nyn s VAL 47 Cb -0.03 -3.63 -0.04 0.00 0.00 0.00 0.00 36.38 32.68 1nyn s VAL 47 CO -0.01 0.33 -0.07 -0.36 0.00 0.00 0.00 175.10 175.00 1nyn s PHE 48 N 0.89 2.70 0.19 5.22 0.08 -1.09 -3.16 117.98 122.81 1nyn s PHE 48 Ca 0.15 -0.19 0.03 0.00 0.12 0.00 0.00 56.93 57.04 1nyn s PHE 48 Cb -0.14 -1.32 -0.05 0.00 -0.57 0.00 0.00 43.02 40.94 1nyn s PHE 48 CO 0.05 0.51 -0.02 0.95 -0.10 0.00 0.00 175.22 176.61 1nyn s THR 49 N -1.68 0.90 0.18 0.64 -4.23 -0.53 -0.80 115.64 110.11 1nyn s THR 49 Ca 0.25 -2.01 -0.02 0.00 -1.18 0.00 0.00 61.69 58.73 1nyn s THR 49 Cb -0.09 -2.16 0.02 0.00 1.34 0.00 0.00 72.50 71.61 1nyn s THR 49 CO 0.16 -0.46 0.06 -2.65 -0.54 0.00 0.00 174.62 171.19 1nyn n PRO 50 N -0.30 0.75 -2.70 3.99 -0.02 -1.26 -0.69 135.00 134.77 1nyn n PRO 50 Ca -0.07 -0.09 -0.21 0.00 -2.02 0.00 0.00 63.50 61.11 1nyn n PRO 50 Cb 0.63 -0.30 0.06 0.00 -0.02 0.00 0.00 33.50 33.87 1nyn n PRO 50 CO 0.00 0.00 0.00 1.14 1.98 0.00 0.00 175.50 178.62 1nyn s GLN 51 N -1.28 2.32 -0.22 -0.52 -2.07 -1.25 -3.39 119.66 113.25 1nyn s GLN 51 Ca 0.04 -1.00 -0.01 0.00 -1.82 0.00 0.00 55.36 52.57 1nyn s GLN 51 Cb -0.01 -2.49 -0.02 0.00 -1.09 0.00 0.00 33.01 29.41 1nyn s GLN 51 CO 0.04 -0.88 1.26 -0.40 -1.32 0.00 0.00 175.29 173.99 1nyn n ASP 52 N -2.42 1.25 0.00 12.60 5.68 -1.26 -4.60 116.55 127.81 1nyn n ASP 52 Ca 0.11 -2.05 0.00 0.00 -0.50 0.00 0.00 54.79 52.35 1nyn n ASP 52 Cb 0.60 -0.62 0.00 0.00 -1.14 0.00 0.00 41.12 39.96 1nyn n ASP 52 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1nyn n GLY 53 N 3.86 -0.49 3.71 6.12 0.00 -1.26 -5.10 105.19 112.04 1nyn n GLY 53 Ca 0.11 -1.33 -0.39 0.00 0.00 0.00 0.00 46.02 44.40 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 -2.00 4.38 0.00 1.61 1.81 -1.26 -4.92 118.95 118.58 1nyn s ARG 54 Ca 0.00 0.74 0.00 0.00 -1.72 0.00 0.00 55.73 54.75 1nyn s ARG 54 Cb 0.00 -3.46 0.00 0.00 -0.45 0.00 0.00 34.95 31.04 1nyn s ARG 54 CO 0.00 0.05 0.00 0.41 -0.68 0.00 0.00 175.30 175.08 1nyn n GLY 55 N 3.23 3.33 0.11 -3.53 0.00 -1.26 -5.00 105.19 102.08 1nyn n GLY 55 Ca -0.03 -0.35 0.12 0.00 0.00 0.00 0.00 46.02 45.76 1nyn n GLY 55 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nyn h ALA 56 N 0.00 0.74 0.00 4.61 0.00 -1.98 -3.22 119.26 119.41 1nyn h ALA 56 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1nyn h ALA 56 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1nyn h ALA 56 