#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 0.24 -2.78 6.12 7.64 -1.26 -4.90 113.62 118.67 1nyn n SER 2 Ca 0.00 -0.62 -0.02 0.00 1.01 0.00 0.00 58.87 59.25 1nyn n SER 2 Cb 0.00 0.96 0.02 0.00 -1.01 0.00 0.00 64.21 64.18 1nyn n SER 2 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 1nyn s THR 3 N -1.33 -0.47 0.00 0.44 2.01 -1.26 -5.17 115.64 109.86 1nyn s THR 3 Ca 0.02 -0.30 0.00 0.00 0.31 0.00 0.00 61.69 61.71 1nyn s THR 3 Cb 0.03 0.00 0.00 0.00 0.01 0.00 0.00 72.50 72.54 1nyn s THR 3 CO 0.16 0.00 0.00 1.33 -0.69 0.00 0.00 174.62 175.42 1nyn n VAL 4 N 3.15 0.00 -4.67 3.82 0.24 -1.26 -5.09 118.33 114.51 1nyn n VAL 4 Ca 0.11 0.00 -0.33 0.00 -2.04 0.00 0.00 64.34 62.08 1nyn n VAL 4 Cb 0.62 0.00 -0.13 0.00 -1.47 0.00 0.00 33.84 32.86 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 -1.34 3.39 -0.28 3.34 2.01 -1.23 -5.02 115.64 116.51 1nyn s THR 5 Ca 0.00 -0.56 -0.08 0.00 0.31 0.00 0.00 61.69 61.36 1nyn s THR 5 Cb 0.00 -2.42 -0.01 0.00 0.01 0.00 0.00 72.50 70.08 1nyn s THR 5 CO 0.00 0.54 0.09 -0.54 -0.69 0.00 0.00 174.62 174.03 1nyn s LYS 6 N -0.05 3.44 -0.15 4.92 1.02 -1.26 -1.37 119.74 126.29 1nyn s LYS 6 Ca -0.01 -0.63 -0.21 0.00 0.02 0.00 0.00 55.97 55.14 1nyn s LYS 6 Cb -0.14 -3.40 -0.03 0.00 -0.52 0.00 0.00 37.83 33.74 1nyn s LYS 6 CO 0.03 -0.31 0.60 0.71 -0.92 0.00 0.00 175.35 175.46 1nyn s TYR 7 N 1.59 3.46 0.45 3.18 1.51 -0.91 -4.93 117.35 121.69 1nyn s TYR 7 Ca 0.05 0.98 -0.04 0.00 -1.01 0.00 0.00 57.07 57.06 1nyn s TYR 7 Cb -0.16 -2.72 -0.03 0.00 -0.11 0.00 0.00 41.96 38.93 1nyn s TYR 7 CO 0.04 -0.01 0.72 -0.06 -1.11 0.00 0.00 175.55 175.13 1nyn s PHE 8 N 1.28 3.54 -0.26 2.71 0.40 -1.26 -2.00 117.98 122.39 1nyn s PHE 8 Ca 0.30 0.68 -0.01 0.00 -0.60 0.00 0.00 56.93 57.29 1nyn s PHE 8 Cb -0.16 -2.20 0.14 0.00 0.51 0.00 0.00 43.02 41.31 1nyn s PHE 8 CO 0.12 -0.18 0.37 -0.47 0.70 0.00 0.00 175.22 175.76 1nyn s TYR 9 N -2.63 -0.80 0.00 0.36 6.14 -0.65 0.33 117.35 120.10 1nyn s TYR 9 Ca 0.45 0.51 -0.30 0.00 0.64 0.00 0.00 57.07 58.37 1nyn s TYR 9 Cb -0.10 -0.12 -0.05 0.00 0.42 0.00 0.00 41.96 42.11 1nyn s TYR 9 CO 0.42 -0.82 1.31 0.21 0.64 0.00 0.00 175.55 177.32 1nyn s LYS 10 N 2.51 4.33 0.00 4.97 2.36 -1.26 -2.14 119.74 130.50 1nyn s LYS 10 Ca 0.11 1.86 0.00 0.00 -2.55 0.00 0.00 55.97 55.39 1nyn s LYS 10 Cb -0.14 -3.51 0.00 0.00 -1.05 0.00 0.00 37.83 33.13 1nyn s LYS 10 CO -0.22 -0.48 0.00 0.41 1.55 0.00 0.00 175.35 176.61 1nyn n GLY 11 N 3.49 1.85 0.16 5.54 0.00 -0.98 -4.97 105.19 110.28 1nyn n GLY 11 Ca 0.12 -1.87 -0.02 0.00 0.00 0.00 0.00 46.02 44.25 1nyn n GLY 11 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1nyn h GLU 12 N 0.00 0.12 0.00 1.61 4.81 -1.93 -3.44 114.58 115.75 1nyn h GLU 12 Ca 0.00 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.16 1nyn h GLU 12 Cb 0.00 0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.39 1nyn h GLU 12 CO 0.00 0.63 0.00 0.09 -0.73 0.00 0.00 179.01 179.00 1nyn n ASN 13 N -3.91 -0.31 -4.84 1.04 3.02 -1.26 -5.12 115.26 103.87 1nyn n ASN 13 Ca -0.02 0.08 -0.29 0.00 -0.03 0.00 0.00 54.58 54.33 1nyn n ASN 13 Cb 0.56 0.60 0.11 0.00 -0.61 0.00 0.00 39.78 40.43 1nyn n ASN 13 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 1nyn s THR 14 N -2.00 2.11 -0.08 3.41 -1.32 -1.26 -5.06 115.64 111.44 1nyn s THR 14 Ca 0.00 0.04 0.03 0.00 -1.21 0.00 0.00 61.69 60.55 1nyn s THR 14 Cb 0.00 -2.91 -0.02 0.00 -1.51 0.00 0.00 72.50 68.07 1nyn s THR 14 CO 0.00 -0.05 -0.18 -0.62 -2.21 0.00 0.00 174.62 171.56 1nyn s ASP 15 N -4.28 3.62 -0.09 8.08 2.15 -1.26 -2.33 116.67 122.56 1nyn s ASP 15 Ca 0.63 -0.37 0.00 0.00 0.43 0.00 0.00 52.55 53.24 1nyn