#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 -1.59 -0.07 7.83 3.41 -1.26 -4.66 113.62 117.28 1nyn n SER 2 Ca 0.00 -0.13 0.25 0.00 -0.26 0.00 0.00 58.87 58.73 1nyn n SER 2 Cb 0.00 -1.45 0.63 0.00 -0.26 0.00 0.00 64.21 63.14 1nyn n SER 2 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 1nyn h THR 3 N -0.35 0.22 -3.90 6.66 2.02 -2.00 -3.40 112.91 112.15 1nyn h THR 3 Ca -0.23 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 66.92 1nyn h THR 3 Cb 1.15 0.37 -0.00 0.00 -1.74 0.00 0.00 68.15 67.93 1nyn h THR 3 CO 0.34 0.00 -0.02 1.33 0.37 0.00 0.00 175.52 177.54 1nyn n VAL 4 N -3.56 0.00 -4.39 3.16 0.24 -1.26 -4.95 118.33 107.57 1nyn n VAL 4 Ca 0.15 -0.09 -0.22 0.00 -2.04 0.00 0.00 64.34 62.14 1nyn n VAL 4 Cb 1.04 0.02 -0.10 0.00 -1.47 0.00 0.00 33.84 33.33 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 -1.14 2.07 -0.03 3.34 2.01 0.19 -4.96 115.64 117.11 1nyn s THR 5 Ca 0.00 -2.19 0.07 0.00 0.31 0.00 0.00 61.69 59.88 1nyn s THR 5 Cb 0.00 -2.09 -0.02 0.00 0.01 0.00 0.00 72.50 70.40 1nyn s THR 5 CO 0.00 -0.41 -0.23 -0.54 -0.69 0.00 0.00 174.62 172.75 1nyn s LYS 6 N -3.29 2.27 -0.23 4.92 1.02 -1.26 -1.04 119.74 122.14 1nyn s LYS 6 Ca 0.23 -0.86 -0.02 0.00 0.02 0.00 0.00 55.97 55.34 1nyn s LYS 6 Cb -0.04 -2.15 0.01 0.00 -0.52 0.00 0.00 37.83 35.13 1nyn s LYS 6 CO 0.10 0.56 -0.08 0.71 -0.92 0.00 0.00 175.35 175.72 1nyn s TYR 7 N -0.59 2.98 -0.22 3.18 1.51 -1.04 -4.94 117.35 118.22 1nyn s TYR 7 Ca 0.09 -1.36 -0.11 0.00 -1.01 0.00 0.00 57.07 54.68 1nyn s TYR 7 Cb -0.11 -2.05 -0.05 0.00 -0.11 0.00 0.00 41.96 39.64 1nyn s TYR 7 CO -0.00 -0.68 0.19 -0.06 -1.11 0.00 0.00 175.55 173.88 1nyn s PHE 8 N 1.37 3.35 -0.28 2.71 0.40 -1.26 -2.42 117.98 121.85 1nyn s PHE 8 Ca 0.03 0.31 0.03 0.00 -0.60 0.00 0.00 56.93 56.70 1nyn s PHE 8 Cb -0.15 -2.27 0.07 0.00 0.51 0.00 0.00 43.02 41.18 1nyn s PHE 8 CO -0.05 0.13 -0.05 -0.47 0.70 0.00 0.00 175.22 175.47 1nyn s TYR 9 N 0.87 3.30 -0.88 0.36 5.04 -1.08 -2.69 117.35 122.27 1nyn s TYR 9 Ca 0.09 -2.48 -0.25 0.00 -2.44 0.00 0.00 57.07 52.00 1nyn s TYR 9 Cb -0.13 -2.21 0.04 0.00 0.35 0.00 0.00 41.96 40.00 1nyn s TYR 9 CO 0.03 -0.89 1.40 0.21 -1.34 0.00 0.00 175.55 174.96 1nyn s LYS 10 N 1.08 3.35 0.00 4.97 2.20 -1.26 -2.95 119.74 127.12 1nyn s LYS 10 Ca -0.02 -0.64 0.00 0.00 -0.36 0.00 0.00 55.97 54.95 1nyn s LYS 10 Cb -0.19 -4.79 0.00 0.00 -1.51 0.00 0.00 37.83 31.34 1nyn s LYS 10 CO -0.07 -2.24 0.00 0.41 -0.36 0.00 0.00 175.35 173.10 1nyn n GLY 11 N 6.17 -3.52 0.20 5.54 0.00 0.01 -4.90 105.19 108.69 1nyn n GLY 11 Ca 0.19 -1.23 -0.14 0.00 0.00 0.00 0.00 46.02 44.83 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 -0.42 0.00 1.61 5.08 -1.96 -3.39 114.58 115.51 1nyn h GLU 12 Ca 0.00 0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 1nyn h GLU 12 Cb 0.00 0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.34 1nyn h GLU 12 CO 0.00 -0.18 0.00 -1.71 -1.00 0.00 0.00 179.01 176.12 1nyn n ASN 13 N -5.21 0.28 -4.29 1.42 2.85 -1.26 -5.05 115.26 104.00 1nyn n ASN 13 Ca -0.10 -0.87 -0.31 0.00 -0.11 0.00 0.00 54.58 53.19 1nyn n ASN 13 Cb 0.23 0.05 -0.16 0.00 1.24 0.00 0.00 39.78 41.14 1nyn n ASN 13 CO 0.00 0.00 0.00 -0.89 -2.11 0.00 0.00 177.26 174.26 1nyn s THR 14 N -0.05 2.05 -0.22 -0.44 2.01 -1.26 -5.11 115.64 112.61 1nyn s THR 14 Ca 0.00 -1.08 -0.06 0.00 0.31 0.00 0.00 61.69 60.86 1nyn s THR 14 Cb 0.00 -1.72 -0.02 0.00 0.01 0.00 0.00 72.50 70.77 1nyn s THR 14 CO 0.00 0.57 0.02 -0.62 -0.69 0.00 0.00 174.62 173.90 1nyn s ASP 15 N -0.35 4.80 0.08 3.53 -1.08 -1.26 -0.81 116.67 121.58 1nyn s ASP 15 Ca 0.02 -0.25 0.10 0.00 -0.52 0.00 0.00 