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 179.25 179.64 1nyn n GLU 57 N -2.44 0.04 0.00 0.00 -0.58 -1.26 -4.71 120.64 111.70 1nyn n GLU 57 Ca 0.03 0.16 0.00 0.00 -0.42 0.00 0.00 57.16 56.93 1nyn n GLU 57 Cb 0.47 -1.57 0.00 0.00 -0.57 0.00 0.00 31.44 29.78 1nyn n GLU 57 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1nyn n GLY 58 N 0.78 -2.81 3.09 0.62 0.00 -1.22 -4.91 105.19 100.75 1nyn n GLY 58 Ca 0.05 -0.96 -0.36 0.00 0.00 0.00 0.00 46.02 44.76 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 2.25 0.49 1.61 2.02 -1.26 -5.00 118.70 118.81 1nyn s GLU 59 Ca 0.00 -2.23 -0.17 0.00 0.02 0.00 0.00 54.97 52.60 1nyn s GLU 59 Cb 0.00 -3.62 -0.14 0.00 0.10 0.00 0.00 34.13 30.47 1nyn s GLU 59 CO 0.00 -1.12 -0.16 1.28 0.02 0.00 0.00 175.26 175.28 1nyn n LEU 60 N 3.93 -3.53 0.00 1.80 4.77 -1.26 -4.58 117.00 118.13 1nyn n LEU 60 Ca 0.03 0.57 -0.13 0.00 -0.03 0.00 0.00 56.01 56.46 1nyn n LEU 60 Cb 0.39 -0.78 -0.03 0.00 -2.33 0.00 0.00 43.42 40.68 1nyn n LEU 60 CO 0.33 -4.49 -0.09 0.61 -1.33 0.00 0.00 177.39 172.42 1nyn n GLY 61 N 2.37 3.93 3.68 -0.72 0.00 0.13 -4.88 105.19 109.71 1nyn n GLY 61 Ca 0.07 -2.25 -0.29 0.00 0.00 0.00 0.00 46.02 43.54 1nyn n GLY 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nyn s ALA 62 N -2.36 3.28 -0.11 4.61 0.00 -1.26 -1.45 121.76 124.46 1nyn s ALA 62 Ca 0.01 -1.17 -0.15 0.00 0.00 0.00 0.00 51.96 50.65 1nyn s ALA 62 Cb 0.00 -1.15 -0.05 0.00 0.00 0.00 0.00 23.12 21.92 1nyn s ALA 62 CO 0.01 0.65 0.35 0.00 0.00 0.00 0.00 175.76 176.76 1nyn s ALA 63 N -1.40 3.61 0.47 0.00 0.00 -1.19 -4.85 121.76 118.40 1nyn s ALA 63 Ca 0.26 -0.36 -0.21 0.00 0.00 0.00 0.00 51.96 51.66 1nyn s ALA 63 Cb -0.11 -2.42 -0.08 0.00 0.00 0.00 0.00 23.12 20.50 1nyn s ALA 63 CO 0.18 0.19 1.05 0.45 0.00 0.00 0.00 175.76 177.63 1nyn s SER 64 N 0.07 6.39 0.23 0.00 0.15 -1.26 -4.80 113.70 114.47 1nyn s SER 64 Ca 0.20 1.96 -0.14 0.00 0.70 0.00 0.00 55.95 58.67 1nyn s SER 64 Cb -0.14 -2.57 0.28 0.00 -1.71 0.00 0.00 66.02 61.89 1nyn s SER 64 CO 0.07 -0.75 1.59 0.11 1.20 0.00 0.00 173.24 175.46 1nyn h LYS 65 N 1.71 -0.03 -1.01 5.44 1.57 -1.99 1.18 116.57 123.43 1nyn h LYS 65 Ca -0.49 0.00 0.26 0.00 -1.87 0.00 0.00 60.65 58.55 1nyn h LYS 65 Cb 1.22 0.01 -0.08 0.00 0.08 0.00 0.00 32.23 33.46 1nyn h LYS 65 CO 0.59 -0.02 0.67 0.00 -0.57 0.00 0.00 179.45 180.12 1nyn h ALA 66 N 1.58 2.36 -0.12 3.86 0.00 -2.00 0.40 119.26 125.35 1nyn h ALA 66 Ca 0.35 0.03 -0.19 0.00 0.00 0.00 0.00 54.91 55.10 1nyn h ALA 66 Cb 0.58 0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.40 1nyn h ALA 66 CO -0.82 -0.72 -0.71 0.37 0.00 0.00 0.00 179.25 177.37 1nyn h GLN 67 N 0.33 0.55 -0.28 0.00 4.15 0.11 -3.08 115.11 116.89 1nyn h GLN 67 Ca 0.55 -0.43 -0.08 0.00 0.77 0.00 0.00 58.65 59.46 1nyn h GLN 67 Cb 1.52 0.08 -0.02 0.00 0.21 0.00 0.00 27.48 29.28 1nyn h GLN 67 CO -0.22 1.05 -0.17 0.28 -1.93 0.00 0.00 178.83 177.85 1nyn h VAL 68 N 0.39 1.24 0.00 2.39 2.07 0.65 -2.22 116.25 120.77 1nyn h VAL 68 Ca -0.03 -1.10 -0.03 0.00 0.82 0.00 0.00 66.70 66.36 1nyn h VAL 68 Cb 1.30 1.21 -0.00 0.00 -1.52 0.00 0.00 31.29 32.28 1nyn h VAL 68 CO 0.13 0.35 -0.15 -0.33 0.02 0.00 0.00 177.57 177.59 1nyn h GLU 69 N 0.44 0.00 0.00 1.57 5.08 -1.12 -1.62 114.58 118.93 1nyn h GLU 69 Ca 0.08 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.44 1nyn h GLU 69 Cb 0.55 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.80 1nyn h GLU 69 CO 0.04 0.15 0.35 -0.91 -1.00 0.00 0.00 179.01 177.64 1nyn h ASN 70 N 0.00 0.00 0.00 1.42 4.21 -1.38 -3.30 115.58 116.54 1nyn h ASN 70 Ca -0.00 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.51 1nyn h ASN 70 Cb 0.29 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.49 1nyn h ASN 70 CO 0.02 0.00 0.00 -0.62 -1.29 0.00 0.00 177.43 175.54 1nyn n GLU 71 N -2.82 0.00 -3.03 0.81 4.71 -0.64 -4.73 120.64 114.93 1nyn n GLU 71 Ca -0.02 0.00 -0.17 0.00 -0.01 0.00 0.00 57.16 56.96 1nyn n GLU 71 Cb 0.39 -0.11 -0.03 0.00 -1.01 0.00 0.00 31.44 30.68 1nyn n GLU 71 CO 0.00 0.00 0.00 1.97 0.09 0.00 0.00 177.13 179.19 1nyn n PHE 72 N -2.09 -1.77 -0.76 -0.32 1.16 -1.01 -4.90 117.46 107.76 1nyn n PHE 72 Ca 0.00 -2.72 0.00 0.00 -1.87 0.00 0.00 57.45 52.86 1nyn n PHE 72 Cb 0.00 0.54 0.00 0.00 -1.61 0.00 0.00 39.48 38.41 1nyn n PHE 72 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 1nyn n GLY 73 N 1.85 0.30 0.31 4.97 0.00 -1.21 -4.58 105.19 106.84 1nyn n GLY 73 Ca 0.18 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.27 1nyn n GLY 73 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1nyn n LYS 74 N -0.01 -0.08 0.00 1.61 3.00 -1.26 -3.47 118.16 117.96 1nyn n LYS 74 Ca 0.00 1.35 0.00 0.00 -0.00 0.00 0.00 58.31 59.66 1nyn n LYS 74 Cb 0.20 -2.03 0.00 0.00 0.00 0.00 0.00 35.03 33.20 1nyn n LYS 74 