#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yux n SER 2 N 0.00 0.00 -3.61 1.61 2.88 -1.26 -5.19 113.62 108.05 2yux n SER 2 Ca 0.00 0.00 0.01 0.00 -1.33 0.00 0.00 58.87 57.55 2yux n SER 2 Cb 0.00 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.45 2yux n SER 2 CO 0.00 0.00 0.00 -0.94 -1.23 0.00 0.00 175.04 172.87 2yux s SER 3 N 0.00 -0.07 0.27 -3.46 1.04 -1.26 -5.19 113.70 105.03 2yux s SER 3 Ca 0.00 -0.10 -0.15 0.00 0.48 0.00 0.00 55.95 56.18 2yux s SER 3 Cb 0.00 0.14 0.01 0.00 0.10 0.00 0.00 66.02 66.27 2yux s SER 3 CO 0.00 -0.26 0.57 -0.83 0.98 0.00 0.00 173.24 173.70 2yux s GLY 4 N -2.82 0.36 0.14 7.32 0.00 -1.26 -5.19 107.32 105.88 2yux s GLY 4 Ca 0.13 -0.71 -0.04 0.00 0.00 0.00 0.00 44.72 44.10 2yux s GLY 4 CO -0.04 -0.45 0.13 -0.56 0.00 0.00 0.00 173.10 172.18 2yux s SER 5 N -3.00 0.22 -0.09 1.64 0.01 -1.26 -5.17 113.70 106.05 2yux s SER 5 Ca 0.19 -1.10 -0.07 0.00 1.31 0.00 0.00 55.95 56.28 2yux s SER 5 Cb -0.03 0.34 0.03 0.00 0.21 0.00 0.00 66.02 66.58 2yux s SER 5 CO 0.09 -0.78 0.23 -0.94 0.41 0.00 0.00 173.24 172.24 2yux s SER 6 N -3.02 -0.24 0.00 2.44 1.04 -1.26 -5.09 113.70 107.57 2yux s SER 6 Ca 0.22 0.47 0.00 0.00 0.48 0.00 0.00 55.95 57.11 2yux s SER 6 Cb 0.06 0.43 0.00 0.00 0.10 0.00 0.00 66.02 66.61 2yux s SER 6 CO 0.01 -0.11 0.00 0.61 0.98 0.00 0.00 173.24 174.73 2yux n GLY 7 N 3.40 0.41 1.32 7.32 0.00 -1.26 -5.15 105.19 111.24 2yux n GLY 7 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.85 2yux n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2yux n ALA 8 N -1.86 -1.73 -0.09 4.61 0.00 -1.26 -4.94 120.51 115.23 2yux n ALA 8 Ca 0.00 0.40 -0.17 0.00 0.00 0.00 0.00 53.44 53.67 2yux n ALA 8 Cb 0.00 -1.31 -0.07 0.00 0.00 0.00 0.00 19.45 18.07 2yux n ALA 8 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2yux n SER 9 N -2.27 1.78 -4.00 0.00 7.64 -1.26 -5.01 113.62 110.49 2yux n SER 9 Ca 0.00 0.12 -0.19 0.00 1.01 0.00 0.00 58.87 59.80 2yux n SER 9 Cb 0.36 -0.46 -0.15 0.00 -1.01 0.00 0.00 64.21 62.96 2yux n SER 9 CO 0.00 0.00 0.00 0.27 -3.01 0.00 0.00 175.04 172.30 2yux s ILE 10 N -2.34 0.72 0.00 0.44 -0.00 -1.26 -5.13 121.20 113.62 2yux s ILE 10 Ca -0.25 -0.35 0.00 0.00 -0.00 0.00 0.00 60.65 60.04 2yux s ILE 10 Cb 0.09 -0.63 0.00 0.00 -0.00 0.00 0.00 42.46 41.92 2yux s ILE 10 CO 0.35 0.22 0.00 -0.67 -0.00 0.00 0.00 174.94 174.84 2yux n ASP 11 N 3.10 0.00 -3.10 4.36 2.03 -1.26 -5.07 116.55 116.61 2yux n ASP 11 Ca -0.16 0.00 -0.17 0.00 0.52 0.00 0.00 54.79 54.98 2yux n ASP 