52.55 51.90 1nyn s ASP 15 Cb -0.12 -1.84 -0.03 0.00 -1.46 0.00 0.00 42.92 39.46 1nyn s ASP 15 CO 0.02 0.00 -0.25 -0.76 0.52 0.00 0.00 175.17 174.70 1nyn s LEU 16 N 1.36 2.33 0.08 -1.34 1.43 -1.15 -4.26 118.68 117.13 1nyn s LEU 16 Ca 0.05 -0.63 0.08 0.00 -1.03 0.00 0.00 54.13 52.60 1nyn s LEU 16 Cb -0.15 -1.31 -0.04 0.00 0.03 0.00 0.00 46.19 44.73 1nyn s LEU 16 CO 0.01 0.22 -0.19 -0.63 0.23 0.00 0.00 176.35 175.99 1nyn s ILE 17 N -0.95 2.72 0.16 -0.59 1.01 -0.89 -2.65 121.20 120.01 1nyn s ILE 17 Ca 0.14 -1.38 0.03 0.00 0.00 0.00 0.00 60.65 59.44 1nyn s ILE 17 Cb -0.10 -2.19 -0.05 0.00 0.01 0.00 0.00 42.46 40.13 1nyn s ILE 17 CO 0.05 0.22 -0.06 0.68 0.00 0.00 0.00 174.94 175.83 1nyn s VAL 18 N -1.02 0.99 0.14 2.92 -7.23 -1.02 -2.35 120.40 112.84 1nyn s VAL 18 Ca 0.16 -2.02 -0.06 0.00 -1.81 0.00 0.00 61.98 58.25 1nyn s VAL 18 Cb -0.10 -1.98 -0.06 0.00 0.56 0.00 0.00 36.38 34.80 1nyn s VAL 18 CO 0.07 -0.63 0.39 -0.36 -0.31 0.00 0.00 175.10 174.26 1nyn s PHE 19 N -3.45 3.48 -0.04 2.82 0.40 -1.26 -2.50 117.98 117.43 1nyn s PHE 19 Ca 0.20 0.60 -0.07 0.00 -0.60 0.00 0.00 56.93 57.05 1nyn s PHE 19 Cb 0.04 -2.03 0.01 0.00 0.51 0.00 0.00 43.02 41.55 1nyn s PHE 19 CO 0.02 0.44 0.17 0.00 0.70 0.00 0.00 175.22 176.54 1nyn s ALA 20 N -1.63 -0.41 -0.00 5.36 0.00 -0.20 -4.39 121.76 120.48 1nyn s ALA 20 Ca 0.40 0.24 -0.00 0.00 0.00 0.00 0.00 51.96 52.60 1nyn s ALA 20 Cb -0.12 -0.12 -0.00 0.00 0.00 0.00 0.00 23.12 22.88 1nyn s ALA 20 CO 0.24 -0.14 0.46 0.00 0.00 0.00 0.00 175.76 176.31 1nyn h ALA 21 N 5.15 -0.46 -3.14 0.00 0.00 -1.74 0.55 119.26 119.63 1nyn h ALA 21 Ca -0.28 -0.00 -0.24 0.00 0.00 0.00 0.00 54.91 54.40 1nyn h ALA 21 Cb 1.20 0.00 -0.22 0.00 0.00 0.00 0.00 17.79 18.77 1nyn h ALA 21 CO 0.40 -0.45 -0.72 -1.12 0.00 0.00 0.00 179.25 177.35 1nyn s SER 22 N -2.56 0.60 0.32 0.00 0.01 -1.26 -2.26 113.70 108.55 1nyn s SER 22 Ca -0.00 -0.50 0.02 0.00 1.31 0.00 0.00 55.95 56.78 1nyn s SER 22 Cb 0.00 0.05 0.56 0.00 0.21 0.00 0.00 66.02 66.84 1nyn s SER 22 CO 0.00 -0.22 1.89 -0.08 0.41 0.00 0.00 173.24 175.24 1nyn h GLU 23 N 4.65 0.67 0.41 12.44 4.81 -1.97 -2.90 114.58 132.68 1nyn h GLU 23 Ca -0.34 -0.12 -0.01 0.00 -0.13 0.00 0.00 59.36 58.77 1nyn h GLU 23 Cb 1.20 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 30.45 1nyn h GLU 23 CO 0.41 0.60 -0.44 1.49 -0.73 0.00 0.00 179.01 180.35 1nyn h GLU 24 N 0.65 -0.83 -0.02 1.92 4.81 -2.00 -1.92 114.58 117.19 1nyn h GLU 24 Ca 0.15 0.06 0.03 0.00 -0.13 0.00 0.00 59.36 59.46 1nyn h GLU 24 Cb 0.23 0.19 -0.06 0.00 0.63 0.00 0.00 28.75 29.75 1nyn h GLU 24 CO -0.00 -0.56 -0.51 -0.07 -0.73 0.00 0.00 179.01 177.14 1nyn h LEU 25 N -0.87 -1.57 -0.99 1.64 3.38 -1.95 -1.70 115.31 113.24 1nyn h LEU 25 Ca -0.04 0.18 0.09 0.00 0.09 0.00 0.00 57.88 58.21 1nyn h LEU 25 Cb 0.77 0.60 -0.12 0.00 0.09 0.00 0.00 40.66 42.01 1nyn h LEU 25 CO -0.08 -0.50 -0.57 0.52 0.09 0.00 0.00 178.44 177.89 1nyn n VAL 26 N -5.46 -0.66 -0.31 1.22 0.31 -1.10 0.14 118.33 112.47 1nyn n VAL 26 Ca -0.07 2.40 0.13 0.00 -0.01 0.00 0.00 64.34 66.80 1nyn n VAL 26 Cb 0.39 -2.98 0.31 0.00 -0.91 0.00 0.00 33.84 30.65 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 0.39 -0.37 4.52 3.58 -0.64 0.16 116.42 124.06 1nyn h ASP 27 Ca 0.17 0.15 -0.00 0.00 0.42 0.00 0.00 57.03 57.77 1nyn h ASP 27 Cb 0.42 0.11 -0.02 0.00 1.72 0.00 0.00 39.33 41.56 1nyn h ASP 27 CO -0.94 0.03 0.23 -0.33 -2.88 0.00 0.00 179.24 175.35 1nyn h GLU 28 N 0.44 0.49 -0.26 0.28 5.08 0.21 -2.81 114.58 118.01 1nyn h GLU 28 Ca 0.56 -0.04 0.06 0.00 -1.00 0.00 0.00 59.36 58.94 1nyn h GLU 28 Cb 1.04 -0.11 -0.08 0.00 0.50 0.00 0.00 28.75 