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 1nyn n GLY 75 N -1.53 0.18 2.26 3.14 0.00 -1.26 -5.11 105.19 102.87 1nyn n GLY 75 Ca 0.15 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.99 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 0.00 -1.44 0.00 1.61 5.02 -1.23 -5.09 118.16 117.03 1nyn n LYS 76 Ca 0.00 -1.17 0.00 0.00 -2.02 0.00 0.00 58.31 55.12 1nyn n LYS 76 Cb 0.33 -0.90 0.00 0.00 -0.02 0.00 0.00 35.03 34.44 1nyn n LYS 76 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1nyn n LYS 77 N -3.07 3.09 -0.03 1.97 5.02 -1.26 -4.91 118.16 118.97 1nyn n LYS 77 Ca 0.10 0.00 0.02 0.00 -2.02 0.00 0.00 58.31 56.41 1nyn n LYS 77 Cb 0.35 0.00 -0.12 0.00 -0.02 0.00 0.00 35.03 35.24 1nyn n LYS 77 CO 0.00 0.00 0.00 1.51 -0.52 0.00 0.00 177.40 178.39 1nyn n ILE 78 N 0.00 0.40 0.09 -0.18 0.13 -1.26 -4.21 119.36 114.33 1nyn n ILE 78 Ca 0.00 -0.47 -0.04 0.00 -1.10 0.00 0.00 62.75 61.14 1nyn n ILE 78 Cb 0.00 -0.16 -0.02 0.00 -0.84 0.00 0.00 39.64 38.62 1nyn n ILE 78 CO 0.00 0.00 0.00 1.05 2.80 0.00 0.00 176.55 180.40 1nyn h GLU 79 N 0.00 -0.26 -0.53 9.51 4.11 -1.99 -2.93 114.58 122.49 1nyn h GLU 79 Ca -0.16 0.02 0.10 0.00 0.07 0.00 0.00 59.36 59.39 1nyn h GLU 79 Cb 1.20 0.06 -0.11 0.00 0.50 0.00 0.00 28.75 30.40 1nyn h GLU 79 CO 0.01 -0.17 -0.29 0.93 0.07 0.00 0.00 179.01 179.56 1nyn h GLU 80 N -0.66 -0.15 -0.59 1.06 5.08 -1.99 -0.47 114.58 116.87 1nyn h GLU 80 Ca -0.03 0.01 0.07 0.00 -1.00 0.00 0.00 59.36 58.41 1nyn h GLU 80 Cb 0.21 0.03 -0.10 0.00 0.50 0.00 0.00 28.75 29.39 1nyn h GLU 80 CO 0.05 -0.10 -0.53 0.28 -1.00 0.00 0.00 179.01 177.71 1nyn h VAL 81 N -0.16 0.02 -0.05 3.13 2.07 -1.73 1.54 116.25 121.08 1nyn h VAL 81 Ca 0.23 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.76 1nyn h VAL 81 Cb 0.52 0.02 -0.00 0.00 -1.52 0.00 0.00 31.29 30.32 1nyn h VAL 81 CO -0.62 0.00 0.11 0.40 0.02 0.00 0.00 177.57 177.48 1nyn h ILE 82 N -0.26 0.22 0.48 4.57 2.04 -1.00 -2.60 117.51 120.97 1nyn h ILE 82 Ca 0.13 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.96 1nyn h ILE 82 Cb 0.55 0.90 0.00 0.00 -0.74 0.00 0.00 36.82 37.54 1nyn h ILE 82 CO -0.70 0.00 -0.23 -0.78 0.00 0.00 0.00 178.15 176.44 1nyn h ASP 83 N 0.00 -0.55 -0.71 1.72 1.82 0.37 -1.05 116.42 118.02 1nyn h ASP 83 Ca 0.02 0.02 0.15 0.00 -0.39 0.00 0.00 57.03 56.83 1nyn h ASP 83 Cb 0.24 0.14 -0.11 0.00 0.68 0.00 0.00 39.33 40.28 1nyn h ASP 83 CO -0.00 -0.19 0.15 -0.07 -1.61 0.00 0.00 179.24 177.52 1nyn h LEU 84 N -1.07 -0.03 0.84 2.28 3.38 -0.91 -0.93 115.31 118.87 1nyn h LEU 84 Ca -0.07 0.14 -0.04 0.00 0.09 0.00 0.00 57.88 58.01 1nyn h LEU 84 Cb 0.50 0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.45 1nyn h LEU 84 CO 0.11 -0.04 -0.46 0.40 0.09 0.00 0.00 178.44 178.53 1nyn h ILE 85 N 0.25 0.07 -1.24 1.22 2.04 -1.50 -1.77 117.51 116.57 1nyn h ILE 85 Ca 0.40 0.00 0.36 0.00 1.00 0.00 0.00 64.86 66.61 1nyn h ILE 85 Cb 0.66 0.07 -0.09 0.00 -0.74 0.00 0.00 36.82 36.72 1nyn h ILE 85 CO -0.51 0.00 0.84 -0.07 0.00 0.00 0.00 178.15 178.41 1nyn h LEU 86 N -1.20 0.22 -0.27 1.44 3.38 -0.34 -2.13 115.31 116.41 1nyn h LEU 86 Ca -0.11 0.06 0.02 0.00 0.09 0.00 0.00 57.88 57.95 1nyn h LEU 86 Cb 0.95 0.04 -0.03 0.00 0.09 0.00 0.00 40.66 41.70 1nyn h LEU 86 CO 0.15 -0.02 -0.16 -1.14 0.09 0.00 0.00 178.44 177.36 1nyn n ARG 87 N -4.45 -0.12 -2.71 1.13 0.63 -0.43 -4.38 116.66 106.32 1nyn n ARG 87 Ca 0.30 0.93 -0.05 0.00 -0.92 0.00 0.00 57.85 58.11 1nyn n ARG 87 Cb 1.23 -1.38 0.04 0.00 0.45 0.00 0.00 32.46 32.80 1nyn n ARG 87 CO 0.00 0.00 0.00 0.09 -2.51 0.00 0.00 177.63 175.21 1nyn n ASN 88 N -3.53 -2.35 0.00 6.15 4.13 -0.82 -5.06 115.26 113.78 1nyn n ASN 88 Ca 0.01 -2.24 0.00 0.00 1.68 0.00 0.00 54.58 54.02 1nyn n ASN 88 Cb 0.07 1.29 0.00 0.00 -1.54 0.00 0.00 39.78 39.60 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 2.25 -1.57 2.62 7.41 0.00 -1.10 -4.97 105.19 109.84 1nyn n GLY 89 Ca 0.11 -0.16 -0.23 0.00 0.00 0.00 0.00 46.02 45.74 1nyn n GLY 89 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nyn s LYS 90 N 0.00 0.50 1.03 1.61 1.02 -0.18 -4.95 119.74 118.76 1nyn s LYS 90 Ca 0.00 -0.89 -0.18 0.00 0.02 0.00 0.00 55.97 54.92 1nyn s LYS 90 Cb 0.00 -0.99 -0.00 0.00 -0.52 0.00 0.00 37.83 36.32 1nyn s LYS 90 CO 0.00 -1.15 -0.24 -2.30 -0.92 0.00 0.00 175.35 170.74 1nyn n PRO 91 N 4.46 -0.71 -5.29 -1.68 -0.02 -1.26 -3.77 135.00 126.73 1nyn n PRO 91 Ca 0.07 -0.19 -0.31 0.00 -2.02 0.00 0.00 63.50 61.05 1nyn n PRO 91 Cb 0.42 -1.53 -0.16 0.00 -0.02 0.00 0.00 33.50 32.20 1nyn n PRO 91 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1nyn s ASN 92 N -1.64 3.08 0.00 2.55 2.20 -1.26 -4.93 114.94 114.95 1nyn s ASN 92 Ca 0.51 -0.46 -0.20 0.00 -0.94 0.00 0.00 52.86 51.77 1nyn s ASN 92 Cb -0.12 -0.39 -0.11 0.00 -2.00 0.00 0.00 41.25 38.63 1nyn s ASN 92 CO 0.69 0.32 0.94 