#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nyn s SER 2 N 0.00 3.95 1.09 7.83 0.01 -1.26 -5.11 113.70 120.21 1nyn s SER 2 Ca 0.00 -2.80 -0.16 0.00 1.31 0.00 0.00 55.95 54.30 1nyn s SER 2 Cb 0.00 -1.30 0.17 0.00 0.21 0.00 0.00 66.02 65.10 1nyn s SER 2 CO 0.00 -0.25 0.27 1.07 0.41 0.00 0.00 173.24 174.74 1nyn n THR 3 N 3.35 0.00 -3.22 1.44 5.66 -1.26 -4.83 114.28 115.42 1nyn n THR 3 Ca 0.07 -0.11 -0.19 0.00 -3.05 0.00 0.00 64.05 60.77 1nyn n THR 3 Cb 0.33 -0.57 0.00 0.00 -1.55 0.00 0.00 70.33 68.54 1nyn n THR 3 CO 0.00 0.00 0.00 0.68 -3.05 0.00 0.00 175.07 172.70 1nyn s VAL 4 N -2.12 2.77 -0.09 1.08 -7.23 -1.23 -4.10 120.40 109.47 1nyn s VAL 4 Ca 0.45 -1.13 -0.11 0.00 -1.81 0.00 0.00 61.98 59.38 1nyn s VAL 4 Cb -0.08 -2.89 0.03 0.00 0.56 0.00 0.00 36.38 33.99 1nyn s VAL 4 CO 0.46 0.00 0.29 -0.89 -0.31 0.00 0.00 175.10 174.65 1nyn s THR 5 N -2.43 0.01 -0.18 5.32 2.01 -0.96 -4.88 115.64 114.53 1nyn s THR 5 Ca 0.53 -0.12 -0.05 0.00 0.31 0.00 0.00 61.69 62.37 1nyn s THR 5 Cb -0.07 -0.46 -0.03 0.00 0.01 0.00 0.00 72.50 71.95 1nyn s THR 5 CO 0.32 -0.06 -0.01 -0.75 -0.69 0.00 0.00 174.62 173.42 1nyn s LYS 6 N -0.17 3.68 -0.04 4.92 2.20 -1.26 -1.30 119.74 127.77 1nyn s LYS 6 Ca -0.03 -0.50 -0.03 0.00 -0.36 0.00 0.00 55.97 55.05 1nyn s LYS 6 Cb -0.03 -3.02 -0.04 0.00 -1.51 0.00 0.00 37.83 33.23 1nyn s LYS 6 CO 0.01 0.14 0.15 0.71 -0.36 0.00 0.00 175.35 176.00 1nyn s TYR 7 N 0.65 3.49 -0.21 4.03 1.51 -0.94 -5.01 117.35 120.88 1nyn s TYR 7 Ca -0.01 0.36 -0.03 0.00 -1.01 0.00 0.00 57.07 56.38 1nyn s TYR 7 Cb -0.14 -1.83 -0.01 0.00 -0.11 0.00 0.00 41.96 39.87 1nyn s TYR 7 CO 0.02 0.64 -0.07 -0.06 -1.11 0.00 0.00 175.55 174.97 1nyn s PHE 8 N -1.22 2.92 -0.00 2.71 0.40 -1.26 -2.60 117.98 118.93 1nyn s PHE 8 Ca 0.23 -0.98 0.05 0.00 -0.60 0.00 0.00 56.93 55.63 1nyn s PHE 8 Cb -0.12 -2.06 -0.01 0.00 0.51 0.00 0.00 43.02 41.34 1nyn s PHE 8 CO 0.14 -0.54 -0.17 -0.47 0.70 0.00 0.00 175.22 174.88 1nyn s TYR 9 N 1.33 1.53 -0.10 0.36 5.04 -0.91 -3.50 117.35 121.10 1nyn s TYR 9 Ca 0.04 -0.30 -0.05 0.00 -2.44 0.00 0.00 57.07 54.32 1nyn s TYR 9 Cb -0.14 -0.97 -0.04 0.00 0.35 0.00 0.00 41.96 41.16 1nyn s TYR 9 CO -0.04 -0.01 0.12 0.21 -1.34 0.00 0.00 175.55 174.49 1nyn s LYS 10 N -0.52 3.35 0.00 4.97 2.20 -1.26 -1.62 119.74 126.86 1nyn s LYS 10 Ca 0.06 -0.21 0.00 0.00 -0.36 0.00 0.00 55.97 55.46 1nyn s LYS 10 Cb -0.07 -3.10 0.00 0.00 -1.51 0.00 0.00 37.83 33.15 1nyn s LYS 10 CO -0.00 0.75 0.00 0.41 -0.36 0.00 0.00 175.35 176.15 1nyn n GLY 11 N 1.85 2.26 0.10 5.54 0.00 -0.16 -4.85 105.19 109.93 1nyn n GLY 11 Ca -0.18 -2.11 -0.12 0.00 0.00 0.00 0.00 46.02 43.61 1nyn n GLY 11 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1nyn n GLU 12 N -0.60 0.67 -0.05 1.61 2.13 -1.26 -4.55 120.64 118.59 1nyn n GLU 12 Ca 0.00 0.17 -0.05 0.00 0.66 0.00 0.00 57.16 57.94 1nyn n GLU 12 Cb 0.00 -1.65 -0.08 0.00 0.27 0.00 0.00 31.44 29.99 1nyn n GLU 12 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1nyn n ASN 13 N -3.05 2.61 -3.25 4.31 5.03 -1.26 -5.07 115.26 114.59 1nyn n ASN 13 Ca -0.29 -0.00 -0.17 0.00 0.87 0.00 0.00 54.58 54.99 1nyn n ASN 13 Cb 1.08 0.74 -0.05 0.00 -1.02 0.00 0.00 39.78 40.52 1nyn n ASN 13 CO 0.00 0.00 0.00 0.28 -1.83 0.00 0.00 177.26 175.71 1nyn s THR 14 N -2.23 0.00 0.31 3.41 -1.32 -1.26 -5.17 115.64 109.38 1nyn s THR 14 Ca -0.05 -1.74 0.04 0.00 -1.21 0.00 0.00 61.69 58.74 1nyn s THR 14 Cb 0.03 -2.61 -0.02 0.00 -1.51 0.00 0.00 72.50 68.39 1nyn s THR 14 CO 0.40 0.00 0.46 -0.62 -2.21 0.00 0.00 174.62 172.65 1nyn s ASP 15 N -3.29 6.16 -0.00 8.08 -1.08 -1.26 -0.99 116.67 124.28 1nyn