30.11 1nyn h GLU 28 CO -0.51 0.36 -0.33 -0.92 -1.00 0.00 0.00 179.01 176.61 1nyn h TYR 29 N 0.48 -0.92 -0.21 4.33 3.20 0.10 0.81 116.97 124.76 1nyn h TYR 29 Ca 0.13 0.05 0.06 0.00 3.14 0.00 0.00 58.73 62.11 1nyn h TYR 29 Cb -0.01 0.44 -0.01 0.00 1.54 0.00 0.00 36.73 38.69 1nyn h TYR 29 CO -0.04 -0.39 0.42 -0.07 -1.64 0.00 0.00 178.16 176.43 1nyn h LEU 30 N -0.33 0.00 0.00 2.82 3.38 -1.22 0.60 115.31 120.56 1nyn h LEU 30 Ca 0.13 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.92 1nyn h LEU 30 Cb 0.55 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.26 1nyn h LEU 30 CO -0.45 0.00 -1.31 0.50 0.09 0.00 0.00 178.44 177.27 1nyn h LYS 31 N 0.00 0.00 -1.98 1.13 3.64 0.70 -3.38 116.57 116.68 1nyn h LYS 31 Ca 0.10 0.00 -0.52 0.00 -1.27 0.00 0.00 60.65 58.96 1nyn h LYS 31 Cb 0.94 0.00 -0.41 0.00 -0.41 0.00 0.00 32.23 32.35 1nyn h LYS 31 CO -0.00 0.38 -0.95 -1.71 -2.27 0.00 0.00 179.45 174.90 1nyn n ASN 32 N -2.98 2.57 -4.56 4.20 5.15 0.19 -5.04 115.26 114.79 1nyn n ASN 32 Ca -0.09 -3.30 -0.34 0.00 -0.60 0.00 0.00 54.58 50.26 1nyn n ASN 32 Cb 0.86 -0.58 -0.04 0.00 -0.53 0.00 0.00 39.78 39.50 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 -2.97 2.81 0.00 1.20 0.04 -0.02 -4.58 135.00 131.48 1nyn s PRO 33 Ca 0.43 -0.16 0.04 0.00 0.04 0.00 0.00 61.00 61.35 1nyn s PRO 33 Cb 0.34 -4.82 0.07 0.00 0.04 0.00 0.00 34.50 30.12 1nyn s PRO 33 CO -0.10 -2.87 0.92 0.45 0.04 0.00 0.00 177.00 175.44 1nyn n SER 34 N 12.31 -0.41 -1.45 6.66 2.88 -1.26 -5.11 113.62 127.23 1nyn n SER 34 Ca 0.29 -1.79 0.18 0.00 -1.33 0.00 0.00 58.87 56.23 1nyn n SER 34 Cb 0.49 0.11 -0.07 0.00 -0.75 0.00 0.00 64.21 64.00 1nyn n SER 34 CO 0.00 0.00 0.00 -0.38 -1.23 0.00 0.00 175.04 173.43 1nyn n ILE 35 N 0.08 -0.04 0.00 2.46 2.08 -1.26 -4.81 119.36 117.86 1nyn n ILE 35 Ca -0.15 0.51 0.00 0.00 0.56 0.00 0.00 62.75 63.67 1nyn n ILE 35 Cb 0.73 -0.99 0.00 0.00 -0.75 0.00 0.00 39.64 38.63 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 -4.29 2.44 0.25 7.39 0.00 -1.26 -4.61 105.19 105.10 1nyn n GLY 36 Ca -0.04 -0.49 0.08 0.00 0.00 0.00 0.00 46.02 45.57 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 0.00 1.74 0.26 1.61 4.81 -1.26 -4.33 118.16 120.99 1nyn n LYS 37 Ca 0.00 -0.56 0.14 0.00 -0.87 0.00 0.00 58.31 57.02 1nyn n LYS 37 Cb 0.00 -1.26 0.71 0.00 0.02 0.00 0.00 35.03 34.50 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 1.24 0.00 -0.24 3.14 5.85 -1.95 -2.35 115.31 121.00 1nyn h LEU 38 Ca 0.00 0.00 -0.21 0.00 0.84 0.00 0.00 57.88 58.51 1nyn h LEU 38 Cb 0.49 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.52 1nyn h LEU 38 CO 0.00 0.11 -0.90 0.28 -0.34 0.00 0.00 178.44 177.58 1nyn h SER 39 N 0.00 0.31 0.84 1.25 0.02 -1.83 -1.11 113.55 113.03 1nyn h SER 39 Ca -0.00 -0.25 -0.11 0.00 -0.84 0.00 0.00 61.79 60.59 1nyn h SER 39 Cb 0.43 -0.10 -0.02 0.00 0.14 0.00 0.00 62.40 62.86 1nyn h SER 39 CO 0.01 1.06 -0.51 -0.08 -1.14 0.00 0.00 176.83 176.18 1nyn h GLU 40 N 0.13 0.00 0.00 3.45 4.81 -1.69 -3.36 114.58 117.92 1nyn h GLU 40 Ca -0.05 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.18 1nyn h GLU 40 Cb 1.54 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.92 1nyn h GLU 40 CO 0.14 0.51 -0.17 0.28 -0.73 0.00 0.00 179.01 179.04 1nyn h VAL 41 N 0.00 0.00 -4.01 0.32 2.07 -1.44 -3.47 116.25 109.72 1nyn h VAL 41 Ca -0.01 -0.50 -0.51 0.00 0.82 0.00 0.00 66.70 66.50 1nyn h VAL 41 Cb 1.07 0.00 0.07 0.00 -1.52 0.00 0.00 31.29 30.91 1nyn h VAL 41 CO 0.07 0.00 0.49 -0.69 0.02 0.00 0.00 177.57 177.46 1nyn s VAL 42 N -1.50 3.00 -0.21 2.57 1.01 -0.42 -2.60 120.40 122.24 1nyn s VAL 42 Ca -0.05 0.74 -0.16 0.00 