0.28 -2.94 0.00 0.00 177.10 176.39 1nyn h SER 93 N 5.52 -0.60 -5.00 3.54 0.02 -2.01 -3.48 113.55 111.54 1nyn h SER 93 Ca -0.42 0.02 0.14 0.00 -0.84 0.00 0.00 61.79 60.68 1nyn h SER 93 Cb 1.12 0.16 -0.11 0.00 0.14 0.00 0.00 62.40 63.71 1nyn h SER 93 CO 0.47 -0.29 0.47 0.28 -1.14 0.00 0.00 176.83 176.62 1nyn s THR 94 N -4.00 0.00 -0.80 -2.27 -1.32 -1.26 -5.06 115.64 100.93 1nyn s THR 94 Ca -0.10 -0.34 0.01 0.00 -1.21 0.00 0.00 61.69 60.04 1nyn s THR 94 Cb 0.01 -1.50 0.35 0.00 -1.51 0.00 0.00 72.50 69.84 1nyn s THR 94 CO 0.31 0.00 1.58 0.41 -2.21 0.00 0.00 174.62 174.71 1nyn n THR 95 N -0.37 4.30 -0.56 5.08 -1.04 -1.26 -5.04 114.28 115.38 1nyn n THR 95 Ca -0.08 -5.34 -0.29 0.00 -2.04 0.00 0.00 64.05 56.30 1nyn n THR 95 Cb 0.61 -1.40 0.20 0.00 -1.82 0.00 0.00 70.33 67.92 1nyn n THR 95 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 1nyn n SER 96 N -0.28 -2.64 0.00 8.00 2.88 -1.26 -4.93 113.62 115.39 1nyn n SER 96 Ca 0.44 -0.28 0.00 0.00 -1.33 0.00 0.00 58.87 57.70 1nyn n SER 96 Cb 0.34 -0.96 0.00 0.00 -0.75 0.00 0.00 64.21 62.84 1nyn n SER 96 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 1nyn n SER 97 N -2.52 0.00 0.03 -3.46 7.64 -1.26 -4.94 113.62 109.11 1nyn n SER 97 Ca 0.03 0.00 0.12 0.00 1.01 0.00 0.00 58.87 60.03 1nyn n SER 97 Cb 0.56 0.06 0.11 0.00 -1.01 0.00 0.00 64.21 63.93 1nyn n SER 97 CO 0.00 0.00 0.00 0.18 -3.01 0.00 0.00 175.04 172.21 1nyn n LEU 98 N -1.07 0.63 0.00 -3.43 4.32 -1.26 -4.90 117.00 111.29 1nyn n LEU 98 Ca 0.00 0.06 0.00 0.00 -0.02 0.00 0.00 56.01 56.05 1nyn n LEU 98 Cb 0.00 -0.15 0.00 0.00 -1.62 0.00 0.00 43.42 41.65 1nyn n LEU 98 CO 0.00 0.03 0.00 0.29 -1.22 0.00 0.00 177.39 176.49 1nyn n LYS 99 N -1.92 0.87 -0.95 3.23 5.02 -1.26 -5.08 118.16 118.06 1nyn n LYS 99 Ca 0.03 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.32 1nyn n LYS 99 Cb 0.42 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.43 1nyn n LYS 99 CO 0.00 0.00 0.00 -2.37 -0.52 0.00 0.00 177.40 174.51 1nyn n THR 100 N -0.89 0.00 -0.73 -0.18 5.66 -1.26 -5.16 114.28 111.72 1nyn n THR 100 Ca 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 61.00 1nyn n THR 100 Cb 0.00 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 68.78 1nyn n THR 100 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 1nyn n LYS 101 N 0.00 2.15 0.00 1.09 5.02 -1.26 -5.08 118.16 120.09 1nyn n LYS 101 