s ASP 15 Ca 0.34 0.10 -0.00 0.00 -0.52 0.00 0.00 52.55 52.47 1nyn s ASP 15 Cb 0.00 -1.68 0.00 0.00 -1.46 0.00 0.00 42.92 39.79 1nyn s ASP 15 CO 0.23 -0.29 0.01 -0.76 0.52 0.00 0.00 175.17 174.88 1nyn s LEU 16 N -4.17 1.97 -0.05 -1.34 1.43 -0.64 -4.71 118.68 111.17 1nyn s LEU 16 Ca 0.40 0.02 0.06 0.00 -1.03 0.00 0.00 54.13 53.58 1nyn s LEU 16 Cb -0.09 0.03 -0.02 0.00 0.03 0.00 0.00 46.19 46.14 1nyn s LEU 16 CO 0.32 -0.00 -0.23 -0.63 0.23 0.00 0.00 176.35 176.03 1nyn s ILE 17 N 0.00 2.24 0.42 -0.59 1.01 0.08 -2.15 121.20 122.22 1nyn s ILE 17 Ca -0.00 -1.01 0.06 0.00 0.00 0.00 0.00 60.65 59.70 1nyn s ILE 17 Cb -0.00 -1.82 -0.07 0.00 0.01 0.00 0.00 42.46 40.58 1nyn s ILE 17 CO 0.00 0.57 0.01 0.68 0.00 0.00 0.00 174.94 176.21 1nyn s VAL 18 N -0.34 1.79 0.28 2.92 -7.23 -1.07 -2.67 120.40 114.08 1nyn s VAL 18 Ca 0.02 -2.00 0.08 0.00 -1.81 0.00 0.00 61.98 58.27 1nyn s VAL 18 Cb -0.12 -2.85 -0.06 0.00 0.56 0.00 0.00 36.38 33.91 1nyn s VAL 18 CO 0.02 0.00 -0.10 -0.36 -0.31 0.00 0.00 175.10 174.35 1nyn s PHE 19 N -2.79 2.05 0.28 2.82 0.08 -1.26 -2.23 117.98 116.93 1nyn s PHE 19 Ca 0.31 -0.59 -0.09 0.00 0.12 0.00 0.00 56.93 56.68 1nyn s PHE 19 Cb 0.09 -1.10 0.04 0.00 -0.57 0.00 0.00 43.02 41.47 1nyn s PHE 19 CO 0.16 0.41 0.53 0.00 -0.10 0.00 0.00 175.22 176.21 1nyn n ALA 20 N -0.60 -1.09 -0.19 5.36 0.00 -0.42 -4.55 120.51 119.01 1nyn n ALA 20 Ca -0.06 -0.95 0.00 0.00 0.00 0.00 0.00 53.44 52.43 1nyn n ALA 20 Cb 0.63 0.76 0.00 0.00 0.00 0.00 0.00 19.45 20.84 1nyn n ALA 20 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1nyn n ALA 21 N -1.27 0.93 -2.85 0.00 0.00 -1.16 -2.27 120.51 113.89 1nyn n ALA 21 Ca -0.12 -0.13 -0.13 0.00 0.00 0.00 0.00 53.44 53.06 1nyn n ALA 21 Cb 0.42 0.00 -0.14 0.00 0.00 0.00 0.00 19.45 19.73 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 -3.56 0.14 0.14 0.00 0.15 -1.26 -3.27 113.70 106.04 1nyn s SER 22 Ca 0.00 -0.03 -0.27 0.00 0.70 0.00 0.00 55.95 56.35 1nyn s SER 22 Cb 0.00 -0.01 -0.03 0.00 -1.71 0.00 0.00 66.02 64.26 1nyn s SER 22 CO 0.00 0.01 1.60 -0.33 1.20 0.00 0.00 173.24 175.72 1nyn h GLU 23 N 6.11 -0.42 -0.88 5.44 5.08 -1.96 0.03 114.58 127.98 1nyn h GLU 23 Ca -0.25 0.03 0.28 0.00 -1.00 0.00 0.00 59.36 58.42 1nyn h GLU 23 Cb 1.21 0.10 -0.16 0.00 0.50 0.00 0.00 28.75 30.39 1nyn h GLU 23 CO 0.51 -0.28 0.15 -1.91 -1.00 0.00 0.00 179.01 176.47 1nyn n GLU 24 N -5.42 -0.07 0.19 2.33 4.07 -1.26 0.41 120.64 120.89 1nyn n GLU 24 Ca -0.03 1.29 0.05 0.00 -0.06 0.00 0.00 57.16 58.41 1nyn n GLU 24 Cb 0.34 -2.13 0.36 0.00 -0.06 0.00 0.00 31.44 29.95 1nyn n GLU 24 CO 0.00 0.00 0.00 -0.07 -0.06 0.00 0.00 177.13 177.00 1nyn h LEU 25 N 0.00 0.00 0.14 4.31 3.38 -1.43 -2.46 115.31 119.25 1nyn h LEU 25 Ca 0.60 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.56 1nyn h LEU 25 Cb 1.35 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.10 1nyn h LEU 25 CO -0.79 0.38 -0.07 0.58 0.09 0.00 0.00 178.44 178.64 1nyn h VAL 26 N 0.00 0.91 -0.03 1.22 2.07 0.87 -2.52 116.25 118.76 1nyn h VAL 26 Ca -0.00 -1.20 0.01 0.00 0.82 0.00 0.00 66.70 66.33 1nyn h VAL 26 Cb 0.82 1.54 -0.00 0.00 -1.52 0.00 0.00 31.29 32.13 1nyn h VAL 26 CO 0.05 0.24 0.05 -0.78 0.02 0.00 0.00 177.57 177.15 1nyn h ASP 27 N -0.85 0.00 0.08 0.57 3.58 -1.05 -1.06 116.42 117.69 1nyn h ASP 27 Ca -0.02 0.00 -0.24 0.00 0.42 0.00 0.00 57.03 57.19 1nyn h ASP 27 Cb 0.54 0.00 0.01 0.00 1.72 0.00 0.00 39.33 41.60 1nyn h ASP 27 CO 0.03 0.00 -0.95 -0.33 -2.88 0.00 0.00 179.24 175.11 1nyn h GLU 28 N 0.00 0.63 -0.05 0.28 5.08 -1.37 -3.28 114.58 115.87 1nyn h GLU 28 Ca 0.02 -0.63 0.00 0.00 -1.00 0.00 0.00 59.36 