0.00 0.00 0.00 61.98 62.51 1nyn s VAL 42 Cb 0.01 -3.37 -0.09 0.00 0.00 0.00 0.00 36.38 32.93 1nyn s VAL 42 CO 0.07 -0.02 -0.28 -0.62 0.00 0.00 0.00 175.10 174.25 1nyn n GLU 43 N -0.61 0.55 -4.07 2.72 -0.58 -1.26 -4.66 120.64 112.72 1nyn n GLU 43 Ca 0.08 0.30 -0.26 0.00 -0.42 0.00 0.00 57.16 56.86 1nyn n GLU 43 Cb 0.48 -1.51 -0.05 0.00 -0.57 0.00 0.00 31.44 29.78 1nyn n GLU 43 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 1nyn s LEU 44 N -7.80 3.83 -0.95 -4.62 1.02 -1.26 -5.04 118.68 103.86 1nyn s LEU 44 Ca -0.31 -0.11 -0.01 0.00 0.02 0.00 0.00 54.13 53.72 1nyn s LEU 44 Cb 0.08 -2.44 0.31 0.00 0.02 0.00 0.00 46.19 44.16 1nyn s LEU 44 CO 0.44 0.07 1.43 0.49 0.02 0.00 0.00 176.35 178.80 1nyn n PHE 45 N -0.32 2.79 -3.55 0.29 3.01 -1.26 -4.92 117.46 113.49 1nyn n PHE 45 Ca -0.08 -2.94 -0.13 0.00 1.01 0.00 0.00 57.45 55.31 1nyn n PHE 45 Cb 0.54 -1.05 -0.04 0.00 -0.01 0.00 0.00 39.48 38.92 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 -3.31 1.10 -0.09 -1.08 2.12 -1.26 -5.08 118.70 111.11 1nyn s GLU 46 Ca 0.37 -0.41 -0.04 0.00 0.36 0.00 0.00 54.97 55.25 1nyn s GLU 46 Cb 0.13 0.50 -0.04 0.00 0.26 0.00 0.00 34.13 34.98 1nyn s GLU 46 CO -0.01 -0.43 0.07 0.08 -0.54 0.00 0.00 175.26 174.43 1nyn s VAL 47 N -3.08 4.85 0.41 3.70 1.01 -1.26 -4.82 120.40 121.20 1nyn s VAL 47 Ca -0.02 -0.08 0.07 0.00 0.00 0.00 0.00 61.98 61.95 1nyn s VAL 47 Cb -0.00 -3.09 -0.06 0.00 0.00 0.00 0.00 36.38 33.23 1nyn s VAL 47 CO -0.07 0.58 0.15 -0.36 0.00 0.00 0.00 175.10 175.41 1nyn s PHE 48 N -0.98 2.58 0.04 5.22 0.40 -0.99 -3.75 117.98 120.51 1nyn s PHE 48 Ca 0.15 -0.61 0.01 0.00 -0.60 0.00 0.00 56.93 55.88 1nyn s PHE 48 Cb -0.12 -1.93 -0.03 0.00 0.51 0.00 0.00 43.02 41.46 1nyn s PHE 48 CO 0.04 0.22 -0.05 0.95 0.70 0.00 0.00 175.22 177.09 1nyn s THR 49 N -2.62 0.34 0.00 0.64 -4.23 -1.14 -2.09 115.64 106.54 1nyn s THR 49 Ca 0.40 -1.25 -0.30 0.00 -1.18 0.00 0.00 61.69 59.36 1nyn s THR 49 Cb 0.05 -0.76 -0.05 0.00 1.34 0.00 0.00 72.50 73.07 1nyn s THR 49 CO 0.22 -0.60 1.31 -2.16 -0.54 0.00 0.00 174.62 172.85 1nyn s PRO 50 N -2.22 4.33 0.00 3.99 0.04 -1.26 -3.71 135.00 136.17 1nyn s PRO 50 Ca -0.07 1.86 0.19 0.00 0.04 0.00 0.00 61.00 63.02 1nyn s PRO 50 Cb -0.05 -3.50 0.60 0.00 0.04 0.00 0.00 34.50 31.59 1nyn s PRO 50 CO -0.03 -0.47 1.46 0.94 0.04 0.00 0.00 177.00 178.95 1nyn n GLN 51 N 4.95 1.90 0.03 4.56 0.00 -1.26 -4.79 117.38 122.77 1nyn n GLN 51 Ca 0.12 -1.37 0.00 0.00 -0.00 0.00 0.00 57.00 55.74 1nyn n GLN 51 Cb 0.45 -1.39 0.00 0.00 0.00 0.00 0.00 30.24 29.29 1nyn n GLN 51 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.06 176.66 1nyn n ASP 52 N 0.60 -0.50 0.00 1.69 5.68 -1.26 -5.03 116.55 117.73 1nyn n ASP 52 Ca 0.16 0.18 0.00 0.00 -0.50 0.00 0.00 54.79 54.63 1nyn n ASP 52 Cb 0.38 0.69 0.00 0.00 -1.14 0.00 0.00 41.12 41.05 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 -1.43 -0.19 0.00 6.12 0.00 -1.26 -4.96 105.19 103.47 1nyn n GLY 53 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 2.25 -0.95 1.61 1.74 -1.26 -4.88 116.66 115.17 1nyn n ARG 54 Ca 0.00 0.00 -0.38 0.00 -0.77 0.00 0.00 57.85 56.70 1nyn n ARG 54 Cb 0.00 -0.72 -0.06 0.00 -1.02 0.00 0.00 32.46 30.67 1nyn n ARG 54 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1nyn n GLY 55 N 1.44 2.38 0.00 -0.13 0.00 -1.26 -4.58 105.19 103.05 1nyn n GLY 55 Ca 0.00 -1.11 0.03 0.00 0.00 0.00 0.00 46.02 44.94 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 7.00 2.08 -3.75 4.61 0.00 -1.26 -4.73 120.51 124.46 1nyn n ALA 56 Ca 0.46 -0.04 -0.10 0.00 0.00 0.00 0.00 53.44 53.76 1nyn n ALA 56 Cb 0.34 -1.11 -0.03 0.00 0.00 0.00 0.00 19.45 