11 Cb 0.56 0.00 0.02 0.00 -0.72 0.00 0.00 41.12 40.97 2yux n ASP 11 CO 0.00 0.00 0.00 -0.38 -1.92 0.00 0.00 177.20 174.90 2yux n ILE 12 N -0.17 -2.60 -4.31 5.18 5.41 -1.26 -4.97 119.36 116.64 2yux n ILE 12 Ca 0.00 0.27 -0.22 0.00 1.00 0.00 0.00 62.75 63.79 2yux n ILE 12 Cb 0.00 -2.93 -0.12 0.00 -0.71 0.00 0.00 39.64 35.88 2yux n ILE 12 CO 0.00 0.00 0.00 -1.10 0.00 0.00 0.00 176.55 175.45 2yux s GLN 13 N -1.53 1.20 -0.06 0.38 -0.21 -1.26 -4.91 119.66 113.27 2yux s GLN 13 Ca 0.17 -1.31 -0.06 0.00 0.02 0.00 0.00 55.36 54.18 2yux s GLN 13 Cb -0.02 -1.32 0.01 0.00 1.00 0.00 0.00 33.01 32.68 2yux s GLN 13 CO 0.38 0.28 0.09 -0.89 -2.12 0.00 0.00 175.29 173.03 2yux n ILE 14 N 0.59 -1.98 -3.35 1.08 5.41 -1.26 -4.84 119.36 115.01 2yux n ILE 14 Ca -0.16 0.37 -0.46 0.00 1.00 0.00 0.00 62.75 63.50 2yux n ILE 14 Cb 0.56 -2.65 -0.03 0.00 -0.71 0.00 0.00 39.64 36.81 2yux n ILE 14 CO 0.00 0.00 0.00 -0.63 0.00 0.00 0.00 176.55 175.92 2yux s ILE 15 N -0.92 5.43 -0.05 1.39 1.01 -1.26 -5.04 121.20 121.76 2yux s ILE 15 Ca 0.05 -2.35 -0.24 0.00 0.00 0.00 0.00 60.65 58.11 2yux s ILE 15 Cb -0.01 -4.38 -0.04 0.00 0.01 0.00 0.00 42.46 38.05 2yux s ILE 15 CO 0.12 -0.99 0.74 -1.81 0.00 0.00 0.00 174.94 173.00 2yux s ASP 16 N 2.29 7.05 -0.00 3.58 1.01 -1.26 -4.67 116.67 124.67 2yux s ASP 16 Ca 0.16 1.26 -0.01 0.00 0.71 0.00 0.00 52.55 54.67 2yux s ASP 16 Cb -0.14 -2.43 0.00 0.00 1.01 0.00 0.00 42.92 41.36 2yux s ASP 16 CO -0.07 -0.12 0.02 0.54 0.21 0.00 0.00 175.17 175.76 2yux n ARG 17 N 3.70 -4.61 0.15 8.23 1.74 -1.26 -4.83 116.66 119.79 2yux n ARG 17 Ca -0.01 3.35 0.13 0.00 -0.77 0.00 0.00 57.85 60.55 2yux n ARG 17 Cb 0.51 -4.31 0.45 0.00 -1.02 0.00 0.00 32.46 28.09 2yux n ARG 17 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 2yux h PRO 18 N 4.29 0.00 0.00 5.56 0.13 -1.89 -3.49 132.00 136.59 2yux h PRO 18 Ca -0.05 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.08 2yux h PRO 18 Cb 0.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.25 2yux h PRO 18 CO 0.00 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.18 2yux n GLY 19 N 0.63 -2.28 3.78 1.56 0.00 -1.26 -4.87 105.19 102.74 2yux n GLY 19 Ca 0.03 -1.68 -0.29 0.00 0.00 0.00 0.00 46.02 44.08 2yux n GLY 19 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2yux s PRO 20 N -0.31 0.47 0.61 1.61 0.04 -1.25 -3.99 135.00 132.18 2yux s PRO 20 Ca 0.00 0.03 -0.14 0.00 0.04 0.00 0.00 61.00 60.93 2yux s PRO 20 Cb 0.00 -1.78 -0.03 0.00 0.04 0.00 0.00 34.50 32.73 2yux s PRO 20 