s ASP 15 Cb -0.13 -1.09 -0.03 0.00 -0.30 0.00 0.00 42.92 41.37 1nyn s ASP 15 CO 0.51 0.25 -0.08 -0.76 -0.17 0.00 0.00 175.17 174.92 1nyn s LEU 16 N -0.15 3.05 -0.11 -1.34 1.43 -0.91 -4.64 118.68 116.01 1nyn s LEU 16 Ca -0.02 -0.12 0.02 0.00 -1.03 0.00 0.00 54.13 52.98 1nyn s LEU 16 Cb -0.14 -1.68 -0.01 0.00 0.03 0.00 0.00 46.19 44.39 1nyn s LEU 16 CO 0.04 0.29 -0.17 -0.63 0.23 0.00 0.00 176.35 176.10 1nyn s ILE 17 N -0.36 2.74 0.22 -0.59 1.01 -0.59 -1.64 121.20 121.99 1nyn s ILE 17 Ca 0.05 -0.79 0.11 0.00 0.00 0.00 0.00 60.65 60.02 1nyn s ILE 17 Cb -0.12 -2.11 -0.05 0.00 0.01 0.00 0.00 42.46 40.19 1nyn s ILE 17 CO 0.02 0.54 -0.16 0.68 0.00 0.00 0.00 174.94 176.03 1nyn s VAL 18 N 0.16 2.73 0.22 2.92 -7.23 -0.84 -2.40 120.40 115.96 1nyn s VAL 18 Ca -0.09 -2.03 -0.08 0.00 -1.81 0.00 0.00 61.98 57.97 1nyn s VAL 18 Cb -0.16 -2.38 -0.06 0.00 0.56 0.00 0.00 36.38 34.34 1nyn s VAL 18 CO 0.06 -0.23 0.51 -0.36 -0.31 0.00 0.00 175.10 174.76 1nyn s PHE 19 N -2.00 3.45 0.15 2.82 0.40 -1.26 -2.14 117.98 119.39 1nyn s PHE 19 Ca 0.26 0.75 -0.00 0.00 -0.60 0.00 0.00 56.93 57.34 1nyn s PHE 19 Cb -0.07 -2.17 -0.04 0.00 0.51 0.00 0.00 43.02 41.25 1nyn s PHE 19 CO 0.14 0.29 0.06 0.00 0.70 0.00 0.00 175.22 176.41 1nyn s ALA 20 N -1.82 1.02 -0.22 5.36 0.00 -0.47 -4.49 121.76 121.13 1nyn s ALA 20 Ca 0.45 -1.54 -0.20 0.00 0.00 0.00 0.00 51.96 50.68 1nyn s ALA 20 Cb -0.11 0.90 -0.17 0.00 0.00 0.00 0.00 23.12 23.73 1nyn s ALA 20 CO 0.24 -0.47 0.08 0.00 0.00 0.00 0.00 175.76 175.60 1nyn n ALA 21 N -0.16 0.87 -3.61 0.00 0.00 -1.10 -3.53 120.51 112.98 1nyn n ALA 21 Ca -0.04 -0.62 -0.12 0.00 0.00 0.00 0.00 53.44 52.66 1nyn n ALA 21 Cb 0.64 -0.40 -0.07 0.00 0.00 0.00 0.00 19.45 19.62 1nyn n ALA 21 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1nyn s SER 22 N -6.97 -0.54 0.38 0.00 0.01 -1.26 -4.35 113.70 100.95 1nyn s SER 22 Ca -0.31 0.95 0.08 0.00 1.31 0.00 0.00 55.95 57.98 1nyn s SER 22 Cb 0.08 0.92 0.82 0.00 0.21 0.00 0.00 66.02 68.05 1nyn s SER 22 CO 0.56 -0.26 1.95 1.05 0.41 0.00 0.00 173.24 176.96 1nyn h GLU 23 N 4.06 0.65 0.40 12.44 4.11 -1.96 -2.10 114.58 132.17 1nyn h GLU 23 Ca -0.27 -0.04 -0.01 0.00 0.07 0.00 0.00 59.36 59.11 1nyn h GLU 23 Cb 1.17 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 30.26 1nyn h GLU 23 CO 0.15 0.43 -0.31 1.49 0.07 0.00 0.00 179.01 180.84 1nyn h GLU 24 N 0.67 -0.66 -0.71 1.06 4.57 -1.99 0.20 114.58 117.71 1nyn h GLU 24 Ca 0.32 0.04 0.15 0.00 -1.18 0.00 0.00 59.36 58.69 1nyn h GLU 24 Cb 0.38 0.15 -0.10 0.00 -0.16 0.00 0.00 28.75 29.02 1nyn h GLU 24 CO -0.11 -0.44 0.19 -0.07 -1.18 0.00 0.00 179.01 177.40 1nyn h LEU 25 N -0.68 0.06 -0.37 1.64 3.38 -1.91 0.17 115.31 117.61 1nyn h LEU 25 Ca -0.05 0.13 0.07 0.00 0.09 0.00 0.00 57.88 58.12 1nyn h LEU 25 Cb 0.57 0.17 -0.06 0.00 0.09 0.00 0.00 40.66 41.43 1nyn h LEU 25 CO 0.01 0.00 -0.01 0.58 0.09 0.00 0.00 178.44 179.11 1nyn h VAL 26 N 0.30 0.71 -0.77 1.22 2.07 -0.99 0.15 116.25 118.94 1nyn h VAL 26 Ca 0.39 -0.03 -0.01 0.00 0.82 0.00 0.00 66.70 67.88 1nyn h VAL 26 Cb 0.64 0.62 -0.04 0.00 -1.52 0.00 0.00 31.29 30.99 1nyn h VAL 26 CO -0.47 0.02 0.46 -0.78 0.02 0.00 0.00 177.57 176.82 1nyn h ASP 27 N 0.09 0.93 -0.24 0.57 3.58 0.93 -1.03 116.42 121.25 1nyn h ASP 27 Ca 0.18 -0.06 -0.09 0.00 0.42 0.00 0.00 57.03 57.48 1nyn h ASP 27 Cb 0.25 -0.24 -0.02 0.00 1.72 0.00 0.00 39.33 41.05 1nyn h ASP 27 CO -0.31 0.73 -0.14 -0.33 -2.88 0.00 0.00 179.24 176.31 1nyn h GLU 28 N 1.07 0.66 -0.08 0.28 5.08 0.39 -2.62 114.58 119.35 1nyn h GLU 28 Ca 0.28 -0.22 -0.13 0.00 -1.00 0.00 0.00 59.36 58.29 1nyn h GLU 28 Cb -0.03 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.16 