#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 -4.52 7.83 7.64 -1.26 -4.53 113.62 118.79 1nyn n SER 2 Ca 0.00 0.00 -0.29 0.00 1.01 0.00 0.00 58.87 59.59 1nyn n SER 2 Cb 0.00 0.00 0.24 0.00 -1.01 0.00 0.00 64.21 63.44 1nyn n SER 2 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 1nyn s THR 3 N 0.00 2.02 0.29 0.44 -4.23 -1.26 -5.05 115.64 107.86 1nyn s THR 3 Ca 0.00 0.01 0.05 0.00 -1.18 0.00 0.00 61.69 60.56 1nyn s THR 3 Cb 0.00 -2.05 -0.03 0.00 1.34 0.00 0.00 72.50 71.76 1nyn s THR 3 CO 0.00 -0.01 0.24 0.68 -0.54 0.00 0.00 174.62 174.99 1nyn s VAL 4 N -2.48 0.00 0.34 2.29 -7.23 -1.26 -5.04 120.40 107.01 1nyn s VAL 4 Ca 0.68 -1.98 0.08 0.00 -1.81 0.00 0.00 61.98 58.95 1nyn s VAL 4 Cb -0.25 -2.50 -0.04 0.00 0.56 0.00 0.00 36.38 34.15 1nyn s VAL 4 CO 0.64 0.00 0.13 -0.89 -0.31 0.00 0.00 175.10 174.66 1nyn s THR 5 N -3.65 3.01 0.03 5.32 2.01 -0.79 -5.01 115.64 116.56 1nyn s THR 5 Ca 0.40 -1.73 0.04 0.00 0.31 0.00 0.00 61.69 60.71 1nyn s THR 5 Cb 0.04 -2.96 -0.02 0.00 0.01 0.00 0.00 72.50 69.57 1nyn s THR 5 CO 0.23 -0.19 -0.12 -0.75 -0.69 0.00 0.00 174.62 173.10 1nyn s LYS 6 N -3.83 0.85 0.06 4.92 2.20 -1.26 -1.69 119.74 120.99 1nyn s LYS 6 Ca 0.37 -0.66 0.07 0.00 -0.36 0.00 0.00 55.97 55.38 1nyn s LYS 6 Cb -0.02 -0.82 -0.04 0.00 -1.51 0.00 0.00 37.83 35.44 1nyn s LYS 6 CO 0.22 0.20 -0.14 0.71 -0.36 0.00 0.00 175.35 175.99 1nyn s TYR 7 N -0.77 2.66 0.19 4.03 1.51 -0.90 -4.96 117.35 119.11 1nyn s TYR 7 Ca 0.01 -0.19 0.08 0.00 -1.01 0.00 0.00 57.07 55.95 1nyn s TYR 7 Cb -0.07 -1.47 -0.04 0.00 -0.11 0.00 0.00 41.96 40.27 1nyn s TYR 7 CO 0.01 0.33 -0.03 -0.06 -1.11 0.00 0.00 175.55 174.69 1nyn s PHE 8 N -1.03 2.76 -0.33 2.71 0.40 -1.26 -2.17 117.98 119.06 1nyn s PHE 8 Ca 0.17 -0.17 -0.00 0.00 -0.60 0.00 0.00 56.93 56.32 1nyn s PHE 8 Cb -0.11 -1.33 0.13 0.00 0.51 0.00 0.00 43.02 42.23 1nyn s PHE 8 CO 0.08 0.53 0.24 -0.47 0.70 0.00 0.00 175.22 176.30 1nyn s TYR 9 N -1.80 0.13 -0.62 0.36 5.04 -0.59 -0.58 117.35 119.29 1nyn s TYR 9 Ca 0.27 -0.93 -0.26 0.00 -2.44 0.00 0.00 57.07 53.71 1nyn s TYR 9 Cb -0.09 -0.70 -0.04 0.00 0.35 0.00 0.00 41.96 41.48 1nyn s TYR 9 CO 0.18 -0.88 2.03 0.21 -1.34 0.00 0.00 175.55 175.75 1nyn s LYS 10 N 1.71 2.44 1.00 4.97 2.20 -1.26 -2.47 119.74 128.33 1nyn s LYS 10 Ca 0.13 0.71 -0.15 0.00 -0.36 0.00 0.00 55.97 56.31 1nyn s LYS 10 Cb -0.17 -4.52 0.19 0.00 -1.51 0.00 0.00 37.83 31.81 1nyn s LYS 10 CO -0.17 -3.01 1.16 0.20 -0.36 0.00 0.00 175.35 173.16 1nyn s GLY 11 N 9.24 1.61 0.33 5.54 0.00 -0.54 -4.86 107.32 118.64 1nyn s GLY 11 Ca 0.76 -0.73 0.11 0.00 0.00 0.00 0.00 44.72 44.86 1nyn s GLY 11 CO 0.19 -0.04 1.60 -2.09 0.00 0.00 0.00 173.10 172.76 1nyn h GLU 12 N -1.85 0.09 0.00 2.90 4.57 -1.92 -3.36 114.58 115.01 1nyn h GLU 12 Ca -0.49 -0.01 0.00 0.00 -1.18 0.00 0.00 59.36 57.69 1nyn h GLU 12 Cb 1.31 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.88 1nyn h GLU 12 CO 0.51 0.06 0.00 0.09 -1.18 0.00 0.00 179.01 178.49 1nyn n ASN 13 N -5.29 0.00 -4.81 1.04 5.03 -1.26 -5.09 115.26 104.88 1nyn n ASN 13 Ca 0.29 0.00 -0.37 0.00 0.87 0.00 0.00 54.58 55.37 1nyn n ASN 13 Cb 0.97 0.00 -0.06 0.00 -1.02 0.00 0.00 39.78 39.67 1nyn n ASN 13 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 1nyn s THR 14 N -1.00 4.64 -0.19 3.41 2.01 -1.26 -5.06 115.64 118.20 1nyn s THR 14 Ca 0.00 1.26 -0.09 0.00 0.31 0.00 0.00 61.69 63.17 1nyn s THR 14 Cb 0.00 -3.90 -0.05 0.00 0.01 0.00 0.00 72.50 68.56 1nyn s THR 14 CO 0.00 0.39 0.11 -0.62 -0.69 0.00 0.00 174.62 173.81 1nyn s ASP 15 N -1.39 6.02 -0.04 3.53 -1.08 -1.26 -1.47 116.67 120.99 1nyn s ASP 15 Ca 0.36 0.20 0.06 0.00 -0.52 