57.74 1nyn h GLU 28 Cb 0.11 0.17 -0.00 0.00 0.50 0.00 0.00 28.75 29.53 1nyn h GLU 28 CO -0.00 1.24 0.03 -0.92 -1.00 0.00 0.00 179.01 178.36 1nyn h TYR 29 N 0.37 0.06 -1.33 4.33 3.20 -0.74 -1.40 116.97 121.46 1nyn h TYR 29 Ca -0.10 0.00 0.39 0.00 3.14 0.00 0.00 58.73 62.16 1nyn h TYR 29 Cb 1.59 -0.02 -0.08 0.00 1.54 0.00 0.00 36.73 39.76 1nyn h TYR 29 CO 0.09 0.04 0.92 -0.07 -1.64 0.00 0.00 178.16 177.49 1nyn h LEU 30 N 0.06 0.14 -0.75 2.82 3.38 -1.57 2.98 115.31 122.37 1nyn h LEU 30 Ca 0.02 0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1nyn h LEU 30 Cb -0.01 0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.77 1nyn h LEU 30 CO -0.00 -0.02 -0.17 0.29 0.09 0.00 0.00 178.44 178.63 1nyn n LYS 31 N -4.32 1.22 -3.13 1.13 4.01 -0.58 -4.33 118.16 112.15 1nyn n LYS 31 Ca 0.31 -0.75 -0.18 0.00 -0.51 0.00 0.00 58.31 57.19 1nyn n LYS 31 Cb 1.35 -1.48 -0.02 0.00 -0.51 0.00 0.00 35.03 34.37 1nyn n LYS 31 CO 0.00 0.00 0.00 0.09 -1.11 0.00 0.00 177.40 176.38 1nyn n ASN 32 N -0.24 0.30 -4.56 4.39 3.02 0.99 -5.07 115.26 114.10 1nyn n ASN 32 Ca 0.15 -3.06 -0.36 0.00 -0.03 0.00 0.00 54.58 51.28 1nyn n ASN 32 Cb 0.37 -0.28 -0.04 0.00 -0.61 0.00 0.00 39.78 39.22 1nyn n ASN 32 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1nyn s PRO 33 N -1.90 3.01 -0.28 3.52 0.04 -0.76 -4.78 135.00 133.86 1nyn s PRO 33 Ca 0.37 -0.41 -0.18 0.00 0.04 0.00 0.00 61.00 60.82 1nyn s PRO 33 Cb 0.32 -4.90 0.10 0.00 0.04 0.00 0.00 34.50 30.05 1nyn s PRO 33 CO -0.08 -2.68 0.78 0.45 0.04 0.00 0.00 177.00 175.50 1nyn s SER 34 N 6.33 -0.79 -0.35 6.66 0.15 -1.26 -5.10 113.70 119.33 1nyn s SER 34 Ca 0.56 1.31 -0.41 0.00 0.70 0.00 0.00 55.95 58.11 1nyn s SER 34 Cb -0.06 1.33 -0.16 0.00 -1.71 0.00 0.00 66.02 65.42 1nyn s SER 34 CO 0.02 -0.21 1.85 -0.38 1.20 0.00 0.00 173.24 175.73 1nyn n ILE 35 N 3.78 0.21 0.00 6.45 2.08 -1.26 -3.38 119.36 127.24 1nyn n ILE 35 Ca -0.18 -0.08 0.00 0.00 0.56 0.00 0.00 62.75 63.05 1nyn n ILE 35 Cb 0.58 -1.11 0.00 0.00 -0.75 0.00 0.00 39.64 38.35 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 5.00 1.06 0.08 7.39 0.00 -1.26 -4.91 105.19 112.55 1nyn n GLY 36 Ca 0.33 -0.03 -0.04 0.00 0.00 0.00 0.00 46.02 46.28 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 -0.99 1.61 3.64 -1.88 -3.28 116.57 115.66 1nyn h LYS 37 Ca 0.00 0.00 0.35 0.00 -1.27 0.00 0.00 60.65 59.73 1nyn h LYS 37 Cb 0.00 0.00 -0.16 0.00 -0.41 0.00 0.00 32.23 31.66 1nyn h LYS 37 CO 0.00 0.86 0.52 1.25 -2.27 0.00 0.00 179.45 179.81 1nyn h LEU 38 N 0.00 0.37 -0.71 5.20 5.85 -1.90 1.39 115.31 125.52 1nyn h LEU 38 Ca -0.01 0.22 -0.11 0.00 0.84 0.00 0.00 57.88 58.82 1nyn h LEU 38 Cb 1.66 0.21 -0.01 0.00 0.37 0.00 0.00 40.66 42.89 1nyn h LEU 38 CO 0.11 -0.26 -0.24 -1.28 -0.34 0.00 0.00 178.44 176.43 1nyn h SER 39 N 0.18 0.75 0.25 1.25 0.87 -1.84 -0.94 113.55 114.07 1nyn h SER 39 Ca 0.76 -0.27 0.00 0.00 -1.23 0.00 0.00 61.79 61.05 1nyn h SER 39 Cb 1.85 -0.21 0.00 0.00 -0.44 0.00 0.00 62.40 63.60 1nyn h SER 39 CO -0.69 0.96 0.00 -0.08 -0.53 0.00 0.00 176.83 176.50 1nyn h GLU 40 N 0.64 0.00 0.00 2.24 4.81 0.17 -3.33 114.58 119.11 1nyn h GLU 40 Ca 0.09 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.32 1nyn h GLU 40 Cb 0.74 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.12 1nyn h GLU 40 CO 0.06 0.00 0.00 0.28 -0.73 0.00 0.00 179.01 178.62 1nyn n VAL 41 N -2.82 0.00 -0.95 0.32 0.31 -0.81 -4.93 118.33 109.46 1nyn n VAL 41 Ca -0.02 0.25 -0.33 0.00 -0.01 0.00 0.00 64.34 64.24 1nyn n VAL 41 Cb 0.12 -1.24 0.13 0.00 -0.91 0.00 0.00 33.84 31.94 1nyn n VAL 41 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 