18.66 1nyn n ALA 56 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1nyn n GLU 57 N -0.69 0.60 0.00 0.00 -0.58 -1.26 -5.06 120.64 113.65 1nyn n GLU 57 Ca 0.05 -1.34 0.00 0.00 -0.42 0.00 0.00 57.16 55.45 1nyn n GLU 57 Cb 0.02 0.84 0.00 0.00 -0.57 0.00 0.00 31.44 31.73 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 0.68 1.12 3.01 0.62 0.00 -1.26 -4.80 105.19 104.56 1nyn n GLY 58 Ca -0.01 -0.58 -0.13 0.00 0.00 0.00 0.00 46.02 45.30 1nyn n GLY 58 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1nyn s GLU 59 N 0.00 0.43 0.00 1.61 4.04 -1.26 -5.16 118.70 118.36 1nyn s GLU 59 Ca 0.00 -0.57 0.00 0.00 0.04 0.00 0.00 54.97 54.44 1nyn s GLU 59 Cb 0.00 -0.22 0.00 0.00 0.02 0.00 0.00 34.13 33.93 1nyn s GLU 59 CO 0.00 0.04 0.00 1.28 -1.84 0.00 0.00 175.26 174.74 1nyn n LEU 60 N 1.88 0.00 0.00 1.83 4.32 -1.26 -4.96 117.00 118.80 1nyn n LEU 60 Ca -0.20 0.00 -0.09 0.00 -0.02 0.00 0.00 56.01 55.70 1nyn n LEU 60 Cb 0.56 0.00 0.02 0.00 -1.62 0.00 0.00 43.42 42.38 1nyn n LEU 60 CO 0.22 -0.01 0.13 0.61 -1.22 0.00 0.00 177.39 177.12 1nyn n GLY 61 N 5.00 2.15 3.25 -0.72 0.00 -1.24 -5.00 105.19 108.62 1nyn n GLY 61 Ca 0.00 -2.18 -0.22 0.00 0.00 0.00 0.00 46.02 43.62 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 -2.31 1.60 -0.11 4.61 0.00 -1.26 -2.87 121.76 121.42 1nyn s ALA 62 Ca 0.24 -1.18 -0.21 0.00 0.00 0.00 0.00 51.96 50.81 1nyn s ALA 62 Cb -0.02 -0.19 -0.04 0.00 0.00 0.00 0.00 23.12 22.88 1nyn s ALA 62 CO 0.15 0.28 0.58 0.00 0.00 0.00 0.00 175.76 176.77 1nyn s ALA 63 N -1.29 3.43 0.55 0.00 0.00 -1.25 -4.85 121.76 118.35 1nyn s ALA 63 Ca 0.04 -0.09 -0.19 0.00 0.00 0.00 0.00 51.96 51.72 1nyn s ALA 63 Cb -0.10 -2.81 -0.06 0.00 0.00 0.00 0.00 23.12 20.16 1nyn s ALA 63 CO 0.04 -0.13 1.14 -1.54 0.00 0.00 0.00 175.76 175.26 1nyn s SER 64 N 0.79 5.66 0.60 0.00 1.04 -1.26 -4.81 113.70 115.72 1nyn s SER 64 Ca 0.31 2.20 0.28 0.00 0.48 0.00 0.00 55.95 59.22 1nyn s SER 64 Cb -0.16 -2.58 1.39 0.00 0.10 0.00 0.00 66.02 64.76 1nyn s SER 64 CO 0.13 -1.26 1.79 0.07 0.98 0.00 0.00 173.24 174.96 1nyn h LYS 65 N 1.16 0.00 -0.36 4.02 2.10 -2.00 0.28 116.57 121.77 1nyn h LYS 65 Ca -0.50 0.00 -0.10 0.00 -2.00 0.00 0.00 60.65 58.05 1nyn h LYS 65 Cb 1.27 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.59 1nyn h LYS 65 CO 0.57 0.00 -0.15 0.00 -2.00 0.00 0.00 179.45 177.86 1nyn h ALA 66 N 1.28 0.51 0.75 0.07 0.00 -2.00 -2.59 119.26 117.29 1nyn h ALA 66 Ca 0.24 -0.34 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 1nyn h ALA 66 Cb 1.43 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 19.10 1nyn h ALA 66 CO -0.00 0.42 -0.36 0.37 0.00 0.00 0.00 179.25 179.68 1nyn h GLN 67 N 0.54 -0.97 -0.88 0.00 4.15 -0.78 -2.99 115.11 114.18 1nyn h GLN 67 Ca 0.08 0.07 0.20 0.00 0.77 0.00 0.00 58.65 59.77 1nyn h GLN 67 Cb 0.69 0.22 -0.16 0.00 0.21 0.00 0.00 27.48 28.44 1nyn h GLN 67 CO 0.05 -0.65 -0.09 0.28 -1.93 0.00 0.00 178.83 176.49 1nyn h VAL 68 N -1.12 0.15 -0.57 2.39 2.07 -1.58 1.90 116.25 119.49 1nyn h VAL 68 Ca -0.10 -0.01 0.17 0.00 0.82 0.00 0.00 66.70 67.57 1nyn h VAL 68 Cb 0.77 0.12 -0.02 0.00 -1.52 0.00 0.00 31.29 30.64 1nyn h VAL 68 CO 0.17 0.01 0.73 -0.33 0.02 0.00 0.00 177.57 178.17 1nyn h GLU 69 N 0.03 0.00 0.00 1.57 5.08 -1.31 1.86 114.58 121.81 1nyn h GLU 69 Ca 0.47 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.83 1nyn h GLU 69 Cb 0.83 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.08 1nyn h GLU 69 CO -0.84 0.00 0.00 -0.97 -1.00 0.00 0.00 179.01 176.20 1nyn h ASN 70 N 0.00 0.00 0.00 1.42 -1.24 0.30 -3.28 115.58 112.78 1nyn h ASN 70 Ca 0.27 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.28 