0.00 0.00 52.55 52.65 1nyn s ASP 15 Cb -0.18 -2.04 -0.02 0.00 -1.46 0.00 0.00 42.92 39.21 1nyn s ASP 15 CO 0.21 0.19 -0.22 -0.76 0.52 0.00 0.00 175.17 175.11 1nyn s LEU 16 N 0.26 2.25 0.07 -1.34 1.43 -1.03 -4.69 118.68 115.64 1nyn s LEU 16 Ca 0.07 -0.40 0.10 0.00 -1.03 0.00 0.00 54.13 52.86 1nyn s LEU 16 Cb -0.11 -1.41 -0.03 0.00 0.03 0.00 0.00 46.19 44.66 1nyn s LEU 16 CO -0.01 0.31 -0.26 -0.63 0.23 0.00 0.00 176.35 175.99 1nyn s ILE 17 N -0.54 2.16 0.23 -0.59 1.01 -0.64 -1.55 121.20 121.27 1nyn s ILE 17 Ca 0.08 -1.50 0.04 0.00 0.00 0.00 0.00 60.65 59.27 1nyn s ILE 17 Cb -0.11 -1.86 -0.05 0.00 0.01 0.00 0.00 42.46 40.44 1nyn s ILE 17 CO 0.00 0.28 -0.02 0.68 0.00 0.00 0.00 174.94 175.88 1nyn s VAL 18 N -0.88 1.12 0.50 2.92 -7.23 -0.92 -2.72 120.40 113.19 1nyn s VAL 18 Ca 0.12 -2.05 -0.00 0.00 -1.81 0.00 0.00 61.98 58.24 1nyn s VAL 18 Cb -0.10 -2.31 0.01 0.00 0.56 0.00 0.00 36.38 34.54 1nyn s VAL 18 CO 0.03 -0.36 0.74 -0.36 -0.31 0.00 0.00 175.10 174.85 1nyn s PHE 19 N -3.36 3.11 -0.02 2.82 0.40 -1.26 -2.13 117.98 117.55 1nyn s PHE 19 Ca 0.28 0.22 -0.28 0.00 -0.60 0.00 0.00 56.93 56.55 1nyn s PHE 19 Cb 0.05 -2.52 0.06 0.00 0.51 0.00 0.00 43.02 41.12 1nyn s PHE 19 CO 0.08 -0.60 0.61 0.00 0.70 0.00 0.00 175.22 176.02 1nyn s ALA 20 N -2.69 -1.60 0.00 5.36 0.00 -0.68 -4.68 121.76 117.47 1nyn s ALA 20 Ca 0.52 1.06 0.00 0.00 0.00 0.00 0.00 51.96 53.54 1nyn s ALA 20 Cb -0.10 0.13 0.00 0.00 0.00 0.00 0.00 23.12 23.14 1nyn s ALA 20 CO 0.39 -0.41 0.00 0.00 0.00 0.00 0.00 175.76 175.75 1nyn n ALA 21 N 0.79 0.00 -2.38 0.00 0.00 -1.05 -1.88 120.51 115.98 1nyn n ALA 21 Ca -0.19 -0.06 -0.08 0.00 0.00 0.00 0.00 53.44 53.12 1nyn n ALA 21 Cb 0.58 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.93 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 -2.68 0.40 0.01 0.00 0.15 -1.26 -3.48 113.70 106.84 1nyn s SER 22 Ca 0.00 -0.83 -0.25 0.00 0.70 0.00 0.00 55.95 55.57 1nyn s SER 22 Cb 0.00 0.17 -0.18 0.00 -1.71 0.00 0.00 66.02 64.30 1nyn s SER 22 CO 0.00 -0.51 1.34 -0.08 1.20 0.00 0.00 173.24 175.19 1nyn h GLU 23 N 3.60 -0.14 -0.62 5.44 4.22 -1.99 -2.53 114.58 122.57 1nyn h GLU 23 Ca -0.33 0.01 0.11 0.00 0.08 0.00 0.00 59.36 59.22 1nyn h GLU 23 Cb 1.16 0.03 -0.12 0.00 0.50 0.00 0.00 28.75 30.33 1nyn h GLU 23 CO 0.58 0.20 -0.36 1.49 -2.18 0.00 0.00 179.01 178.75 1nyn h GLU 24 N -0.49 -0.16 -0.37 1.92 4.81 -1.99 0.98 114.58 119.29 1nyn h GLU 24 Ca -0.01 0.01 0.07 0.00 -0.13 0.00 0.00 59.36 59.30 1nyn h GLU 24 Cb 0.40 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.80 1nyn h GLU 24 CO 0.02 -0.10 0.25 -0.07 -0.73 0.00 0.00 179.01 178.38 1nyn h LEU 25 N -0.16 0.16 0.00 1.64 3.38 -1.97 -2.30 115.31 116.06 1nyn h LEU 25 Ca 0.23 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.20 1nyn h LEU 25 Cb 0.56 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.27 1nyn h LEU 25 CO -0.70 0.10 0.00 0.52 0.09 0.00 0.00 178.44 178.45 1nyn n VAL 26 N -4.47 0.00 0.31 1.22 0.31 0.32 -1.91 118.33 114.11 1nyn n VAL 26 Ca 0.05 0.88 0.02 0.00 -0.01 0.00 0.00 64.34 65.28 1nyn n VAL 26 Cb 0.31 -1.85 0.08 0.00 -0.91 0.00 0.00 33.84 31.47 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 0.00 0.02 4.52 3.58 -0.87 0.78 116.42 124.45 1nyn h ASP 27 Ca 0.00 0.00 -0.09 0.00 0.42 0.00 0.00 57.03 57.36 1nyn h ASP 27 Cb 0.00 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.04 1nyn h ASP 27 CO 0.00 0.00 -0.46 -0.33 -2.88 0.00 0.00 179.24 175.57 1nyn h GLU 28 N 0.00 0.04 -0.36 0.28 4.39 -1.31 -3.35 114.58 114.27 1nyn h GLU 28 Ca 0.02 -0.07 0.08 0.00 0.34 0.00 0.00 59.36 59.72 1nyn h GLU 28 Cb 1.94 0.03 -0.07 0.00 -0.10 0.00 0.00 28.75 30.54 1nyn h GLU 28 CO -0.00 1.04 -0.12 -0.92 -1.16 0.00 0.00 179.01 177.84 1nyn h TYR 29 N -0.90 -0.28 -0.99 4.33 3.20 0.13 0.08 116.97 122.54 1nyn h TYR 29 Ca -0.11 0.04 0.35 0.00 3.14 0.00 0.00 58.73 62.14 1nyn h TYR 29 Cb 1.18 0.18 -0.18 0.00 1.54 0.00 0.00 36.73 39.46 1nyn h TYR 29 CO 0.22 -0.20 0.34 -0.07 -1.64 0.00 0.00 178.16 176.82 1nyn h LEU 30 N -0.05 0.03 -0.12 2.82 3.38 -1.63 4.49 115.31 124.23 1nyn h LEU 30 Ca 0.18 0.26 0.00 0.00 0.09 0.00 0.00 57.88 58.41 1nyn h LEU 30 Cb 0.32 0.34 0.00 0.00 0.09 0.00 0.00 40.66 41.41 1nyn h LEU 30 CO -0.40 -0.37 0.00 0.29 0.09 0.00 0.00 178.44 178.05 1nyn n LYS 31 N -5.32 0.20 -3.43 1.13 5.02 -0.03 -4.08 118.16 111.65 1nyn n LYS 31 Ca 0.31 0.22 -0.26 0.00 -2.02 0.00 0.00 58.31 56.56 1nyn n LYS 31 Cb 1.05 -1.76 -0.09 0.00 -0.02 0.00 0.00 35.03 34.21 1nyn n LYS 31 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1nyn n ASN 32 N -2.13 1.85 -4.69 4.39 5.03 1.47 -5.09 115.26 116.10 1nyn n ASN 32 Ca 0.05 -3.00 -0.42 0.00 0.87 0.00 0.00 54.58 52.07 1nyn n ASN 32 Cb 0.37 -0.66 -0.03 0.00 -1.02 0.00 0.00 39.78 38.45 1nyn n ASN 32 CO 0.00 0.00 0.00 -2.16 -1.83 0.00 0.00 177.26 173.27 1nyn s PRO 33 N -1.50 4.34 0.00 3.52 0.04 -1.02 -4.74 135.00 135.63 1nyn s PRO 33 Ca 0.35 1.74 0.00 0.00 0.04 0.00 0.00 61.00 63.13 1nyn s PRO 33 Cb 0.10 -3.56 0.00 0.00 0.04 0.00 0.00 34.50 31.09 1nyn s PRO 33 CO -0.10 -0.47 0.00 0.43 0.04 0.00 0.00 177.00 176.90 1nyn n SER 34 N 5.21 0.00 -3.28 6.66 7.64 -1.26 -5.01 113.62 123.58 1nyn n SER 34 Ca 0.11 0.00 -0.29 0.00 1.01 0.00 0.00 58.87 59.70 1nyn n SER 34 Cb 0.46 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.63 1nyn n SER 34 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 1nyn n ILE 35 N -0.37 2.82 0.00 0.44 2.08 -1.26 -3.50 119.36 119.57 1nyn n ILE 35 Ca 0.00 -1.79 0.00 0.00 0.56 0.00 0.00 62.75 61.52 1nyn n ILE 35 Cb 0.00 -2.28 0.00 0.00 -0.75 0.00 0.00 39.64 36.61 1nyn n ILE 35 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1nyn n GLY 36 N 3.83 -0.15 0.09 7.39 0.00 -1.26 -4.90 105.19 110.19 1nyn n GLY 36 Ca 0.53 0.01 -0.05 0.00 0.00 0.00 0.00 46.02 46.51 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 -0.27 1.61 3.64 -1.88 -3.31 116.57 116.36 1nyn h LYS 37 Ca 0.00 0.00 0.08 0.00 -1.27 0.00 0.00 60.65 59.46 1nyn h LYS 37 Cb 0.00 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.81 1nyn h LYS 37 CO 0.00 0.51 0.34 1.25 -2.27 0.00 0.00 179.45 179.28 1nyn h LEU 38 N 0.00 0.00 -0.63 5.20 5.85 -1.91 0.33 115.31 124.15 1nyn h LEU 38 Ca -0.17 0.00 -0.15 0.00 0.84 0.00 0.00 57.88 58.40 1nyn h LEU 38 Cb 1.78 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 42.79 1nyn h LEU 38 CO 0.08 0.00 -0.66 0.77 -0.34 0.00 0.00 178.44 178.29 1nyn h SER 39 N 0.00 0.16 1.35 1.25 4.64 -1.84 -1.34 113.55 117.76 1nyn h SER 39 Ca 0.13 -0.10 -0.12 0.00 -0.47 0.00 0.00 61.79 61.23 1nyn h SER 39 Cb 0.80 -0.05 -0.02 0.00 -0.31 0.00 0.00 62.40 62.83 1nyn h SER 39 CO -0.00 0.77 -0.58 -0.08 -0.87 0.00 0.00 176.83 176.06 1nyn h GLU 40 N 0.09 0.00 0.00 4.77 4.81 -0.56 -3.37 114.58 120.33 1nyn h GLU 40 Ca -0.01 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.22 1nyn h GLU 40 Cb 1.17 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.55 1nyn h GLU 40 CO 0.09 0.58 -0.08 0.28 -0.73 0.00 0.00 179.01 179.16 1nyn h VAL 41 N 0.00 0.00 -3.05 0.32 2.07 -1.27 -3.45 116.25 110.87 1nyn h VAL 41 Ca -0.01 -0.54 -0.54 0.00 0.82 0.00 0.00 66.70 66.44 1nyn h VAL 41 Cb 1.41 0.00 0.01 0.00 -1.52 0.00 0.00 31.29 31.19 1nyn h VAL 41 CO 0.08 0.00 0.69 -0.69 0.02 0.00 0.00 177.57 177.67 1nyn s VAL 42 N -1.40 3.76 -0.12 2.57 1.01 -0.52 -2.53 120.40 123.17 1nyn s VAL 42 Ca -0.02 1.23 -0.26 0.00 0.00 0.00 0.00 61.98 62.92 1nyn s VAL 42 Cb 0.00 -3.79 -0.23 0.00 0.00 0.00 0.00 36.38 32.36 1nyn s VAL 42 CO 0.03 0.06 0.77 -0.08 0.00 0.00 0.00 175.10 175.88 1nyn h GLU 43 N 7.14 -0.01 -6.40 2.72 4.81 -1.83 -3.43 114.58 117.57 1nyn h GLU 43 Ca -0.40 0.00 -0.67 0.00 -0.13 0.00 0.00 59.36 58.17 1nyn h GLU 43 Cb 1.20 0.00 -0.15 0.00 0.63 0.00 0.00 28.75 30.43 1nyn h GLU 43 CO 0.86 0.86 -0.71 -0.51 -0.73 0.00 0.00 179.01 178.78 1nyn s LEU 44 N -8.36 3.19 -0.80 1.64 1.02 -1.26 -5.07 118.68 109.04 1nyn s LEU 44 Ca -0.17 -0.24 -0.09 0.00 0.02 0.00 0.00 54.13 53.64 1nyn s LEU 44 Cb -0.02 -1.92 0.21 0.00 0.02 0.00 0.00 46.19 44.48 1nyn s LEU 44 CO 0.63 0.22 0.71 -0.36 0.02 0.00 0.00 176.35 177.57 1nyn s PHE 45 N -1.16 3.72 0.06 0.29 0.40 -1.26 -4.81 117.98 115.23 1nyn s PHE 45 Ca 0.21 -2.38 -0.08 0.00 -0.60 0.00 0.00 56.93 54.08 1nyn s PHE 45 Cb -0.11 -3.58 0.03 0.00 0.51 0.00 0.00 43.02 39.86 1nyn s PHE 45 CO 0.13 -0.92 0.37 -1.91 0.70 0.00 0.00 175.22 173.59 1nyn n GLU 46 N 3.54 0.23 -4.20 0.44 2.13 -1.26 -5.12 120.64 116.39 1nyn n GLU 46 Ca 0.14 -0.52 -0.23 0.00 0.66 0.00 0.00 57.16 57.20 1nyn n GLU 46 Cb 0.43 0.71 -0.17 0.00 0.27 0.00 0.00 31.44 32.68 1nyn n GLU 46 CO 0.00 0.00 0.00 0.08 -0.41 0.00 0.00 177.13 176.80 1nyn s VAL 47 N -2.38 0.83 0.13 6.31 1.01 -1.26 -4.86 120.40 120.18 1nyn s VAL 47 Ca 0.08 -0.25 0.09 0.00 0.00 0.00 0.00 61.98 61.90 1nyn s VAL 47 Cb -0.01 -0.83 -0.04 0.00 0.00 0.00 0.00 36.38 35.50 1nyn s VAL 47 CO 0.02 0.31 -0.17 -0.36 0.00 0.00 0.00 175.10 174.90 1nyn s PHE 48 N 1.13 2.55 0.17 5.22 0.08 -1.10 -3.00 117.98 123.03 1nyn s PHE 48 Ca -0.07 -0.25 -0.09 0.00 0.12 0.00 0.00 56.93 56.63 1nyn s PHE 48 Cb -0.14 -1.33 -0.01 0.00 -0.57 0.00 0.00 43.02 40.97 1nyn s PHE 48 CO -0.01 0.41 0.30 -0.08 -0.10 0.00 0.00 175.22 175.74 1nyn s THR 49 N -1.24 0.06 0.51 0.64 -1.32 -0.90 -1.63 115.64 111.76 1nyn s THR 49 Ca 0.19 -1.35 -0.20 0.00 -1.21 0.00 0.00 61.69 59.12 1nyn s THR 49 Cb -0.10 -1.83 -0.07 0.00 -1.51 0.00 0.00 72.50 68.99 1nyn s THR 49 CO 0.11 -0.28 1.11 -2.16 -2.21 0.00 0.00 174.62 171.19 1nyn s PRO 50 N -3.96 3.56 0.00 7.08 0.04 -1.26 -2.80 135.00 137.65 1nyn s PRO 50 Ca 0.17 1.56 0.00 0.00 0.04 0.00 0.00 61.00 62.77 1nyn s PRO 50 Cb 0.03 -2.10 0.00 0.00 0.04 0.00 0.00 34.50 32.47 1nyn s PRO 50 CO 0.00 -0.67 0.00 0.94 0.04 0.00 0.00 177.00 177.31 1nyn n GLN 51 N -1.06 0.00 -4.45 4.56 7.27 -1.26 -4.92 117.38 117.52 1nyn n GLN 51 Ca 0.10 0.00 -0.22 0.00 0.07 0.00 0.00 57.00 56.95 1nyn n GLN 51 Cb 0.51 -0.03 -0.10 0.00 2.41 0.00 0.00 30.24 33.03 1nyn n GLN 51 CO 0.00 0.00 0.00 0.16 0.07 0.00 0.00 177.06 177.29 1nyn s ASP 52 N -4.92 2.68 0.14 1.69 1.47 -1.26 -5.08 116.67 111.39 1nyn s ASP 52 Ca 0.00 -1.28 0.00 0.00 1.18 0.00 0.00 52.55 52.45 1nyn s ASP 52 Cb 0.00 -0.15 0.00 0.00 -0.34 0.00 0.00 42.92 42.43 1nyn s ASP 52 CO 0.00 -0.46 0.00 0.61 0.68 0.00 0.00 175.17 176.00 1nyn n GLY 53 N -0.65 -1.66 0.27 2.12 0.00 -1.26 -4.31 105.19 99.70 1nyn n GLY 53 Ca -0.04 -1.39 -0.09 0.00 0.00 0.00 0.00 46.02 44.50 1nyn n GLY 53 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1nyn h ARG 54 N -0.50 0.83 0.00 1.61 3.08 -2.01 -3.49 114.38 113.90 1nyn h ARG 54 Ca 0.00 -0.35 0.00 0.00 0.07 0.00 0.00 59.98 59.70 1nyn h ARG 54 Cb 0.49 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 30.51 1nyn h ARG 54 CO 0.01 0.98 0.00 0.41 -1.07 0.00 0.00 179.97 180.30 1nyn n GLY 55 N -0.18 3.78 0.56 0.04 0.00 -1.26 -5.05 105.19 103.08 1nyn n GLY 55 Ca -0.00 -1.69 0.00 0.00 0.00 0.00 0.00 46.02 