1nyn h GLU 28 CO -0.05 0.77 -0.54 -0.92 -1.00 0.00 0.00 179.01 177.27 1nyn h TYR 29 N 0.59 0.30 -0.67 4.33 3.20 0.09 -2.85 116.97 121.97 1nyn h TYR 29 Ca 0.10 -0.10 0.16 0.00 3.14 0.00 0.00 58.73 62.03 1nyn h TYR 29 Cb 0.58 -0.06 -0.04 0.00 1.54 0.00 0.00 36.73 38.76 1nyn h TYR 29 CO 0.03 0.73 0.47 -0.07 -1.64 0.00 0.00 178.16 177.67 1nyn h LEU 30 N 0.19 0.17 -3.69 2.82 3.38 -0.82 0.26 115.31 117.62 1nyn h LEU 30 Ca 0.00 0.01 -0.46 0.00 0.09 0.00 0.00 57.88 57.52 1nyn h LEU 30 Cb 1.01 -0.02 -0.25 0.00 0.09 0.00 0.00 40.66 41.49 1nyn h LEU 30 CO 0.08 0.09 0.59 1.17 0.09 0.00 0.00 178.44 180.46 1nyn n LYS 31 N -4.41 2.12 -2.67 1.13 4.81 -1.07 -4.39 118.16 113.68 1nyn n LYS 31 Ca 0.13 -2.52 -0.04 0.00 -0.87 0.00 0.00 58.31 55.01 1nyn n LYS 31 Cb 0.62 -1.99 0.09 0.00 0.02 0.00 0.00 35.03 33.77 1nyn n LYS 31 CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 1nyn n ASN 32 N -0.74 -1.30 -4.55 3.14 2.85 0.91 -5.10 115.26 110.48 1nyn n ASN 32 Ca 0.50 -1.97 -0.37 0.00 -0.11 0.00 0.00 54.58 52.63 1nyn n ASN 32 Cb 1.22 1.18 -0.03 0.00 1.24 0.00 0.00 39.78 43.39 1nyn n ASN 32 CO 0.00 0.00 0.00 -2.16 -2.11 0.00 0.00 177.26 172.99 1nyn s PRO 33 N 0.06 2.59 0.00 1.20 0.04 -1.16 -4.81 135.00 132.92 1nyn s PRO 33 Ca 0.18 0.55 0.00 0.00 0.04 0.00 0.00 61.00 61.78 1nyn s PRO 33 Cb 0.27 -4.46 0.00 0.00 0.04 0.00 0.00 34.50 30.34 1nyn s PRO 33 CO -0.16 -2.83 0.00 0.43 0.04 0.00 0.00 177.00 174.48 1nyn n SER 34 N 13.03 0.00 0.00 6.66 7.64 -1.26 -5.09 113.62 134.60 1nyn n SER 34 Ca 0.23 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.11 1nyn n SER 34 Cb 0.52 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.72 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 0.00 0.44 0.13 -1.26 -4.93 119.36 113.73 1nyn n ILE 35 Ca 0.00 0.00 0.00 0.00 -1.10 0.00 0.00 62.75 61.65 1nyn n ILE 35 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 39.64 38.80 1nyn n ILE 35 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 1nyn n GLY 36 N -0.15 0.19 0.43 4.50 0.00 -1.26 -3.70 105.19 105.20 1nyn n GLY 36 Ca 0.00 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.17 1nyn n GLY 36 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 1nyn h LYS 37 N 0.00 0.00 -0.51 1.61 3.64 -1.95 1.50 116.57 120.86 1nyn h LYS 37 Ca 0.00 0.00 -0.10 0.00 -1.27 0.00 0.00 60.65 59.28 1nyn h LYS 37 Cb 0.00 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 31.80 1nyn h LYS 37 CO 0.00 0.00 -0.10 1.25 -2.27 0.00 0.00 179.45 178.33 1nyn h LEU 38 N 0.00 0.94 -1.39 5.20 5.85 -1.92 -1.85 115.31 122.13 1nyn h LEU 38 Ca 0.24 -0.30 0.03 0.00 0.84 0.00 0.00 57.88 58.70 1nyn h LEU 38 Cb 2.34 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 43.08 1nyn h LEU 38 CO -0.00 1.05 0.44 0.28 -0.34 0.00 0.00 178.44 179.86 1nyn h SER 39 N 0.85 0.68 0.22 1.25 0.02 0.21 -2.31 113.55 114.46 1nyn h SER 39 Ca 0.14 -0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 61.07 1nyn h SER 39 Cb 0.63 -0.16 0.00 0.00 0.14 0.00 0.00 62.40 63.02 1nyn h SER 39 CO 0.04 0.47 -0.10 -0.08 -1.14 0.00 0.00 176.83 176.02 1nyn h GLU 40 N 0.79 -0.28 -1.34 3.45 4.81 -1.52 -3.20 114.58 117.30 1nyn h GLU 40 Ca 0.26 0.02 0.44 0.00 -0.13 0.00 0.00 59.36 59.96 1nyn h GLU 40 Cb 0.07 0.06 -0.13 0.00 0.63 0.00 0.00 28.75 29.38 1nyn h GLU 40 CO -0.07 0.00 0.86 0.28 -0.73 0.00 0.00 179.01 179.35 1nyn h VAL 41 N -1.00 0.10 -3.62 0.32 2.07 -1.19 -3.32 116.25 109.60 1nyn h VAL 41 Ca -0.03 -0.02 -0.64 0.00 0.82 0.00 0.00 66.70 66.83 1nyn h VAL 41 Cb 0.41 0.02 -0.20 0.00 -1.52 0.00 0.00 31.29 30.00 1nyn h VAL 41 CO 0.05 0.01 -0.59 -0.69 0.02 0.00 0.00 177.57 176.37 