1nyn h ASN 70 Cb 1.73 0.00 0.00 0.00 0.73 0.00 0.00 38.32 40.78 1nyn h ASN 70 CO -0.00 0.00 -0.24 -0.62 -1.29 0.00 0.00 177.43 175.28 1nyn n GLU 71 N -3.09 0.18 -2.81 6.67 -0.58 0.63 -4.92 120.64 116.72 1nyn n GLU 71 Ca 0.03 0.30 -0.11 0.00 -0.42 0.00 0.00 57.16 56.97 1nyn n GLU 71 Cb 0.47 -1.07 0.05 0.00 -0.57 0.00 0.00 31.44 30.32 1nyn n GLU 71 CO 0.00 0.00 0.00 1.97 -0.48 0.00 0.00 177.13 178.62 1nyn n PHE 72 N -3.21 -2.70 -3.68 -0.32 1.16 -0.91 -5.06 117.46 102.75 1nyn n PHE 72 Ca -0.03 -2.18 -0.10 0.00 -1.87 0.00 0.00 57.45 53.27 1nyn n PHE 72 Cb 0.13 1.28 -0.10 0.00 -1.61 0.00 0.00 39.48 39.18 1nyn n PHE 72 CO 0.00 0.00 0.00 0.20 -1.87 0.00 0.00 176.76 175.09 1nyn s GLY 73 N -1.56 -0.41 0.00 4.97 0.00 -1.24 -4.79 107.32 104.29 1nyn s GLY 73 Ca 0.30 1.78 0.00 0.00 0.00 0.00 0.00 44.72 46.79 1nyn s GLY 73 CO -0.16 1.87 0.00 0.58 0.00 0.00 0.00 173.10 175.39 1nyn n LYS 74 N 4.24 0.00 0.00 2.90 2.85 -1.26 -4.33 118.16 122.55 1nyn n LYS 74 Ca -0.22 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.04 1nyn n LYS 74 Cb 0.56 0.00 0.00 0.00 -0.65 0.00 0.00 35.03 34.94 1nyn n LYS 74 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 1nyn n GLY 75 N -0.19 0.00 0.00 2.58 0.00 -1.26 -5.12 105.19 101.19 1nyn n GLY 75 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 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 -0.12 0.01 -0.30 1.61 5.02 -1.26 -5.09 118.16 118.03 1nyn n LYS 76 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1nyn n LYS 76 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 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 -0.78 3.09 -0.03 1.97 5.02 -1.26 -5.05 118.16 121.12 1nyn n LYS 77 Ca 0.00 0.00 -0.22 0.00 -2.02 0.00 0.00 58.31 56.07 1nyn n LYS 77 Cb 0.00 0.00 -0.13 0.00 -0.02 0.00 0.00 35.03 34.88 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 -0.10 1.70 -0.05 -0.18 0.00 -1.26 -3.56 119.36 115.91 1nyn n ILE 78 Ca 0.00 -0.49 -0.10 0.00 0.00 0.00 0.00 62.75 62.16 1nyn n ILE 78 Cb 0.00 -1.80 -0.04 0.00 0.00 0.00 0.00 39.64 37.80 1nyn n ILE 78 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 176.55 177.60 1nyn h GLU 79 N -0.23 -0.35 -0.28 9.51 9.09 -1.98 -1.19 114.58 129.15 1nyn h GLU 79 Ca -0.42 0.02 0.04 0.00 0.05 0.00 0.00 59.36 59.06 1nyn h GLU 79 Cb 1.84 0.08 -0.04 0.00 -1.65 0.00 0.00 28.75 28.98 1nyn h GLU 79 CO -0.01 -0.24 0.03 0.93 0.05 0.00 0.00 179.01 179.78 1nyn h GLU 80 N -0.37 0.13 -0.66 1.06 4.39 -1.99 -2.10 114.58 115.04 1nyn h GLU 80 Ca 0.12 -0.01 0.11 0.00 0.34 0.00 0.00 59.36 59.92 1nyn h GLU 80 Cb 0.56 -0.03 -0.12 0.00 -0.10 0.00 0.00 28.75 29.07 1nyn h GLU 80 CO -0.44 0.08 -0.37 0.28 -1.16 0.00 0.00 179.01 177.41 1nyn h VAL 81 N 0.13 0.12 -0.63 3.13 2.07 -1.30 0.72 116.25 120.49 1nyn h VAL 81 Ca 0.13 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.70 1nyn h VAL 81 Cb 0.15 0.12 -0.04 0.00 -1.52 0.00 0.00 31.29 30.01 1nyn h VAL 81 CO -0.19 0.00 0.42 0.40 0.02 0.00 0.00 177.57 178.21 1nyn h ILE 82 N -0.14 1.06 -0.35 4.57 2.04 -0.84 -2.11 117.51 121.73 1nyn h ILE 82 Ca 0.24 -0.24 0.07 0.00 1.00 0.00 0.00 64.86 65.93 1nyn h ILE 82 Cb 0.56 0.29 -0.06 0.00 -0.74 0.00 0.00 36.82 36.87 1nyn h ILE 82 CO -0.74 0.13 -0.03 -0.78 0.00 0.00 0.00 178.15 176.73 1nyn h ASP 83 N 0.70 -0.20 0.25 1.72 1.82 0.11 -2.24 116.42 118.59 1nyn h ASP 83 Ca 0.26 0.09 0.00 0.00 -0.39 0.00 0.00 57.03 56.99 1nyn h ASP 83 Cb 0.14 0.17 -0.02 0.00 0.68 0.00 0.00 39.33 40.30 1nyn h ASP 83 CO -0.07 -0.06 -0.25 -0.07 -1.61 0.00 0.00 179.24 177.18 1nyn h LEU 84 N 0.07 -0.66 -0.93 2.28 3.38 -0.81 -1.44 115.31 117.20 