44.33 1nyn n GLY 55 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nyn n ALA 56 N -1.39 -1.08 -1.17 4.61 0.00 -1.26 -4.55 120.51 115.66 1nyn n ALA 56 Ca 0.00 0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.61 1nyn n ALA 56 Cb 0.00 -0.85 0.00 0.00 0.00 0.00 0.00 19.45 18.60 1nyn n ALA 56 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 1nyn n GLU 57 N -1.81 -1.26 -4.65 0.00 4.07 -1.26 -4.80 120.64 110.94 1nyn n GLU 57 Ca 0.00 0.00 -0.29 0.00 -0.06 0.00 0.00 57.16 56.81 1nyn n GLU 57 Cb 0.16 -3.83 -0.09 0.00 -0.06 0.00 0.00 31.44 27.62 1nyn n GLU 57 CO 0.00 0.00 0.00 0.20 -0.06 0.00 0.00 177.13 177.27 1nyn s GLY 58 N -1.09 2.73 1.19 8.31 0.00 -1.26 -5.13 107.32 112.08 1nyn s GLY 58 Ca 0.00 -1.16 -0.14 0.00 0.00 0.00 0.00 44.72 43.42 1nyn s GLY 58 CO 0.00 -2.07 0.80 1.18 0.00 0.00 0.00 173.10 173.01 1nyn n GLU 59 N -1.07 -2.52 -3.61 2.90 4.71 -1.26 -5.04 120.64 114.74 1nyn n GLU 59 Ca -0.12 -0.71 -0.14 0.00 -0.01 0.00 0.00 57.16 56.18 1nyn n GLU 59 Cb 0.67 -2.06 -0.05 0.00 -1.01 0.00 0.00 31.44 28.99 1nyn n GLU 59 CO 0.00 0.00 0.00 1.28 0.09 0.00 0.00 177.13 178.50 1nyn n LEU 60 N -4.39 0.00 -3.61 -4.62 4.77 -1.26 -4.66 117.00 103.22 1nyn n LEU 60 Ca 0.02 -2.34 -0.11 0.00 -0.03 0.00 0.00 56.01 53.55 1nyn n LEU 60 Cb 0.56 1.47 -0.06 0.00 -2.33 0.00 0.00 43.42 43.05 1nyn n LEU 60 CO 0.57 -0.43 0.67 -0.83 -1.33 0.00 0.00 177.39 176.03 1nyn s GLY 61 N -2.74 -0.28 0.60 -0.72 0.00 -1.12 -4.94 107.32 98.11 1nyn s GLY 61 Ca 0.28 2.29 -0.18 0.00 0.00 0.00 0.00 44.72 47.11 1nyn s GLY 61 CO 0.20 1.55 1.16 0.00 0.00 0.00 0.00 173.10 176.01 1nyn s ALA 62 N -0.19 2.56 0.34 3.20 0.00 -1.26 -2.11 121.76 124.30 1nyn s ALA 62 Ca 0.00 0.84 0.00 0.00 0.00 0.00 0.00 51.96 52.81 1nyn s ALA 62 Cb -0.03 -3.39 0.02 0.00 0.00 0.00 0.00 23.12 19.71 1nyn s ALA 62 CO -0.02 -1.08 0.15 0.00 0.00 0.00 0.00 175.76 174.82 1nyn n ALA 63 N -1.71 0.08 -2.54 0.00 0.00 -1.16 -4.87 120.51 110.31 1nyn n ALA 63 Ca 0.12 -0.32 -0.25 0.00 0.00 0.00 0.00 53.44 52.99 1nyn n ALA 63 Cb 0.51 0.06 -0.10 0.00 0.00 0.00 0.00 19.45 19.92 1nyn n ALA 63 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1nyn s SER 64 N -1.63 3.88 0.37 0.00 0.01 -1.26 -5.02 113.70 110.05 1nyn s SER 64 Ca 0.10 -1.12 0.08 0.00 1.31 0.00 0.00 55.95 56.32 1nyn s SER 64 Cb -0.01 -0.41 0.73 0.00 0.21 0.00 0.00 66.02 66.54 1nyn s SER 64 CO 0.07 -0.21 1.90 0.11 0.41 0.00 0.00 173.24 175.52 1nyn h LYS 65 N 1.96 0.32 -0.71 12.44 1.57 -2.00 -2.53 116.57 127.62 1nyn h LYS 65 Ca -0.42 -0.07 0.11 0.00 -1.87 0.00 0.00 60.65 58.40 1nyn h LYS 65 Cb 1.25 -0.04 -0.08 0.00 0.08 0.00 0.00 32.23 33.44 1nyn h LYS 65 CO 0.69 0.43 0.32 0.00 -0.57 0.00 0.00 179.45 180.32 1nyn h ALA 66 N 1.60 0.99 0.39 3.86 0.00 -1.99 0.12 119.26 124.23 1nyn h ALA 66 Ca 0.06 0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.03 1nyn h ALA 66 Cb 0.37 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1nyn h ALA 66 CO 0.02 -0.12 -0.19 1.96 0.00 0.00 0.00 179.25 180.92 1nyn h GLN 67 N 0.53 -0.51 -0.84 0.00 4.20 -1.88 -3.05 115.11 113.56 1nyn h GLN 67 Ca 0.37 0.03 0.24 0.00 0.06 0.00 0.00 58.65 59.36 1nyn h GLN 67 Cb 0.46 0.12 -0.03 0.00 0.30 0.00 0.00 27.48 28.32 1nyn h GLN 67 CO -0.32 -0.34 0.87 0.28 -0.67 0.00 0.00 178.83 178.65 1nyn h VAL 68 N -1.12 0.19 -0.30 -0.54 2.07 -1.30 0.89 116.25 116.14 1nyn h VAL 68 Ca -0.05 0.00 -0.17 0.00 0.82 0.00 0.00 66.70 67.29 1nyn h VAL 68 Cb 0.40 0.32 -0.00 0.00 -1.52 0.00 0.00 31.29 30.49 1nyn h VAL 68 CO 0.09 0.00 -0.49 -0.33 0.02 0.00 0.00 177.57 176.86 1nyn h GLU 69 N 0.00 0.83 0.00 1.57 5.08 -0.66 -0.72 114.58 120.69 1nyn h GLU 69 Ca 