1nyn s VAL 42 N -5.29 4.61 -0.06 2.57 1.01 -0.88 -2.73 120.40 119.62 1nyn s VAL 42 Ca -0.08 -0.08 0.13 0.00 0.00 0.00 0.00 61.98 61.96 1nyn s VAL 42 Cb 0.30 -3.15 -0.08 0.00 0.00 0.00 0.00 36.38 33.45 1nyn s VAL 42 CO 0.82 0.35 1.20 -0.08 0.00 0.00 0.00 175.10 177.39 1nyn h GLU 43 N 7.93 0.00 -5.27 2.72 4.81 -1.77 -3.45 114.58 119.56 1nyn h GLU 43 Ca -0.37 0.00 -0.48 0.00 -0.13 0.00 0.00 59.36 58.38 1nyn h GLU 43 Cb 1.18 0.00 -0.29 0.00 0.63 0.00 0.00 28.75 30.27 1nyn h GLU 43 CO 0.60 0.60 -0.81 -0.51 -0.73 0.00 0.00 179.01 178.15 1nyn s LEU 44 N -6.36 2.03 -1.18 1.64 1.02 -1.26 -5.04 118.68 109.53 1nyn s LEU 44 Ca 0.01 -0.26 -0.04 0.00 0.02 0.00 0.00 54.13 53.86 1nyn s LEU 44 Cb 0.08 -0.71 0.18 0.00 0.02 0.00 0.00 46.19 45.77 1nyn s LEU 44 CO 0.79 0.16 2.24 0.49 0.02 0.00 0.00 176.35 180.05 1nyn n PHE 45 N 2.70 2.60 -3.77 0.29 3.01 -1.26 -4.89 117.46 116.15 1nyn n PHE 45 Ca -0.14 -2.69 -0.10 0.00 1.01 0.00 0.00 57.45 55.53 1nyn n PHE 45 Cb 0.55 -1.61 -0.05 0.00 -0.01 0.00 0.00 39.48 38.36 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 -2.17 1.27 0.15 -1.08 2.12 -1.26 -5.08 118.70 112.65 1nyn s GLU 46 Ca 0.50 -0.90 0.10 0.00 0.36 0.00 0.00 54.97 55.02 1nyn s GLU 46 Cb 0.20 0.48 -0.04 0.00 0.26 0.00 0.00 34.13 35.03 1nyn s GLU 46 CO -0.12 -0.51 -0.20 0.08 -0.54 0.00 0.00 175.26 173.97 1nyn s VAL 47 N -3.88 2.69 0.07 3.70 1.01 -1.26 -4.73 120.40 117.99 1nyn s VAL 47 Ca 0.10 -1.70 0.05 0.00 0.00 0.00 0.00 61.98 60.43 1nyn s VAL 47 Cb 0.01 -2.26 -0.03 0.00 0.00 0.00 0.00 36.38 34.10 1nyn s VAL 47 CO -0.04 0.01 -0.15 -0.36 0.00 0.00 0.00 175.10 174.56 1nyn s PHE 48 N -1.34 1.28 0.06 5.22 0.08 -1.01 -3.35 117.98 118.91 1nyn s PHE 48 Ca 0.19 -0.43 -0.15 0.00 0.12 0.00 0.00 56.93 56.66 1nyn s PHE 48 Cb -0.10 -0.73 0.02 0.00 -0.57 0.00 0.00 43.02 41.65 1nyn s PHE 48 CO 0.10 0.07 0.34 0.95 -0.10 0.00 0.00 175.22 176.58 1nyn s THR 49 N -1.15 0.08 0.36 0.64 -4.23 -0.81 -1.53 115.64 108.99 1nyn s THR 49 Ca -0.00 -0.64 -0.26 0.00 -1.18 0.00 0.00 61.69 59.61 1nyn s THR 49 Cb -0.09 -0.99 -0.09 0.00 1.34 0.00 0.00 72.50 72.66 1nyn s THR 49 CO 0.02 -0.35 1.13 -2.16 -0.54 0.00 0.00 174.62 172.72 1nyn s PRO 50 N -2.76 4.27 0.04 3.99 0.04 -1.26 -1.65 135.00 137.66 1nyn s PRO 50 Ca -0.03 1.78 0.00 0.00 0.04 0.00 0.00 61.00 62.78 1nyn s PRO 50 Cb -0.00 -2.82 0.00 0.00 0.04 0.00 0.00 34.50 31.71 1nyn s PRO 50 CO -0.05 -0.11 0.00 0.00 0.04 0.00 0.00 177.00 176.88 1nyn n GLN 51 N 0.42 0.00 -0.00 4.56 10.64 -1.26 -4.86 117.38 126.88 1nyn n GLN 51 Ca 0.03 0.00 -0.17 0.00 -1.83 0.00 0.00 57.00 55.03 1nyn n GLN 51 Cb 0.46 -0.16 -0.06 0.00 -0.86 0.00 0.00 30.24 29.62 1nyn n GLN 51 CO 0.00 0.00 0.00 -0.44 -1.83 0.00 0.00 177.06 174.79 1nyn h ASP 52 N 0.00 0.88 0.00 2.61 5.19 -1.92 -3.49 116.42 119.69 1nyn h ASP 52 Ca 0.00 -0.59 0.00 0.00 -0.62 0.00 0.00 57.03 55.82 1nyn h ASP 52 Cb 0.27 -0.26 0.00 0.00 0.18 0.00 0.00 39.33 39.52 1nyn h ASP 52 CO 0.00 1.39 0.00 0.61 -3.12 0.00 0.00 179.24 178.12 1nyn n GLY 53 N 0.73 2.27 0.00 2.75 0.00 -1.26 -5.18 105.19 104.50 1nyn n GLY 53 Ca -0.07 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.42 1nyn n GLY 53 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nyn n ARG 54 N 0.00 3.64 -1.55 1.61 5.12 -1.26 -4.71 116.66 119.51 1nyn n ARG 54 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 1nyn n ARG 54 Cb 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.30 1nyn n ARG 54 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1nyn n GLY 55 N 5.00 -4.15 3.56 -0.13 0.00 -1.26 -4.76 105.19 103.45 1nyn n GLY 55 Ca 0.00 -0.31 -0.34 0.00 0.00 0.00 0.00 46.02 45.37 1nyn n GLY 55 