1nyn h LEU 84 Ca 0.17 0.06 0.27 0.00 0.09 0.00 0.00 57.88 58.47 1nyn h LEU 84 Cb 0.25 0.23 -0.16 0.00 0.09 0.00 0.00 40.66 41.06 1nyn h LEU 84 CO -0.31 -0.36 0.21 0.40 0.09 0.00 0.00 178.44 178.47 1nyn h ILE 85 N -0.53 0.18 0.00 1.22 2.04 -1.28 1.89 117.51 121.03 1nyn h ILE 85 Ca -0.01 -0.04 -0.07 0.00 1.00 0.00 0.00 64.86 65.74 1nyn h ILE 85 Cb 0.49 0.05 -0.01 0.00 -0.74 0.00 0.00 36.82 36.61 1nyn h ILE 85 CO -0.05 0.02 -0.35 -0.07 0.00 0.00 0.00 178.15 177.70 1nyn h LEU 86 N 0.12 0.00 -1.96 1.44 3.38 -0.80 -2.63 115.31 114.85 1nyn h LEU 86 Ca 0.61 0.00 0.20 0.00 0.09 0.00 0.00 57.88 58.78 1nyn h LEU 86 Cb 1.30 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 42.02 1nyn h LEU 86 CO -0.75 0.35 0.57 -0.09 0.09 0.00 0.00 178.44 178.60 1nyn h ARG 87 N 0.00 0.00 0.00 1.13 9.65 0.40 -3.36 114.38 122.20 1nyn h ARG 87 Ca -0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 1nyn h ARG 87 Cb 0.74 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 29.32 1nyn h ARG 87 CO 0.05 0.00 0.00 0.09 2.80 0.00 0.00 179.97 182.91 1nyn n ASN 88 N -4.06 0.00 -1.14 -3.80 3.02 -1.04 -5.11 115.26 103.13 1nyn n ASN 88 Ca 0.14 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.69 1nyn n ASN 88 Cb 0.82 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.99 1nyn n ASN 88 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1nyn n GLY 89 N 3.95 -4.39 4.07 7.41 0.00 -1.02 -4.65 105.19 110.55 1nyn n GLY 89 Ca 0.00 -0.62 -0.39 0.00 0.00 0.00 0.00 46.02 45.01 1nyn n GLY 89 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1nyn n LYS 90 N 0.31 -0.82 0.00 1.61 5.02 -1.10 -4.73 118.16 118.45 1nyn n LYS 90 Ca 0.00 0.16 0.00 0.00 -2.02 0.00 0.00 58.31 56.45 1nyn n LYS 90 Cb 0.00 -3.17 0.00 0.00 -0.02 0.00 0.00 35.03 31.84 1nyn n LYS 90 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 1nyn n PRO 91 N -4.78 0.62 -1.36 1.97 -0.04 -1.26 -4.90 135.00 125.26 1nyn n PRO 91 Ca -0.18 0.00 -0.38 0.00 -0.04 0.00 0.00 63.50 62.91 1nyn n PRO 91 Cb 0.61 -1.25 0.04 0.00 -0.04 0.00 0.00 33.50 32.86 1nyn n PRO 91 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 1nyn n ASN 92 N 0.06 -1.83 -4.28 3.54 0.23 -1.26 -4.99 115.26 106.72 1nyn n ASN 92 Ca 0.00 0.66 -0.16 0.00 -0.53 0.00 0.00 54.58 54.55 1nyn n ASN 92 Cb 0.13 -1.10 -0.10 0.00 -2.08 0.00 0.00 39.78 36.63 1nyn n ASN 92 CO 0.00 0.00 0.00 -0.94 -0.93 0.00 0.00 177.26 175.39 1nyn s SER 93 N -1.20 2.06 -0.94 0.53 1.04 -1.26 -5.07 113.70 108.86 1nyn s SER 93 Ca 0.64 -0.99 -0.01 0.00 0.48 0.00 0.00 55.95 56.07 1nyn s SER 93 Cb -0.42 -0.06 0.29 0.00 0.10 0.00 0.00 66.02 65.93 1nyn s SER 93 CO 0.59 -0.26 1.23 0.41 0.98 0.00 0.00 173.24 176.19 1nyn n THR 94 N -0.18 4.36 -2.81 2.02 -1.04 -1.26 -4.97 114.28 110.39 1nyn n THR 94 Ca -0.10 -5.69 -0.43 0.00 -2.04 0.00 0.00 64.05 55.79 1nyn n THR 94 Cb 0.60 -2.10 -0.03 0.00 -1.82 0.00 0.00 70.33 66.99 1nyn n THR 94 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1nyn s THR 95 N -2.65 4.44 1.19 12.58 2.01 -1.26 -5.01 115.64 126.95 1nyn s THR 95 Ca 0.34 -1.19 -0.15 0.00 0.31 0.00 0.00 61.69 60.99 1nyn s THR 95 Cb 0.07 -4.85 0.29 0.00 0.01 0.00 0.00 72.50 68.02 1nyn s THR 95 CO 0.06 -1.63 1.03 -0.94 -0.69 0.00 0.00 174.62 172.45 1nyn s SER 96 N 4.02 0.83 0.31 3.53 1.04 -1.26 -5.01 113.70 117.17 1nyn s SER 96 Ca 0.36 1.21 -0.03 0.00 0.48 0.00 0.00 55.95 57.96 1nyn s SER 96 Cb -0.05 -1.84 -0.04 0.00 0.10 0.00 0.00 66.02 64.19 1nyn s SER 96 CO -0.07 -4.25 0.56 -0.44 0.98 0.00 0.00 173.24 170.02 1nyn s SER 97 N -2.97 6.38 0.12 7.02 0.01 -1.26 -5.00 113.70 118.01 1nyn s SER 97 Ca 0.68 0.64 0.18 0.00 1.31 0.00 0.00 55.95 58.75 