0.40 -0.49 -0.00 0.00 -1.00 0.00 0.00 59.36 58.27 1nyn h GLU 69 Cb 2.13 0.04 -0.00 0.00 0.50 0.00 0.00 28.75 31.43 1nyn h GLU 69 CO -0.00 1.13 -0.00 -0.91 -1.00 0.00 0.00 179.01 178.22 1nyn h ASN 70 N 0.66 0.00 0.00 1.42 2.35 0.90 -3.25 115.58 117.66 1nyn h ASN 70 Ca 0.03 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.78 1nyn h ASN 70 Cb 1.08 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.45 1nyn h ASN 70 CO 0.11 0.00 -0.25 -0.62 -1.65 0.00 0.00 177.43 175.02 1nyn n GLU 71 N -3.30 0.15 -2.75 0.81 4.71 -1.01 -4.89 120.64 114.37 1nyn n GLU 71 Ca -0.03 0.15 -0.05 0.00 -0.01 0.00 0.00 57.16 57.22 1nyn n GLU 71 Cb 0.08 -0.86 0.03 0.00 -1.01 0.00 0.00 31.44 29.67 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 -3.05 -3.40 0.00 -0.32 1.16 -0.31 -5.06 117.46 106.49 1nyn n PHE 72 Ca -0.04 -1.42 0.00 0.00 -1.87 0.00 0.00 57.45 54.13 1nyn n PHE 72 Cb 0.13 1.48 0.00 0.00 -1.61 0.00 0.00 39.48 39.48 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 2.48 3.16 5.20 4.97 0.00 -1.12 -4.66 105.19 115.22 1nyn n GLY 73 Ca 0.14 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.89 1nyn n GLY 73 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1nyn n LYS 74 N 0.00 0.00 -0.85 1.61 5.02 -1.26 -2.67 118.16 120.01 1nyn n LYS 74 Ca 0.00 0.00 0.04 0.00 -2.02 0.00 0.00 58.31 56.33 1nyn n LYS 74 Cb 0.00 0.00 0.17 0.00 -0.02 0.00 0.00 35.03 35.18 1nyn n LYS 74 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1nyn n GLY 75 N 0.00 4.53 3.05 0.72 0.00 -1.26 -4.95 105.19 107.27 1nyn n GLY 75 Ca 0.00 -1.31 -0.32 0.00 0.00 0.00 0.00 46.02 44.38 1nyn n GLY 75 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nyn s LYS 76 N -2.75 1.65 1.01 1.61 1.02 -1.09 -5.10 119.74 116.08 1nyn s LYS 76 Ca 0.38 -1.84 -0.16 0.00 0.02 0.00 0.00 55.97 54.37 1nyn s LYS 76 Cb 0.37 -3.29 0.03 0.00 -0.52 0.00 0.00 37.83 34.42 1nyn s LYS 76 CO -0.08 -0.96 0.07 1.63 -0.92 0.00 0.00 175.35 175.10 1nyn n LYS 77 N 4.35 -0.63 0.02 1.68 5.02 -1.26 -4.49 118.16 122.84 1nyn n LYS 77 Ca 0.02 -0.16 0.20 0.00 -2.02 0.00 0.00 58.31 56.35 1nyn n LYS 77 Cb 0.42 -1.68 0.70 0.00 -0.02 0.00 0.00 35.03 34.45 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 -1.63 0.69 0.68 -0.18 6.09 -1.98 -2.24 117.51 118.94 1nyn h ILE 78 Ca -0.46 0.00 -0.03 0.00 -1.37 0.00 0.00 64.86 63.00 1nyn h ILE 78 Cb 1.31 0.74 -0.01 0.00 0.47 0.00 0.00 36.82 39.33 1nyn h ILE 78 CO 0.34 0.00 -0.47 -0.33 -3.07 0.00 0.00 178.15 174.62 1nyn h GLU 79 N 0.00 -1.05 0.15 2.19 5.08 -2.00 -2.10 114.58 116.84 1nyn h GLU 79 Ca 0.23 0.07 0.02 0.00 -1.00 0.00 0.00 59.36 58.68 1nyn h GLU 79 Cb 0.97 0.24 -0.03 0.00 0.50 0.00 0.00 28.75 30.43 1nyn h GLU 79 CO -0.00 -0.70 -0.29 0.93 -1.00 0.00 0.00 179.01 177.94 1nyn h GLU 80 N -1.09 -0.51 -0.92 2.33 5.08 -1.71 -1.92 114.58 115.84 1nyn h GLU 80 Ca -0.09 0.03 0.18 0.00 -1.00 0.00 0.00 59.36 58.48 1nyn h GLU 80 Cb 0.89 0.12 -0.17 0.00 0.50 0.00 0.00 28.75 30.09 1nyn h GLU 80 CO 0.06 -0.34 -0.24 0.28 -1.00 0.00 0.00 179.01 177.76 1nyn n VAL 81 N -5.40 -0.40 -0.20 3.13 0.31 -1.01 0.25 118.33 115.01 1nyn n VAL 81 Ca -0.07 2.10 -0.02 0.00 -0.01 0.00 0.00 64.34 66.35 1nyn n VAL 81 Cb 0.31 -2.90 0.19 0.00 -0.91 0.00 0.00 33.84 30.54 1nyn n VAL 81 CO 0.00 0.00 0.00 0.40 -1.32 0.00 0.00 176.83 175.91 1nyn h ILE 82 N 0.00 1.22 0.35 2.52 2.04 -0.65 -2.83 117.51 120.15 1nyn h ILE 82 Ca 0.43 -0.61 -0.02 0.00 1.00 0.00 0.00 64.86 65.66 1nyn h ILE 82 Cb 0.66 0.34 0.00 0.00 -0.74 0.00 0.00 36.82 37.08 1nyn h ILE 82 CO -0.94 0.26 -0.17 -0.78 0.00 0.00 0.00 178.15 176.52 1nyn h ASP 83 N 0.97 -0.40 -1.74 1.72 3.58 0.39 -2.21 116.42 