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nyn s ALA 56 N -0.26 2.17 -0.13 4.61 0.00 -1.26 -4.69 121.76 122.20 1nyn s ALA 56 Ca 0.00 -1.84 0.21 0.00 0.00 0.00 0.00 51.96 50.33 1nyn s ALA 56 Cb 0.00 -4.54 -0.19 0.00 0.00 0.00 0.00 23.12 18.40 1nyn s ALA 56 CO 0.00 -4.23 0.69 0.39 0.00 0.00 0.00 175.76 172.61 1nyn n GLU 57 N 8.88 0.64 0.00 0.00 1.02 -1.26 -4.96 120.64 124.96 1nyn n GLU 57 Ca 0.36 -0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.49 1nyn n GLU 57 Cb 0.49 -1.67 0.00 0.00 -0.02 0.00 0.00 31.44 30.24 1nyn n GLU 57 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1nyn n GLY 58 N 1.29 1.28 2.51 0.62 0.00 -1.26 -4.99 105.19 104.65 1nyn n GLY 58 Ca -0.06 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.62 1nyn n GLY 58 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1nyn n GLU 59 N -0.02 2.93 -1.49 1.61 1.02 -1.26 -5.01 120.64 118.41 1nyn n GLU 59 Ca 0.00 -3.64 -0.29 0.00 -0.02 0.00 0.00 57.16 53.21 1nyn n GLU 59 Cb 0.00 -2.28 0.16 0.00 -0.02 0.00 0.00 31.44 29.30 1nyn n GLU 59 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 1nyn s LEU 60 N -3.85 1.87 -0.06 -4.62 1.43 -1.26 -4.94 118.68 107.26 1nyn s LEU 60 Ca 0.56 0.86 0.06 0.00 -1.03 0.00 0.00 54.13 54.58 1nyn s LEU 60 Cb 0.46 -3.06 -0.01 0.00 0.03 0.00 0.00 46.19 43.60 1nyn s LEU 60 CO -0.17 -2.83 -0.24 -0.83 0.23 0.00 0.00 176.35 172.51 1nyn s GLY 61 N -4.06 1.32 0.89 -3.19 0.00 -0.66 -4.93 107.32 96.69 1nyn s GLY 61 Ca 0.66 -1.05 -0.13 0.00 0.00 0.00 0.00 44.72 44.20 1nyn s GLY 61 CO 0.54 -0.67 0.53 0.00 0.00 0.00 0.00 173.10 173.50 1nyn n ALA 62 N 2.88 -2.07 -2.34 3.20 0.00 -1.26 -1.93 120.51 118.98 1nyn n ALA 62 Ca -0.17 -0.50 -0.29 0.00 0.00 0.00 0.00 53.44 52.47 1nyn n ALA 62 Cb 0.52 -1.86 -0.03 0.00 0.00 0.00 0.00 19.45 18.08 1nyn n ALA 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1nyn s ALA 63 N -2.28 3.47 0.28 0.00 0.00 -1.21 -4.70 121.76 117.32 1nyn s ALA 63 Ca 0.60 -0.41 -0.22 0.00 0.00 0.00 0.00 51.96 51.94 1nyn s ALA 63 Cb -0.25 -2.52 -0.09 0.00 0.00 0.00 0.00 23.12 20.26 1nyn s ALA 63 CO 0.64 0.03 0.83 -1.54 0.00 0.00 0.00 175.76 175.72 1nyn s SER 64 N -3.33 7.14 0.40 0.00 1.04 -1.26 -4.90 113.70 112.78 1nyn s SER 64 Ca 0.48 1.59 0.22 0.00 0.48 0.00 0.00 55.95 58.72 1nyn s SER 64 Cb -0.10 -2.49 1.19 0.00 0.10 0.00 0.00 66.02 64.72 1nyn s SER 64 CO 0.33 -0.05 1.63 0.07 0.98 0.00 0.00 173.24 176.20 1nyn h LYS 65 N 3.12 0.00 0.10 4.02 2.10 -2.01 0.46 116.57 124.36 1nyn h LYS 65 Ca -0.48 0.00 -0.33 0.00 -2.00 0.00 0.00 60.65 57.85 1nyn h LYS 65 Cb 1.19 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 32.50 1nyn h LYS 65 CO 0.65 0.00 -1.77 0.00 -2.00 0.00 0.00 179.45 176.33 1nyn h ALA 66 N 1.62 0.45 -0.84 0.07 0.00 -1.98 -2.77 119.26 115.81 1nyn h ALA 66 Ca 0.00 -1.31 0.01 0.00 0.00 0.00 0.00 54.91 53.61 1nyn h ALA 66 Cb 0.31 0.51 -0.04 0.00 0.00 0.00 0.00 17.79 18.56 1nyn h ALA 66 CO 0.00 1.31 0.55 0.37 0.00 0.00 0.00 179.25 181.49 1nyn h GLN 67 N 0.06 1.09 0.03 0.00 4.15 -1.27 -2.03 115.11 117.14 1nyn h GLN 67 Ca -0.33 -0.07 -0.11 0.00 0.77 0.00 0.00 58.65 58.91 1nyn h GLN 67 Cb 2.03 -0.25 0.01 0.00 0.21 0.00 0.00 27.48 29.48 1nyn h GLN 67 CO 0.11 0.72 -0.44 0.28 -1.93 0.00 0.00 178.83 177.57 1nyn h VAL 68 N 1.13 1.53 -1.04 2.39 2.07 -1.66 -2.91 116.25 117.77 1nyn h VAL 68 Ca 0.31 -2.14 0.27 0.00 0.82 0.00 0.00 66.70 65.96 1nyn h VAL 68 Cb -0.12 2.87 -0.12 0.00 -1.52 0.00 0.00 31.29 32.40 1nyn h VAL 68 CO -0.07 0.60 0.63 -0.33 0.02 0.00 0.00 177.57 178.42 1nyn h GLU 69 N -0.41 0.44 0.00 1.57 5.08 -1.30 1.24 114.58 121.20 1nyn h GLU 69 Ca -0.06 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.25 