1nyn n VAL 42 N -2.02 1.08 0.00 2.52 0.31 -0.42 -2.98 118.33 116.82 1nyn n VAL 42 Ca 0.00 -0.17 -0.00 0.00 -0.01 0.00 0.00 64.34 64.16 1nyn n VAL 42 Cb 0.00 -0.99 -0.00 0.00 -0.91 0.00 0.00 33.84 31.94 1nyn n VAL 42 CO 0.00 0.00 0.00 1.21 -1.32 0.00 0.00 176.83 176.72 1nyn n GLU 43 N -2.96 0.01 -3.28 5.55 2.13 -1.26 -4.70 120.64 116.12 1nyn n GLU 43 Ca 0.11 0.00 -0.42 0.00 0.66 0.00 0.00 57.16 57.51 1nyn n GLU 43 Cb 0.51 -0.12 -0.08 0.00 0.27 0.00 0.00 31.44 32.02 1nyn n GLU 43 CO 0.00 0.00 0.00 -1.17 -0.41 0.00 0.00 177.13 175.55 1nyn s LEU 44 N -5.26 4.65 -0.93 4.31 2.96 -1.26 -4.97 118.68 118.19 1nyn s LEU 44 Ca -0.00 -0.44 -0.23 0.00 -0.22 0.00 0.00 54.13 53.24 1nyn s LEU 44 Cb 0.00 -2.48 -0.14 0.00 0.50 0.00 0.00 46.19 44.08 1nyn s LEU 44 CO 0.01 -0.57 1.92 0.49 -1.32 0.00 0.00 176.35 176.88 1nyn n PHE 45 N 5.72 2.19 -3.57 5.38 3.72 -1.26 -4.80 117.46 124.84 1nyn n PHE 45 Ca -0.06 -1.62 -0.12 0.00 -0.05 0.00 0.00 57.45 55.60 1nyn n PHE 45 Cb 0.48 -2.07 -0.04 0.00 -0.94 0.00 0.00 39.48 36.90 1nyn n PHE 45 CO 0.00 0.00 0.00 -2.00 -0.05 0.00 0.00 176.76 174.71 1nyn s GLU 46 N 5.70 1.10 -0.08 -1.08 2.56 -1.26 -5.13 118.70 120.51 1nyn s GLU 46 Ca 0.63 -0.47 0.02 0.00 0.00 0.00 0.00 54.97 55.15 1nyn s GLU 46 Cb 0.08 0.49 0.01 0.00 2.00 0.00 0.00 34.13 36.72 1nyn s GLU 46 CO 0.13 -0.43 -0.12 0.08 -0.56 0.00 0.00 175.26 174.36 1nyn s VAL 47 N -3.24 1.19 0.22 3.70 1.01 -1.26 -4.64 120.40 117.38 1nyn s VAL 47 Ca -0.01 -0.49 0.09 0.00 0.00 0.00 0.00 61.98 61.57 1nyn s VAL 47 Cb 0.00 -1.10 -0.04 0.00 0.00 0.00 0.00 36.38 35.24 1nyn s VAL 47 CO -0.08 0.37 -0.05 -0.36 0.00 0.00 0.00 175.10 174.98 1nyn s PHE 48 N 0.81 2.67 0.07 5.22 0.40 -1.09 -3.30 117.98 122.77 1nyn s PHE 48 Ca -0.12 -0.21 -0.15 0.00 -0.60 0.00 0.00 56.93 55.85 1nyn s PHE 48 Cb -0.15 -1.25 0.03 0.00 0.51 0.00 0.00 43.02 42.16 1nyn s PHE 48 CO 0.02 0.57 0.36 -0.08 0.70 0.00 0.00 175.22 176.79 1nyn s THR 49 N -2.00 0.07 1.21 0.64 -1.32 -0.83 -0.74 115.64 112.68 1nyn s THR 49 Ca 0.28 -0.62 -0.20 0.00 -1.21 0.00 0.00 61.69 59.95 1nyn s THR 49 Cb -0.08 -1.05 0.29 0.00 -1.51 0.00 0.00 72.50 70.15 1nyn s THR 49 CO 0.18 -0.34 1.12 -2.16 -2.21 0.00 0.00 174.62 171.20 1nyn s PRO 50 N -3.04 -1.30 0.00 7.08 0.04 -1.26 0.28 135.00 136.79 1nyn s PRO 50 Ca -0.02 -0.12 0.00 0.00 0.04 0.00 0.00 61.00 60.90 1nyn s PRO 50 Cb 0.01 -1.59 0.00 0.00 0.04 0.00 0.00 34.50 32.95 1nyn s PRO 50 CO -0.06 -3.76 0.00 0.00 0.04 0.00 0.00 177.00 173.22 1nyn n GLN 51 N -4.78 0.00 -0.55 4.56 10.64 -1.26 -4.59 117.38 121.40 1nyn n GLN 51 Ca 0.14 0.00 0.07 0.00 -1.83 0.00 0.00 57.00 55.37 1nyn n GLN 51 Cb 0.60 0.00 0.15 0.00 -0.86 0.00 0.00 30.24 30.13 1nyn n GLN 51 CO 0.00 0.00 0.00 -0.25 -1.83 0.00 0.00 177.06 174.98 1nyn n ASP 52 N 0.00 1.70 0.00 2.61 8.00 -1.26 -5.00 116.55 122.60 1nyn n ASP 52 Ca 0.00 -3.32 0.00 0.00 0.71 0.00 0.00 54.79 52.18 1nyn n ASP 52 Cb 0.00 -0.45 0.00 0.00 -0.02 0.00 0.00 41.12 40.65 1nyn n ASP 52 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1nyn n GLY 53 N -0.95 0.85 0.00 0.44 0.00 -1.26 -5.01 105.19 99.27 1nyn n GLY 53 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.17 1nyn n GLY 53 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1nyn n ARG 54 N 0.00 1.32 0.00 1.61 1.85 -1.26 -5.11 116.66 115.08 1nyn n ARG 54 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 57.85 56.85 1nyn n ARG 54 Cb 0.00 -0.88 0.00 0.00 -1.05 0.00 0.00 32.46 30.53 1nyn n ARG 54 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 1nyn n GLY 55 N 2.01 4.65 3.79 2.89 0.00 -1.26 -5.03 105.19 112.23 1nyn n GLY 55 Ca 0.00 -0.84 -0.25 0.00 0.00 0.00 0.00 46.02 44.93 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 -1.09 -2.80 0.03 4.61 0.00 -1.26 -4.90 120.51 115.10 1nyn n ALA 56 Ca 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.16 1nyn n ALA 56 Cb 0.00 -0.76 0.00 0.00 0.00 0.00 0.00 19.45 18.69 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 -2.67 0.00 0.00 0.00 -0.58 -1.26 -5.12 120.64 111.01 1nyn n GLU 57 Ca -0.31 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.43 1nyn n GLU 57 Cb 0.69 -0.22 0.00 0.00 -0.57 0.00 0.00 31.44 31.34 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 3.26 6.35 0.81 0.62 0.00 -1.26 -5.11 105.19 109.87 1nyn n GLY 58 Ca 0.00 -2.00 -0.05 0.00 0.00 0.00 0.00 46.02 43.96 1nyn n GLY 58 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1nyn n GLU 59 N 0.00 -1.10 -4.23 1.61 0.28 -1.26 -4.99 120.64 110.95 1nyn n GLU 59 Ca 0.00 -0.25 -0.24 0.00 -0.16 0.00 0.00 57.16 56.50 1nyn n GLU 59 Cb 0.00 -0.43 -0.08 0.00 1.43 0.00 0.00 31.44 32.37 1nyn n GLU 59 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 177.13 176.46 1nyn s LEU 60 N 0.00 3.10 -0.03 -1.84 1.43 -1.26 -4.67 118.68 115.40 1nyn s LEU 60 Ca 0.12 -0.94 0.04 0.00 -1.03 0.00 0.00 54.13 52.31 1nyn s LEU 60 Cb -0.02 -1.48 -0.00 0.00 0.03 0.00 0.00 46.19 44.71 1nyn s LEU 60 CO 0.10 -0.32 -0.14 -0.83 0.23 0.00 0.00 176.35 175.39 1nyn s GLY 61 N -3.79 0.77 0.27 -3.19 0.00 0.14 -4.95 107.32 96.57 1nyn s GLY 61 Ca 0.37 -0.57 -0.30 0.00 0.00 0.00 0.00 44.72 44.21 1nyn s GLY 61 CO 0.21 -0.31 1.59 0.00 0.00 0.00 0.00 173.10 174.60 1nyn s ALA 62 N 0.01 3.77 0.06 3.20 0.00 -1.26 -1.97 121.76 125.56 1nyn s ALA 62 Ca -0.02 1.53 -0.31 0.00 0.00 0.00 0.00 51.96 53.17 1nyn s ALA 62 Cb -0.10 -3.64 -0.06 0.00 0.00 0.00 0.00 23.12 19.33 1nyn s ALA 62 CO 0.01 -0.93 1.19 0.00 0.00 0.00 0.00 175.76 176.02 1nyn s ALA 63 N 0.25 3.38 0.01 0.00 0.00 -1.21 -4.88 121.76 119.32 1nyn s ALA 63 Ca 0.65 0.83 -0.29 0.00 0.00 0.00 0.00 51.96 53.16 1nyn s ALA 63 Cb -0.47 -3.44 -0.04 0.00 0.00 0.00 0.00 23.12 19.17 1nyn s ALA 63 CO 0.44 -0.42 0.92 -1.12 0.00 0.00 0.00 175.76 175.58 1nyn s SER 64 N 1.03 7.33 0.36 0.00 0.01 -1.26 -4.89 113.70 116.28 1nyn s SER 64 Ca 0.58 1.60 0.20 0.00 1.31 0.00 0.00 55.95 59.64 1nyn s SER 64 Cb -0.29 -2.54 1.30 0.00 0.21 0.00 0.00 66.02 64.70 1nyn s SER 64 CO 0.29 -0.19 1.59 0.07 0.41 0.00 0.00 173.24 175.41 1nyn h LYS 65 N 6.51 0.03 -0.37 12.44 2.10 -1.99 2.61 116.57 137.91 1nyn h LYS 65 Ca -0.41 -0.00 0.05 0.00 -2.00 0.00 0.00 60.65 58.29 1nyn h LYS 65 Cb 1.21 -0.01 -0.02 0.00 -0.90 0.00 0.00 32.23 32.52 1nyn h LYS 65 CO 0.74 0.02 0.25 0.00 -2.00 0.00 0.00 179.45 178.46 1nyn h ALA 66 N 1.98 2.00 0.02 0.07 0.00 -1.99 0.68 119.26 122.03 1nyn h ALA 66 Ca 0.83 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.73 1nyn h ALA 66 Cb 2.16 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 19.89 1nyn h ALA 66 CO -0.76 -0.07 -0.01 1.96 0.00 0.00 0.00 179.25 180.37 1nyn h GLN 67 N 0.27 -0.02 -0.86 0.00 1.08 0.42 -3.09 115.11 112.90 1nyn h GLN 67 Ca 0.16 0.00 0.06 0.00 -1.45 0.00 0.00 58.65 57.42 1nyn h GLN 67 Cb 0.30 0.01 -0.06 0.00 -0.05 0.00 0.00 27.48 27.67 1nyn h GLN 67 CO -0.03 0.72 0.53 0.28 -0.95 0.00 0.00 178.83 179.38 1nyn h VAL 68 N -0.84 1.04 -0.88 -0.54 2.07 -1.01 -1.32 116.25 114.77 1nyn h VAL 68 Ca -0.00 -0.33 0.09 0.00 0.82 0.00 0.00 66.70 67.27 1nyn h VAL 68 Cb 0.75 -0.02 -0.07 0.00 -1.52 0.00 0.00 31.29 30.43 1nyn h VAL 68 CO 0.00 0.18 0.53 -0.33 0.02 0.00 0.00 177.57 177.97 1nyn h GLU 69 N 0.98 0.87 0.00 1.57 5.08 -0.94 -0.01 114.58 122.12 1nyn h GLU 69 Ca 0.38 