118.72 1nyn h ASP 83 Ca 0.24 0.01 0.51 0.00 0.42 0.00 0.00 57.03 58.22 1nyn h ASP 83 Cb 0.09 0.10 -0.08 0.00 1.72 0.00 0.00 39.33 41.16 1nyn h ASP 83 CO -0.03 -0.21 1.24 0.18 -2.88 0.00 0.00 179.24 177.54 1nyn n LEU 84 N -3.66 0.03 0.02 2.28 4.77 0.11 -0.83 117.00 119.71 1nyn n LEU 84 Ca -0.06 0.96 -0.01 0.00 -0.03 0.00 0.00 56.01 56.87 1nyn n LEU 84 Cb 0.18 -0.48 -0.00 0.00 -2.33 0.00 0.00 43.42 40.79 1nyn n LEU 84 CO 0.14 -0.97 0.15 0.40 -1.33 0.00 0.00 177.39 175.78 1nyn h ILE 85 N 0.00 0.00 0.00 -0.08 2.04 -1.23 -3.10 117.51 115.14 1nyn h ILE 85 Ca 0.86 -0.11 0.00 0.00 1.00 0.00 0.00 64.86 66.61 1nyn h ILE 85 Cb 3.35 0.00 0.00 0.00 -0.74 0.00 0.00 36.82 39.43 1nyn h ILE 85 CO -0.07 0.00 0.42 0.18 0.00 0.00 0.00 178.15 178.68 1nyn n LEU 86 N -2.48 0.09 0.01 1.44 4.77 -0.01 0.46 117.00 121.27 1nyn n LEU 86 Ca -0.01 0.29 -0.18 0.00 -0.03 0.00 0.00 56.01 56.08 1nyn n LEU 86 Cb 0.03 -0.22 -0.11 0.00 -2.33 0.00 0.00 43.42 40.79 1nyn n LEU 86 CO 0.02 -0.32 0.23 0.03 -1.33 0.00 0.00 177.39 176.03 1nyn h ARG 87 N 0.00 0.47 -1.01 3.23 3.08 -1.14 -3.41 114.38 115.61 1nyn h ARG 87 Ca 0.00 -0.49 -0.38 0.00 0.07 0.00 0.00 59.98 59.18 1nyn h ARG 87 Cb 0.83 0.14 -0.27 0.00 0.08 0.00 0.00 29.97 30.75 1nyn h ARG 87 CO 0.00 1.14 -0.81 -1.71 -1.07 0.00 0.00 179.97 177.52 1nyn n ASN 88 N -4.16 -1.14 0.00 7.04 4.05 0.17 -4.99 115.26 116.23 1nyn n ASN 88 Ca -0.10 -3.13 0.00 0.00 0.45 0.00 0.00 54.58 51.80 1nyn n ASN 88 Cb 0.70 0.61 0.00 0.00 1.23 0.00 0.00 39.78 42.32 1nyn n ASN 88 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1nyn n GLY 89 N 1.10 -0.78 3.76 8.20 0.00 -0.82 -4.77 105.19 111.87 1nyn n GLY 89 Ca 0.15 -0.07 -0.33 0.00 0.00 0.00 0.00 46.02 45.77 1nyn n GLY 89 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1nyn s LYS 90 N 0.00 2.61 0.00 1.61 -2.85 0.25 -4.23 119.74 117.14 1nyn s LYS 90 Ca 0.00 1.48 0.00 0.00 -1.00 0.00 0.00 55.97 56.45 1nyn s LYS 90 Cb 0.00 -1.92 0.00 0.00 -2.06 0.00 0.00 37.83 33.85 1nyn s LYS 90 CO 0.00 -1.41 0.80 -0.35 0.10 0.00 0.00 175.35 174.49 1nyn n PRO 91 N -2.51 0.65 0.19 1.78 -0.04 -1.26 -4.26 135.00 129.55 1nyn n PRO 91 Ca 0.11 0.00 0.13 0.00 -0.04 0.00 0.00 63.50 63.70 1nyn n PRO 91 Cb 0.52 -1.17 0.68 0.00 -0.04 0.00 0.00 33.50 33.48 1nyn n PRO 91 CO 0.00 0.00 0.00 -0.97 -0.04 0.00 0.00 175.50 174.49 1nyn h ASN 92 N 1.01 0.00 0.00 3.54 -1.24 -1.99 -3.44 115.58 113.46 1nyn h ASN 92 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.01 1nyn h ASN 92 Cb 0.65 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.70 1nyn h ASN 92 CO 0.00 0.00 0.00 -1.54 -1.29 0.00 0.00 177.43 174.60 1nyn n SER 93 N -2.39 0.00 -3.85 1.15 3.41 -1.26 -5.17 113.62 105.51 1nyn n SER 93 Ca -0.02 0.00 -0.16 0.00 -0.26 0.00 0.00 58.87 58.44 1nyn n SER 93 Cb 0.05 0.00 0.08 0.00 -0.26 0.00 0.00 64.21 64.07 1nyn n SER 93 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 1nyn n THR 94 N -0.61 0.00 -2.75 6.66 -2.24 -1.26 -5.00 114.28 109.07 1nyn n THR 94 Ca 0.00 -1.16 -0.42 0.00 -2.27 0.00 0.00 64.05 60.20 1nyn n THR 94 Cb 0.00 -0.95 0.01 0.00 -2.10 0.00 0.00 70.33 67.29 1nyn n THR 94 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1nyn n THR 95 N -2.29 5.60 -2.92 4.28 -2.24 -1.26 -5.00 114.28 110.45 1nyn n THR 95 Ca 0.12 -5.77 -0.41 0.00 -2.27 0.00 0.00 64.05 55.72 1nyn n THR 95 Cb 0.42 -1.88 -0.04 0.00 -2.10 0.00 0.00 70.33 66.73 1nyn n THR 95 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 1nyn s SER 96 N -1.33 7.13 -0.36 3.42 1.04 -1.26 -4.98 113.70 117.37 1nyn s SER 96 Ca 0.36 1.37 -0.28 0.00 0.48 0.00 0.00 55.95 57.88 1nyn s SER 96 Cb 0.12 -2.47 -0.02 0.00 0.10 