1nyn h GLU 69 Cb 1.22 -0.10 -0.00 0.00 0.50 0.00 0.00 28.75 30.37 1nyn h GLU 69 CO 0.09 0.29 -0.09 -0.97 -1.00 0.00 0.00 179.01 177.33 1nyn h ASN 70 N 0.46 0.00 0.69 1.42 -0.00 -1.39 3.94 115.58 120.70 1nyn h ASN 70 Ca 0.65 0.00 -0.18 0.00 -0.00 0.00 0.00 56.30 56.78 1nyn h ASN 70 Cb 1.46 0.00 -0.02 0.00 -0.00 0.00 0.00 38.32 39.76 1nyn h ASN 70 CO -0.43 0.09 -0.82 -0.08 -0.00 0.00 0.00 177.43 176.19 1nyn h GLU 71 N 0.00 0.09 0.00 6.67 4.57 0.17 -3.37 114.58 122.71 1nyn h GLU 71 Ca -0.00 -0.09 0.00 0.00 -1.18 0.00 0.00 59.36 58.09 1nyn h GLU 71 Cb 1.00 0.03 0.00 0.00 -0.16 0.00 0.00 28.75 29.62 1nyn h GLU 71 CO 0.01 0.85 -0.57 1.19 -1.18 0.00 0.00 179.01 179.32 1nyn n PHE 72 N -3.63 0.00 0.00 0.92 3.72 -0.49 -4.94 117.46 113.03 1nyn n PHE 72 Ca -0.02 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.38 1nyn n PHE 72 Cb 0.77 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.31 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 1.52 0.24 2.51 1.37 0.00 1.30 -4.93 105.19 107.20 1nyn n GLY 73 Ca 0.00 -2.09 -0.29 0.00 0.00 0.00 0.00 46.02 43.63 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 0.00 0.52 0.00 1.61 2.20 -1.25 -4.13 119.74 118.70 1nyn s LYS 74 Ca 0.00 -1.17 0.00 0.00 -0.36 0.00 0.00 55.97 54.44 1nyn s LYS 74 Cb 0.00 -1.38 0.00 0.00 -1.51 0.00 0.00 37.83 34.94 1nyn s LYS 74 CO 0.00 -1.15 0.00 0.41 -0.36 0.00 0.00 175.35 174.25 1nyn n GLY 75 N 4.35 0.00 3.23 5.54 0.00 -1.26 -5.15 105.19 111.89 1nyn n GLY 75 Ca 0.07 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.91 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 0.28 0.00 1.61 5.02 -1.26 -5.13 118.16 118.68 1nyn n LYS 76 Ca 0.00 -2.39 0.00 0.00 -2.02 0.00 0.00 58.31 53.90 1nyn n LYS 76 Cb 0.00 -0.41 0.00 0.00 -0.02 0.00 0.00 35.03 34.60 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 -2.33 3.58 -0.01 1.97 5.02 -1.26 -5.02 118.16 120.11 1nyn n LYS 77 Ca 0.14 0.00 -0.10 0.00 -2.02 0.00 0.00 58.31 56.33 1nyn n LYS 77 Cb 0.49 0.00 -0.14 0.00 -0.02 0.00 0.00 35.03 35.36 1nyn n LYS 77 CO 0.00 0.00 0.00 0.97 -0.52 0.00 0.00 177.40 177.85 1nyn h ILE 78 N 0.00 0.92 0.47 -0.18 6.09 -1.99 -3.28 117.51 119.54 1nyn h ILE 78 Ca 0.00 -2.74 -0.02 0.00 -1.37 0.00 0.00 64.86 60.73 1nyn h ILE 78 Cb 0.00 2.49 0.00 0.00 0.47 0.00 0.00 36.82 39.78 1nyn h ILE 78 CO 0.00 0.59 -0.22 -0.33 -3.07 0.00 0.00 178.15 175.12 1nyn h GLU 79 N 0.01 -0.61 -1.08 2.19 5.08 -1.98 -2.38 114.58 115.81 1nyn h GLU 79 Ca -0.27 0.04 0.31 0.00 -1.00 0.00 0.00 59.36 58.44 1nyn h GLU 79 Cb 1.99 0.14 -0.05 0.00 0.50 0.00 0.00 28.75 31.33 1nyn h GLU 79 CO 0.09 -0.40 0.76 0.93 -1.00 0.00 0.00 179.01 179.39 1nyn h GLU 80 N -1.17 0.08 0.47 2.33 5.08 -1.97 0.37 114.58 119.77 1nyn h GLU 80 Ca -0.06 -0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.27 1nyn h GLU 80 Cb 0.49 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.72 1nyn h GLU 80 CO 0.11 0.05 -0.23 0.28 -1.00 0.00 0.00 179.01 178.22 1nyn h VAL 81 N 0.08 0.00 -0.06 3.13 2.07 -1.60 -2.85 116.25 117.02 1nyn h VAL 81 Ca 0.54 -0.34 0.02 0.00 0.82 0.00 0.00 66.70 67.73 1nyn h VAL 81 Cb 1.97 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 31.73 1nyn h VAL 81 CO -0.07 0.00 0.22 0.40 0.02 0.00 0.00 177.57 178.14 1nyn h ILE 82 N -0.97 0.13 0.43 4.57 2.04 -0.77 -2.00 117.51 120.93 1nyn h ILE 82 Ca -0.06 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 65.77 1nyn h ILE 82 Cb 0.48 0.80 0.00 0.00 -0.74 0.00 0.00 36.82 37.36 1nyn h ILE 82 CO 0.11 0.00 -0.21 -0.78 0.00 0.00 0.00 178.15 177.27 1nyn h ASP 83 N 0.00 -0.49 -0.04 1.72 3.58 -0.78 -1.97 116.42 118.44 1nyn h ASP 83 Ca 