1nyn s SER 97 Cb -0.20 -2.11 -0.08 0.00 0.21 0.00 0.00 66.02 63.84 1nyn s SER 97 CO 0.61 -0.24 0.96 0.25 0.41 0.00 0.00 173.24 175.23 1nyn h LEU 98 N 1.32 0.00 0.00 2.44 5.85 -2.05 -3.46 115.31 119.41 1nyn h LEU 98 Ca -0.48 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.24 1nyn h LEU 98 Cb 1.20 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.23 1nyn h LEU 98 CO 0.65 0.46 0.00 0.29 -0.34 0.00 0.00 178.44 179.49 1nyn n LYS 99 N -2.90 1.35 -2.74 1.25 5.02 -1.26 -5.01 118.16 113.87 1nyn n LYS 99 Ca -0.06 0.00 -0.20 0.00 -2.02 0.00 0.00 58.31 56.02 1nyn n LYS 99 Cb 0.77 0.00 0.03 0.00 -0.02 0.00 0.00 35.03 35.81 1nyn n LYS 99 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 1nyn s THR 100 N 0.00 2.83 0.00 -0.18 -4.23 -1.26 -5.09 115.64 107.71 1nyn s THR 100 Ca 0.00 -0.72 0.00 0.00 -1.18 0.00 0.00 61.69 59.79 1nyn s THR 100 Cb 0.00 -3.04 0.00 0.00 1.34 0.00 0.00 72.50 70.80 1nyn s THR 100 CO 0.00 -0.02 0.00 0.29 -0.54 0.00 0.00 174.62 174.35 1nyn n LYS 101 N -2.23 -1.33 -1.03 3.99 5.02 -1.26 -4.87 118.16 116.45 1nyn n LYS 101 Ca 0.07 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.36 1nyn n LYS 101 Cb 0.59 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.60 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 0.29 -1.70 0.00 0.72 0.00 -1.26 -5.06 105.19 98.18 1nyn n GLY 102 Ca 0.00 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.64 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 -0.06 0.00 0.00 -0.02 0.00 -1.26 -4.93 105.19 98.92 1nyn n GLY 103 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1nyn n GLY 103 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1nyn n ASN 104 N -1.45 0.00 0.12 1.61 4.13 -1.26 -4.88 115.26 113.52 1nyn n ASN 104 Ca 0.00 -1.00 -0.13 0.00 1.68 0.00 0.00 54.58 55.13 1nyn n ASN 104 Cb 0.03 0.00 -0.08 0.00 -1.54 0.00 0.00 39.78 38.19 1nyn n ASN 104 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1nyn h ALA 105 N 0.00 -0.33 0.00 5.41 0.00 -2.01 -3.49 119.26 118.85 1nyn h ALA 105 Ca 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1nyn h ALA 105 Cb 0.54 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.45 1nyn h ALA 105 CO 0.00 -0.48 0.00 0.41 0.00 0.00 0.00 179.25 179.18 1nyn n GLY 106 N -0.09 3.75 0.83 0.00 0.00 -1.26 -4.96 105.19 103.46 1nyn n GLY 106 Ca -0.09 -0.49 0.04 0.00 0.00 0.00 0.00 46.02 45.48 1nyn n GLY 106 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 1nyn n THR 107 N 0.00 0.79 0.00 2.61 5.66 -1.26 -4.94 114.28 117.13 1nyn n THR 107 Ca 0.00 -0.49 0.00 0.00 -3.05 0.00 0.00 64.05 60.51 1nyn n THR 107 Cb 0.00 -0.12 0.00 0.00 -1.55 0.00 0.00 70.33 68.66 1nyn n THR 107 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 175.07 172.31 1nyn n LYS 108 N 0.32 0.00 -0.09 1.09 4.01 -1.26 -4.72 118.16 117.50 1nyn n LYS 108 Ca 0.11 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 57.91 1nyn n LYS 108 Cb 0.46 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 34.98 1nyn n LYS 108 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1nyn n ALA 109 N 5.94 0.00 -3.11 7.82 0.00 -1.26 -5.08 120.51 124.82 1nyn n ALA 109 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 53.44 53.27 1nyn n ALA 109 Cb 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.44 1nyn n ALA 109 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 1nyn n TYR 110 N 0.00 -0.20 -1.84 0.00 9.36 -1.26 -5.28 117.16 117.93 1nyn n TYR 110 Ca 0.00 -3.56 0.00 0.00 3.32 0.00 0.00 57.90 57.66 1nyn n TYR 110 Cb 0.00 -0.14 0.00 0.00 -0.63 0.00 0.00 39.34 38.57 1nyn n TYR 110 CO 0.00 0.00 0.00 -1.71 0.22 0.00 0.00 176.86 175.37