0.00 0.00 66.02 63.75 1nyn s SER 96 CO -0.01 -0.16 1.79 -0.94 0.98 0.00 0.00 173.24 174.90 1nyn s SER 97 N 0.85 5.85 -0.28 7.02 1.04 -1.26 -4.95 113.70 121.98 1nyn s SER 97 Ca 0.43 1.21 0.02 0.00 0.48 0.00 0.00 55.95 58.09 1nyn s SER 97 Cb -0.19 -2.53 0.07 0.00 0.10 0.00 0.00 66.02 63.48 1nyn s SER 97 CO 0.22 -1.76 -0.04 -0.76 0.98 0.00 0.00 173.24 171.88 1nyn s LEU 98 N 7.05 3.42 -0.08 2.42 1.43 -1.26 -4.91 118.68 126.74 1nyn s LEU 98 Ca 0.78 -1.54 -0.00 0.00 -1.03 0.00 0.00 54.13 52.34 1nyn s LEU 98 Cb -0.21 -1.40 0.00 0.00 0.03 0.00 0.00 46.19 44.61 1nyn s LEU 98 CO 0.32 -0.27 0.01 0.29 0.23 0.00 0.00 176.35 176.93 1nyn n LYS 99 N 4.49 -1.19 -0.74 1.70 5.02 -1.26 -4.61 118.16 121.57 1nyn n LYS 99 Ca -0.08 1.34 0.10 0.00 -2.02 0.00 0.00 58.31 57.65 1nyn n LYS 99 Cb 0.43 -2.08 -0.03 0.00 -0.02 0.00 0.00 35.03 33.33 1nyn n LYS 99 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1nyn n THR 100 N 1.26 0.00 1.06 -0.18 -2.24 -1.26 -4.04 114.28 108.88 1nyn n THR 100 Ca -0.01 0.00 0.13 0.00 -2.27 0.00 0.00 64.05 61.90 1nyn n THR 100 Cb 0.35 -0.25 0.39 0.00 -2.10 0.00 0.00 70.33 68.72 1nyn n THR 100 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 1nyn n LYS 101 N -2.42 0.13 0.00 -0.78 5.02 -1.26 -4.98 118.16 113.87 1nyn n LYS 101 Ca 0.00 -0.06 0.00 0.00 -2.02 0.00 0.00 58.31 56.24 1nyn n LYS 101 Cb 0.59 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 34.10 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 1.47 0.75 0.00 0.72 0.00 -1.26 -5.04 105.19 101.82 1nyn n GLY 102 Ca 0.07 -1.30 0.00 0.00 0.00 0.00 0.00 46.02 44.79 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 -1.13 0.48 3.44 -0.02 0.00 -1.26 -5.05 105.19 101.64 1nyn n GLY 103 Ca 0.00 -0.61 -0.44 0.00 0.00 0.00 0.00 46.02 44.97 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 0.00 7.00 0.43 1.61 0.02 -1.26 -4.98 114.94 117.76 1nyn s ASN 104 Ca 0.00 -2.86 0.06 0.00 -1.02 0.00 0.00 52.86 49.05 1nyn s ASN 104 Cb 0.00 -2.37 -0.05 0.00 0.02 0.00 0.00 41.25 38.85 1nyn s ASN 104 CO 0.00 -0.75 0.10 0.00 0.02 0.00 0.00 177.10 176.47 1nyn s ALA 105 N 1.40 3.53 -1.32 0.60 0.00 -1.26 -5.03 121.76 119.67 1nyn s ALA 105 Ca 0.38 -1.91 -0.15 0.00 0.00 0.00 0.00 51.96 50.28 1nyn s ALA 105 Cb -0.04 -0.11 0.09 0.00 0.00 0.00 0.00 23.12 23.06 1nyn s ALA 105 CO -0.03 -0.14 1.83 0.41 0.00 0.00 0.00 175.76 177.83 1nyn n GLY 106 N -1.16 3.49 7.00 0.00 0.00 -1.26 -4.94 105.19 108.33 1nyn n GLY 106 Ca -0.05 -1.68 0.00 0.00 0.00 0.00 0.00 46.02 44.29 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 5.35 0.00 -4.11 2.61 -2.24 -1.26 -4.75 114.28 109.88 1nyn n THR 107 Ca 0.46 0.00 -0.34 0.00 -2.27 0.00 0.00 64.05 61.90 1nyn n THR 107 Cb 0.42 0.00 -0.01 0.00 -2.10 0.00 0.00 70.33 68.65 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 14.00 -4.11 -3.47 -0.78 5.02 -1.26 -4.91 118.16 122.65 1nyn n LYS 108 Ca 0.00 0.46 -0.26 0.00 -2.02 0.00 0.00 58.31 56.49 1nyn n LYS 108 Cb 0.00 -5.26 -0.12 0.00 -0.02 0.00 0.00 35.03 29.62 1nyn n LYS 108 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1nyn s ALA 109 N -3.28 0.45 -0.49 7.82 0.00 -1.26 -5.08 121.76 119.92 1nyn s ALA 109 Ca 0.72 -1.25 -0.43 0.00 0.00 0.00 0.00 51.96 51.00 1nyn s ALA 109 Cb -0.38 -1.60 -0.19 0.00 0.00 0.00 0.00 23.12 20.95 1nyn s ALA 109 CO 0.89 -1.89 2.06 0.66 0.00 0.00 0.00 175.76 177.48 1nyn n TYR 110 N 4.70 1.18 -1.79 0.00 4.01 -1.26 -5.23 117.16 118.77 1nyn n TYR 110 Ca 0.03 0.78 0.00 0.00 -0.16 0.00 0.00 57.90 58.56 1nyn n TYR 110 Cb 0.41 -2.24 0.00 0.00 -0.31 0.00 0.00 39.34 37.20 1nyn n TYR 110 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49