0.03 -0.11 0.01 0.00 0.42 0.00 0.00 57.03 57.39 1nyn h ASP 83 Cb 0.47 0.13 -0.00 0.00 1.72 0.00 0.00 39.33 41.64 1nyn h ASP 83 CO -0.00 -0.13 0.05 -0.07 -2.88 0.00 0.00 179.24 176.21 1nyn h LEU 84 N -0.89 0.00 0.04 2.28 3.38 -1.15 -1.58 115.31 117.40 1nyn h LEU 84 Ca -0.06 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.91 1nyn h LEU 84 Cb 0.56 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.31 1nyn h LEU 84 CO 0.10 0.00 -0.02 0.40 0.09 0.00 0.00 178.44 179.01 1nyn h ILE 85 N 0.00 1.28 0.00 1.22 2.04 -1.21 -1.08 117.51 119.77 1nyn h ILE 85 Ca 0.02 -1.11 0.00 0.00 1.00 0.00 0.00 64.86 64.77 1nyn h ILE 85 Cb 0.12 2.01 0.00 0.00 -0.74 0.00 0.00 36.82 38.21 1nyn h ILE 85 CO -0.00 0.28 0.00 0.18 0.00 0.00 0.00 178.15 178.61 1nyn n LEU 86 N -4.88 0.00 -0.06 1.44 4.77 -0.77 0.58 117.00 118.07 1nyn n LEU 86 Ca -0.08 0.29 -0.14 0.00 -0.03 0.00 0.00 56.01 56.04 1nyn n LEU 86 Cb 0.26 -0.29 -0.14 0.00 -2.33 0.00 0.00 43.42 40.91 1nyn n LEU 86 CO 0.32 -0.11 -0.98 -1.14 -1.33 0.00 0.00 177.39 174.15 1nyn n ARG 87 N -1.29 0.68 -2.79 3.23 0.00 -0.65 -4.62 116.66 111.22 1nyn n ARG 87 Ca 0.09 0.17 -0.02 0.00 -0.00 0.00 0.00 57.85 58.08 1nyn n ARG 87 Cb 0.15 -1.63 0.05 0.00 0.00 0.00 0.00 32.46 31.03 1nyn n ARG 87 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.63 177.90 1nyn n ASN 88 N -3.13 1.31 0.00 6.15 6.94 -0.43 -5.07 115.26 121.03 1nyn n ASN 88 Ca -0.32 -2.18 0.00 0.00 -0.02 0.00 0.00 54.58 52.06 1nyn n ASN 88 Cb 1.06 -0.40 0.00 0.00 -2.36 0.00 0.00 39.78 38.09 1nyn n ASN 88 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1nyn n GLY 89 N -0.55 1.57 3.29 4.83 0.00 0.20 -4.89 105.19 109.64 1nyn n GLY 89 Ca 0.06 -0.63 -0.26 0.00 0.00 0.00 0.00 46.02 45.19 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 0.00 -1.40 0.01 1.61 4.81 0.15 -4.83 118.16 118.51 1nyn n LYS 90 Ca 0.00 0.87 -0.03 0.00 -0.87 0.00 0.00 58.31 58.28 1nyn n LYS 90 Cb 0.00 -1.69 -0.02 0.00 0.02 0.00 0.00 35.03 33.34 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 0.82 -0.12 0.00 1.64 0.11 -1.91 -3.47 132.00 129.07 1nyn h PRO 91 Ca -0.50 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.62 1nyn h PRO 91 Cb 1.14 0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1nyn h PRO 91 CO 0.24 -0.08 0.00 -1.71 -0.21 0.00 0.00 178.00 176.24 1nyn n ASN 92 N -3.06 -1.18 -4.08 -2.05 2.85 -1.26 -4.02 115.26 102.46 1nyn n ASN 92 Ca -0.01 0.00 -0.35 0.00 -0.11 0.00 0.00 54.58 54.10 1nyn n ASN 92 Cb 0.07 0.00 -0.08 0.00 1.24 0.00 0.00 39.78 41.02 1nyn n ASN 92 CO 0.00 0.00 0.00 -0.94 -2.11 0.00 0.00 177.26 174.21 1nyn s SER 93 N -4.00 5.73 0.02 1.20 1.04 -1.26 -5.05 113.70 111.38 1nyn s SER 93 Ca 0.00 -3.60 -0.31 0.00 0.48 0.00 0.00 55.95 52.52 1nyn s SER 93 Cb 0.00 -1.87 -0.10 0.00 0.10 0.00 0.00 66.02 64.15 1nyn s SER 93 CO 0.00 -0.20 1.95 1.07 0.98 0.00 0.00 173.24 177.03 1nyn n THR 94 N 2.48 0.70 -1.59 2.02 5.66 -1.26 -4.94 114.28 117.35 1nyn n THR 94 Ca 0.19 -0.13 -0.33 0.00 -3.05 0.00 0.00 64.05 60.74 1nyn n THR 94 Cb 0.37 -2.21 0.06 0.00 -1.55 0.00 0.00 70.33 67.01 1nyn n THR 94 CO 0.00 0.00 0.00 0.42 -3.05 0.00 0.00 175.07 172.44 1nyn s THR 95 N 4.24 3.18 0.66 1.09 -4.23 -1.26 -4.97 115.64 114.35 1nyn s THR 95 Ca 0.89 0.50 -0.16 0.00 -1.18 0.00 0.00 61.69 61.74 1nyn s THR 95 Cb -0.50 -3.01 -0.00 0.00 1.34 0.00 0.00 72.50 70.33 1nyn s THR 95 CO 0.44 -0.38 1.18 -0.44 -0.54 0.00 0.00 174.62 174.88 1nyn s SER 96 N -2.75 4.82 0.21 3.99 0.01 -1.26 -4.98 113.70 113.74 1nyn s SER 96 Ca 0.66 2.28 -0.22 0.00 1.31 0.00 0.00 55.95 59.98 1nyn s SER 96 Cb -0.20 -2.58 -0.08 0.00 0.21 0.00 0.00 66.02 63.36 1nyn s SER 96 CO 0.46 -1.84 