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.68 1nyn h GLU 69 Cb 0.17 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.22 1nyn h GLU 69 CO -0.17 0.58 0.95 -0.97 -1.00 0.00 0.00 179.01 178.39 1nyn h ASN 70 N 0.90 0.00 0.00 1.42 -0.00 -1.15 -2.35 115.58 114.40 1nyn h ASN 70 Ca 0.42 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 56.72 1nyn h ASN 70 Cb 0.34 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 38.66 1nyn h ASN 70 CO -0.23 0.00 -0.25 -0.62 -0.00 0.00 0.00 177.43 176.32 1nyn n GLU 71 N -2.41 0.13 -2.73 6.67 -0.58 -0.07 -4.83 120.64 116.82 1nyn n GLU 71 Ca -0.00 0.05 -0.06 0.00 -0.42 0.00 0.00 57.16 56.73 1nyn n GLU 71 Cb 0.95 -0.70 0.05 0.00 -0.57 0.00 0.00 31.44 31.17 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 -3.65 -2.62 -0.47 -0.32 1.16 -0.88 -4.97 117.46 105.71 1nyn n PHE 72 Ca -0.04 -1.36 0.00 0.00 -1.87 0.00 0.00 57.45 54.18 1nyn n PHE 72 Cb 0.13 1.41 0.00 0.00 -1.61 0.00 0.00 39.48 39.41 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 1.93 -0.32 3.54 4.97 0.00 -1.24 -4.75 105.19 109.32 1nyn n GLY 73 Ca 0.09 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.68 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 -0.01 3.38 -0.68 1.61 2.20 -1.26 -3.73 119.74 121.25 1nyn s LYS 74 Ca 0.00 -0.14 -0.01 0.00 -0.36 0.00 0.00 55.97 55.46 1nyn s LYS 74 Cb 0.00 -4.03 0.00 0.00 -1.51 0.00 0.00 37.83 32.29 1nyn s LYS 74 CO 0.00 -1.46 0.13 0.41 -0.36 0.00 0.00 175.35 174.07 1nyn n GLY 75 N 5.08 0.10 2.76 5.54 0.00 -1.26 -5.00 105.19 112.41 1nyn n GLY 75 Ca 0.03 -0.47 -0.30 0.00 0.00 0.00 0.00 46.02 45.28 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 -4.71 0.79 0.77 1.61 1.02 -1.24 -5.11 119.74 112.85 1nyn s LYS 76 Ca 0.06 -1.14 -0.16 0.00 0.02 0.00 0.00 55.97 54.75 1nyn s LYS 76 Cb -0.03 -2.10 -0.08 0.00 -0.52 0.00 0.00 37.83 35.10 1nyn s LYS 76 CO 0.08 -0.98 0.08 1.63 -0.92 0.00 0.00 175.35 175.24 1nyn n LYS 77 N 4.79 0.10 0.32 1.68 5.02 -1.26 -4.46 118.16 124.35 1nyn n LYS 77 Ca -0.02 0.06 0.20 0.00 -2.02 0.00 0.00 58.31 56.53 1nyn n LYS 77 Cb 0.42 -1.48 1.07 0.00 -0.02 0.00 0.00 35.03 35.02 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 -0.58 0.14 0.11 -0.18 6.09 -1.99 -1.62 117.51 119.49 1nyn h ILE 78 Ca -0.44 0.00 -0.01 0.00 -1.37 0.00 0.00 64.86 63.04 1nyn h ILE 78 Cb 1.35 0.93 0.00 0.00 0.47 0.00 0.00 36.82 39.57 1nyn h ILE 78 CO 0.37 0.00 -0.05 -0.33 -3.07 0.00 0.00 178.15 175.07 1nyn h GLU 79 N 0.00 -0.14 -0.39 2.19 5.08 -2.01 -2.79 114.58 116.51 1nyn h GLU 79 Ca 0.01 0.01 -0.08 0.00 -1.00 0.00 0.00 59.36 58.30 1nyn h GLU 79 Cb 0.17 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.44 1nyn h GLU 79 CO -0.00 0.26 -0.07 0.93 -1.00 0.00 0.00 179.01 179.13 1nyn h GLU 80 N -0.60 0.74 -0.53 2.33 4.39 -1.69 -2.78 114.58 116.44 1nyn h GLU 80 Ca -0.02 -0.27 0.11 0.00 0.34 0.00 0.00 59.36 59.52 1nyn h GLU 80 Cb 0.48 -0.05 -0.11 0.00 -0.10 0.00 0.00 28.75 28.97 1nyn h GLU 80 CO 0.03 0.87 -0.21 0.28 -1.16 0.00 0.00 179.01 178.82 1nyn h VAL 81 N 0.56 0.35 -0.52 3.13 2.07 -1.36 0.32 116.25 120.80 1nyn h VAL 81 Ca 0.10 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.61 1nyn h VAL 81 Cb 0.58 0.35 -0.03 0.00 -1.52 0.00 0.00 31.29 30.67 1nyn h VAL 81 CO 0.03 0.00 0.27 0.40 0.02 0.00 0.00 177.57 178.30 1nyn h ILE 82 N -0.08 1.17 0.38 4.57 2.04 -1.40 -2.94 117.51 121.24 1nyn h ILE 82 Ca 0.25 -0.43 -0.02 0.00 1.00 0.00 0.00 64.86 65.66 1nyn h ILE 82 Cb 0.47 0.47 0.00 0.00 -0.74 0.00 0.00 36.82 37.02 1nyn h ILE 82 CO -0.59 0.18 -0.18 -0.78 0.00 0.00 0.00 178.15 176.79 1nyn h ASP 83 N 0.73 -0.43 -1.68 1.72 3.58 -0.13 0.14 