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1nyn n LYS 101 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 1nyn n LYS 101 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1nyn n GLY 102 N 5.00 3.54 1.90 0.72 0.00 -1.26 -5.12 105.19 109.98 1nyn n GLY 102 Ca 0.00 -1.83 -0.00 0.00 0.00 0.00 0.00 46.02 44.18 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 -1.36 -3.00 0.23 -0.02 0.00 -1.26 -5.05 105.19 94.73 1nyn n GLY 103 Ca 0.00 0.03 0.00 0.00 0.00 0.00 0.00 46.02 46.05 1nyn n GLY 103 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1nyn n ASN 104 N 0.14 0.00 -2.80 1.61 4.05 -1.26 -5.02 115.26 111.98 1nyn n ASN 104 Ca 0.01 0.00 -0.16 0.00 0.45 0.00 0.00 54.58 54.88 1nyn n ASN 104 Cb 0.02 0.05 0.00 0.00 1.23 0.00 0.00 39.78 41.08 1nyn n ASN 104 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1nyn n ALA 105 N -1.17 3.40 -0.89 5.20 0.00 -1.26 -5.10 120.51 120.69 1nyn n ALA 105 Ca 0.00 -3.53 0.01 0.00 0.00 0.00 0.00 53.44 49.92 1nyn n ALA 105 Cb 0.00 -0.86 -0.01 0.00 0.00 0.00 0.00 19.45 18.59 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 -0.05 -3.47 0.01 0.00 0.00 -1.26 -4.32 105.19 96.09 1nyn n GLY 106 Ca 0.20 -1.07 0.07 0.00 0.00 0.00 0.00 46.02 45.22 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 -2.29 0.01 -1.49 2.61 -2.24 -1.26 -4.71 114.28 104.90 1nyn n THR 107 Ca -0.01 -0.32 0.00 0.00 -2.27 0.00 0.00 64.05 61.45 1nyn n THR 107 Cb 0.29 0.17 0.00 0.00 -2.10 0.00 0.00 70.33 68.70 1nyn n THR 107 CO 0.00 0.00 0.00 1.17 -0.57 0.00 0.00 175.07 175.67 1nyn n LYS 108 N -1.99 0.00 0.00 -0.78 4.81 -1.26 -5.03 118.16 113.91 1nyn n LYS 108 Ca -0.03 -0.10 0.00 0.00 -0.87 0.00 0.00 58.31 57.32 1nyn n LYS 108 Cb 0.37 -0.25 0.00 0.00 0.02 0.00 0.00 35.03 35.17 1nyn n LYS 108 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1nyn n ALA 109 N 0.00 0.00 -2.93 3.14 0.00 -1.26 -5.00 120.51 114.46 1nyn n ALA 109 Ca 0.00 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.11 1nyn n ALA 109 Cb 0.35 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.67 1nyn n ALA 109 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 1nyn s TYR 110 N 0.27 2.90 0.00 0.00 1.51 -1.26 -5.10 117.35 115.67 1nyn s TYR 110 Ca 0.00 -0.40 0.00 0.00 -1.01 0.00 0.00 57.07 55.66 1nyn s TYR 110 Cb 0.00 -1.86 0.00 0.00 -0.11 0.00 0.00 41.96 39.99 1nyn s TYR 110 CO 0.00 -0.05 0.10 0.27 -1.11 0.00 0.00 175.55 174.76