0.75 -0.94 0.41 0.00 0.00 173.24 172.08 1nyn s SER 97 N -2.00 7.17 0.00 2.44 1.04 -1.26 -4.89 113.70 116.20 1nyn s SER 97 Ca 0.74 1.51 0.00 0.00 0.48 0.00 0.00 55.95 58.67 1nyn s SER 97 Cb -0.27 -2.45 0.00 0.00 0.10 0.00 0.00 66.02 63.40 1nyn s SER 97 CO 0.39 0.08 0.00 0.18 0.98 0.00 0.00 173.24 174.88 1nyn n LEU 98 N 0.99 0.00 0.00 2.42 4.77 -1.26 -4.39 117.00 119.53 1nyn n LEU 98 Ca -0.03 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.95 1nyn n LEU 98 Cb 0.50 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.59 1nyn n LEU 98 CO 0.44 0.00 0.00 0.29 -1.33 0.00 0.00 177.39 176.79 1nyn n LYS 99 N 13.87 0.00 -1.67 3.23 4.76 -1.26 -5.10 118.16 131.98 1nyn n LYS 99 Ca 0.00 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.44 1nyn n LYS 99 Cb 0.00 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.19 1nyn n LYS 99 CO 0.00 0.00 0.00 2.41 -1.37 0.00 0.00 177.40 178.44 1nyn n THR 100 N -0.14-10.55 -3.22 -0.18 -1.04 -1.26 -4.96 114.28 92.94 1nyn n THR 100 Ca 0.00 2.52 -0.32 0.00 -2.04 0.00 0.00 64.05 64.21 1nyn n THR 100 Cb 0.00 -4.67 -0.06 0.00 -1.82 0.00 0.00 70.33 63.78 1nyn n THR 100 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 1nyn s LYS 101 N -1.26 3.91 -0.29 -2.82 -0.14 -1.26 -5.06 119.74 112.82 1nyn s LYS 101 Ca 0.00 0.50 -0.00 0.00 -1.36 0.00 0.00 55.97 55.11 1nyn s LYS 101 Cb 0.00 -2.51 0.09 0.00 -1.68 0.00 0.00 37.83 33.73 1nyn s LYS 101 CO 0.00 0.20 0.07 0.20 -0.76 0.00 0.00 175.35 175.05 1nyn s GLY 102 N -2.39 1.18 0.49 -3.33 0.00 -1.26 -5.12 107.32 96.88 1nyn s GLY 102 Ca 0.51 -1.64 0.04 0.00 0.00 0.00 0.00 44.72 43.63 1nyn s GLY 102 CO 0.20 1.42 0.12 -0.32 0.00 0.00 0.00 173.10 174.52 1nyn s GLY 103 N 1.52 2.71 -0.00 0.20 0.00 -1.26 -5.00 107.32 105.48 1nyn s GLY 103 Ca 0.07 -1.10 0.06 0.00 0.00 0.00 0.00 44.72 43.75 1nyn s GLY 103 CO -0.19 -2.08 1.13 0.70 0.00 0.00 0.00 173.10 172.66 1nyn n ASN 104 N -1.33 0.99 -4.25 1.64 4.13 -1.26 -4.70 115.26 110.48 1nyn n ASN 104 Ca -0.11 -2.00 -0.36 0.00 1.68 0.00 0.00 54.58 53.79 1nyn n ASN 104 Cb 0.66 -0.13 -0.13 0.00 -1.54 0.00 0.00 39.78 38.64 1nyn n ASN 104 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1nyn s ALA 105 N -1.75 2.90 0.00 5.41 0.00 -1.26 -5.04 121.76 122.02 1nyn s ALA 105 Ca 0.12 -1.59 0.00 0.00 0.00 0.00 0.00 51.96 50.49 1nyn s ALA 105 Cb 0.06 -2.00 0.00 0.00 0.00 0.00 0.00 23.12 21.18 1nyn s ALA 105 CO 0.08 -1.06 0.00 0.41 0.00 0.00 0.00 175.76 175.19 1nyn n GLY 106 N 4.74 2.32 0.00 0.00 0.00 -1.26 -4.96 105.19 106.03 1nyn n GLY 106 Ca -0.14 -0.11 0.03 0.00 0.00 0.00 0.00 46.02 45.80 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 -0.41 0.00 0.00 2.61 -2.24 -1.26 -4.11 114.28 108.87 1nyn n THR 107 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1nyn n THR 107 Cb 0.00 -0.49 0.00 0.00 -2.10 0.00 0.00 70.33 67.74 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 -0.71 0.00 -1.26 -0.78 5.02 -1.26 -5.02 118.16 114.15 1nyn n LYS 108 Ca 0.05 0.00 0.17 0.00 -2.02 0.00 0.00 58.31 56.50 1nyn n LYS 108 Cb 0.02 -0.01 -0.05 0.00 -0.02 0.00 0.00 35.03 34.98 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 -3.00 -3.52 -2.86 7.82 0.00 -1.26 -4.32 120.51 113.37 1nyn n ALA 109 Ca 0.00 0.43 -0.43 0.00 0.00 0.00 0.00 53.44 53.44 1nyn n ALA 109 Cb 0.00 -1.21 -0.04 0.00 0.00 0.00 0.00 19.45 18.20 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 -2.28 2.70 -2.00 0.00 1.51 -1.26 -5.20 117.35 110.82 1nyn s TYR 110 Ca 0.00 -0.61 0.21 0.00 -1.01 0.00 0.00 57.07 55.66 1nyn s TYR 110 Cb 0.00 -4.30 1.26 0.00 -0.11 0.00 0.00 41.96 38.81 1nyn s TYR 110 CO 0.00 -1.64 1.64 0.27 -1.11 0.00 0.00 175.55 174.71