116.42 120.34 1nyn h ASP 83 Ca 0.19 0.01 0.52 0.00 0.42 0.00 0.00 57.03 58.17 1nyn h ASP 83 Cb 0.04 0.11 -0.11 0.00 1.72 0.00 0.00 39.33 41.09 1nyn h ASP 83 CO -0.03 -0.31 1.16 -0.07 -2.88 0.00 0.00 179.24 177.12 1nyn h LEU 84 N -0.52 0.10 0.03 2.28 3.38 -1.20 2.52 115.31 121.90 1nyn h LEU 84 Ca -0.05 0.07 -0.23 0.00 0.09 0.00 0.00 57.88 57.76 1nyn h LEU 84 Cb 0.39 0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.19 1nyn h LEU 84 CO 0.09 -0.12 -1.10 0.40 0.09 0.00 0.00 178.44 177.80 1nyn h ILE 85 N 0.01 1.62 0.00 1.22 2.04 -1.22 -3.12 117.51 118.06 1nyn h ILE 85 Ca 0.90 -3.31 0.00 0.00 1.00 0.00 0.00 64.86 63.46 1nyn h ILE 85 Cb 3.30 2.85 0.00 0.00 -0.74 0.00 0.00 36.82 42.23 1nyn h ILE 85 CO -0.22 0.94 0.00 0.18 0.00 0.00 0.00 178.15 179.05 1nyn n LEU 86 N -3.38 0.00 0.03 1.44 4.77 0.84 -3.26 117.00 117.44 1nyn n LEU 86 Ca -0.03 0.02 -0.19 0.00 -0.03 0.00 0.00 56.01 55.78 1nyn n LEU 86 Cb 0.97 -0.02 -0.10 0.00 -2.33 0.00 0.00 43.42 41.93 1nyn n LEU 86 CO 0.48 -0.00 0.13 -0.09 -1.33 0.00 0.00 177.39 176.58 1nyn h ARG 87 N 0.00 0.66 0.00 3.23 2.43 -1.23 -3.41 114.38 116.05 1nyn h ARG 87 Ca 0.00 -0.69 0.00 0.00 -0.81 0.00 0.00 59.98 58.48 1nyn h ARG 87 Cb 0.02 0.19 0.00 0.00 -0.42 0.00 0.00 29.97 29.76 1nyn h ARG 87 CO 0.00 1.28 0.00 0.09 -1.51 0.00 0.00 179.97 179.83 1nyn n ASN 88 N -3.94 0.00 -1.27 -3.80 4.13 -1.21 -5.11 115.26 104.07 1nyn n ASN 88 Ca -0.11 0.06 0.00 0.00 1.68 0.00 0.00 54.58 56.22 1nyn n ASN 88 Cb 0.83 -0.33 0.00 0.00 -1.54 0.00 0.00 39.78 38.74 1nyn n ASN 88 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1nyn n GLY 89 N 1.90 -4.31 3.51 7.41 0.00 -1.20 -4.74 105.19 107.76 1nyn n GLY 89 Ca 0.00 -0.48 -0.25 0.00 0.00 0.00 0.00 46.02 45.29 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 0.80 -1.63 -2.19 1.61 5.02 -1.23 -4.82 118.16 115.72 1nyn n LYS 90 Ca 0.00 0.62 -0.32 0.00 -2.02 0.00 0.00 58.31 56.59 1nyn n LYS 90 Cb 0.00 -4.81 -0.04 0.00 -0.02 0.00 0.00 35.03 30.16 1nyn n LYS 90 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1nyn s PRO 91 N -5.33 2.83 0.09 1.97 0.04 -1.26 -4.43 135.00 128.91 1nyn s PRO 91 Ca 0.47 -0.38 0.00 0.00 0.04 0.00 0.00 61.00 61.13 1nyn s PRO 91 Cb -0.13 -5.02 0.00 0.00 0.04 0.00 0.00 34.50 29.39 1nyn s PRO 91 CO 0.81 -2.98 0.00 0.09 0.04 0.00 0.00 177.00 174.96 1nyn n ASN 92 N 12.47 -0.63 -0.38 6.66 4.13 -1.26 -4.86 115.26 131.40 1nyn n ASN 92 Ca 0.35 0.17 0.00 0.00 1.68 0.00 0.00 54.58 56.78 1nyn n ASN 92 Cb 0.49 0.84 0.00 0.00 -1.54 0.00 0.00 39.78 39.56 1nyn n ASN 92 CO 0.00 0.00 0.00 -1.54 0.28 0.00 0.00 177.26 176.00 1nyn n SER 93 N -2.72 0.36 -0.67 6.41 3.41 -1.26 -3.97 113.62 115.18 1nyn n SER 93 Ca 0.00 -0.95 0.00 0.00 -0.26 0.00 0.00 58.87 57.66 1nyn n SER 93 Cb 0.00 -0.18 0.00 0.00 -0.26 0.00 0.00 64.21 63.77 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 0.07 0.12 -3.55 6.66 -2.24 -1.26 -3.99 114.28 110.09 1nyn n THR 94 Ca 0.00 0.00 -0.28 0.00 -2.27 0.00 0.00 64.05 61.50 1nyn n THR 94 Cb 0.09 -0.34 -0.11 0.00 -2.10 0.00 0.00 70.33 67.87 1nyn n THR 94 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1nyn s THR 95 N -0.44 1.06 -1.06 4.28 -4.23 -1.25 -5.05 115.64 108.95 1nyn s THR 95 Ca 0.00 -3.00 -0.22 0.00 -1.18 0.00 0.00 61.69 57.29 1nyn s THR 95 Cb 0.00 -1.72 0.04 0.00 1.34 0.00 0.00 72.50 72.16 1nyn s THR 95 CO 0.00 -1.14 1.56 -0.44 -0.54 0.00 0.00 174.62 174.06 1nyn s SER 96 N -0.24 6.38 0.45 3.99 0.01 -1.26 -4.94 113.70 118.09 1nyn s SER 96 Ca 0.29 -1.54 0.03 0.00 1.31 0.00 0.00 55.95 56.04 1nyn s SER 96 Cb -0.02 -2.57 0.03 0.00 0.21 0.00 0.00 66.02 63.67 1nyn s SER 96 CO -0.16 -1.62 0.26 -1.54 0.41 0.00 0.00 173.24 170.59 1nyn n SER 97 N 9.46 2.65 -4.24 2.44 3.41 -1.26 -5.10 113.62 120.98 1nyn n SER 97 Ca 0.37 -2.65 -0.31 0.00 -0.26 0.00 0.00 58.87 56.01 1nyn n SER 97 Cb 0.50 0.05 0.18 0.00 -0.26 0.00 0.00 64.21 64.68 1nyn n SER 97 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1nyn n LEU 98 N 0.00 -2.25 -4.79 1.04 4.32 -1.26 -4.92 117.00 109.14 1nyn n LEU 98 Ca -0.06 -0.17 -0.39 0.00 -0.02 0.00 0.00 56.01 55.37 1nyn n LEU 98 Cb 0.53 -0.96 -0.06 0.00 -1.62 0.00 0.00 43.42 41.30 1nyn n LEU 98 CO 0.30 -3.13 0.40 -0.54 -1.22 0.00 0.00 177.39 173.21 1nyn s LYS 99 N -3.55 4.43 -0.01 3.23 1.02 -1.26 -4.94 119.74 118.66 1nyn s LYS 99 Ca 0.56 0.99 0.01 0.00 0.02 0.00 0.00 55.97 57.56 1nyn s LYS 99 Cb -0.12 -3.26 0.02 0.00 -0.52 0.00 0.00 37.83 33.95 1nyn s LYS 99 CO 0.64 0.58 0.75 0.25 -0.92 0.00 0.00 175.35 176.65 1nyn n THR 100 N 1.72 0.39 0.00 2.17 -2.24 -1.26 -5.08 114.28 109.98 1nyn n THR 100 Ca -0.07 -0.42 0.00 0.00 -2.27 0.00 0.00 64.05 61.29 1nyn n THR 100 Cb 0.50 0.71 0.00 0.00 -2.10 0.00 0.00 70.33 69.44 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 -0.23 0.00 -1.52 -0.78 5.02 -1.26 -4.85 118.16 114.55 1nyn n LYS 101 Ca 0.01 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.30 1nyn n LYS 101 Cb 0.47 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.48 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 0.00 0.46 0.00 0.72 0.00 -1.26 -5.07 105.19 100.05 1nyn n GLY 102 Ca 0.00 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.27 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 0.00 0.08 0.00 -0.02 0.00 -1.26 -4.94 105.19 99.05 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 -2.01 0.00 0.00 0.00 173.32 171.31 1nyn n ASN 104 N 0.00 0.00 -4.85 1.61 5.15 -1.26 -4.60 115.26 111.31 1nyn n ASN 104 Ca 0.00 0.12 -0.32 0.00 -0.60 0.00 0.00 54.58 53.79 1nyn n ASN 104 Cb 0.00 -0.12 -0.04 0.00 -0.53 0.00 0.00 39.78 39.09 1nyn n ASN 104 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1nyn s ALA 105 N -2.16 3.19 0.00 5.20 0.00 -1.26 -4.95 121.76 121.78 1nyn s ALA 105 Ca 0.00 0.04 0.00 0.00 0.00 0.00 0.00 51.96 52.00 1nyn s ALA 105 Cb 0.00 -2.94 0.00 0.00 0.00 0.00 0.00 23.12 20.18 1nyn s ALA 105 CO 0.00 -0.08 0.00 0.41 0.00 0.00 0.00 175.76 176.09 1nyn n GLY 106 N -1.32 0.00 0.00 0.00 0.00 -1.26 -4.98 105.19 97.63 1nyn n GLY 106 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 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 0.00 0.00 -3.16 2.61 -2.24 -1.26 -2.56 114.28 107.67 1nyn n THR 107 Ca 0.00 0.00 -0.20 0.00 -2.27 0.00 0.00 64.05 61.58 1nyn n THR 107 Cb 0.00 -0.91 -0.04 0.00 -2.10 0.00 0.00 70.33 67.28 1nyn n THR 107 CO 0.00 0.00 0.00 2.29 -0.57 0.00 0.00 175.07 176.79 1nyn n LYS 108 N -0.90 1.30 0.00 -0.78 2.85 -1.26 -4.93 118.16 114.44 1nyn n LYS 108 Ca 0.00 -3.60 0.00 0.00 -1.05 0.00 0.00 58.31 53.66 1nyn n LYS 108 Cb 0.00 -1.72 0.00 0.00 -0.65 0.00 0.00 35.03 32.66 1nyn n LYS 108 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1nyn n ALA 109 N 0.40 0.74 -0.25 0.58 0.00 -1.06 -4.97 120.51 115.96 1nyn n ALA 109 Ca 0.25 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.63 1nyn n ALA 109 Cb 0.59 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.99 1nyn n ALA 109 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1nyn n TYR 110 N -1.26 -0.26 -1.13 0.00 4.01 -1.26 -5.21 117.16 112.05 1nyn n TYR 110 Ca 0.00 0.73 0.00 0.00 -0.16 0.00 0.00 57.90 58.47 1nyn n TYR 110 Cb 0.00 -0.54 0.00 0.00 -0.31 0.00 0.00 39.34 38.49 1nyn n TYR 110 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49