CO 0.00 -2.60 1.05 -1.25 0.04 0.00 0.00 177.00 174.24 2yux s PRO 21 N -5.46 3.28 0.15 0.56 0.04 -1.26 -4.85 135.00 127.46 2yux s PRO 21 Ca 0.68 1.11 -0.24 0.00 0.04 0.00 0.00 61.00 62.59 2yux s PRO 21 Cb -0.11 -2.03 0.02 0.00 0.04 0.00 0.00 34.50 32.42 2yux s PRO 21 CO 0.54 -0.83 1.61 1.96 0.04 0.00 0.00 177.00 180.31 2yux h GLN 22 N 0.18 -0.30 -3.36 4.56 4.20 -1.60 -3.44 115.11 115.35 2yux h GLN 22 Ca -0.46 0.02 -0.04 0.00 0.06 0.00 0.00 58.65 58.23 2yux h GLN 22 Cb 1.21 0.07 -0.11 0.00 0.30 0.00 0.00 27.48 28.95 2yux h GLN 22 CO 0.58 -0.20 -0.02 -1.50 -0.67 0.00 0.00 178.83 177.02 2yux s ILE 23 N -6.00 0.04 -0.10 2.54 -1.16 -1.26 -4.97 121.20 110.28 2yux s ILE 23 Ca -0.15 -0.74 -0.03 0.00 -0.51 0.00 0.00 60.65 59.21 2yux s ILE 23 Cb 0.12 -1.47 0.05 0.00 0.61 0.00 0.00 42.46 41.77 2yux s ILE 23 CO 0.67 -0.18 0.09 -0.69 -2.81 0.00 0.00 174.94 172.02 2yux s VAL 24 N -3.86 -0.12 0.35 4.00 1.01 -1.26 -0.63 120.40 119.88 2yux s VAL 24 Ca 0.08 0.18 0.05 0.00 0.00 0.00 0.00 61.98 62.28 2yux s VAL 24 Cb 0.00 -0.34 -0.07 0.00 0.00 0.00 0.00 36.38 35.97 2yux s VAL 24 CO -0.05 -0.01 0.05 -1.59 0.00 0.00 0.00 175.10 173.49 2yux s LYS 25 N 2.17 1.73 -0.35 2.72 -2.85 0.51 -3.68 119.74 120.00 2yux s LYS 25 Ca 0.04 -1.97 -0.03 0.00 -1.00 0.00 0.00 55.97 53.01 2yux s LYS 25 Cb -0.14 -1.05 0.07 0.00 -2.06 0.00 0.00 37.83 34.65 2yux s LYS 25 CO -0.06 -0.16 0.10 0.42 0.10 0.00 0.00 175.35 175.75 2yux s ILE 26 N -3.15 3.29 0.31 3.79 1.01 -1.26 0.20 121.20 125.38 2yux s ILE 26 Ca 0.36 -1.55 0.06 0.00 0.00 0.00 0.00 60.65 59.51 2yux s ILE 26 Cb 0.09 -3.01 0.33 0.00 0.01 0.00 0.00 42.46 39.88 2yux s ILE 26 CO 0.16 -0.33 1.64 -0.33 0.00 0.00 0.00 174.94 176.09 2yux h GLU 27 N 8.07 0.20 0.00 2.79 4.39 -0.69 -3.46 114.58 125.89 2yux h GLU 27 Ca -0.19 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.50 2yux h GLU 27 Cb 1.06 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 29.67 2yux h GLU 27 CO 0.61 0.13 0.00 -3.47 -1.16 0.00 0.00 179.01 175.12 2yux n ASP 28 N -5.21 0.00 -3.68 1.42 2.03 -1.18 -4.99 116.55 104.95 2yux n ASP 28 Ca 0.25 0.00 -0.13 0.00 0.52 0.00 0.00 54.79 55.43 2yux n ASP 28 Cb 0.79 0.00 -0.13 0.00 -0.72 0.00 0.00 41.12 41.06 2yux n ASP 28 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 2yux s VAL 29 N -2.00 -0.33 0.06 5.18 0.11 -1.26 0.12 120.40 122.28 2yux s VAL 29 Ca 0.00 0.23 0.05 0.00 -2.93 0.00 0.00 61.98 59.34 2yux s VAL 29 Cb 0.00 -0.46 -0.03 0.00 -1.53 0.00 0.00 36.38 34.37 2yux s VAL 29 CO 0.00 0.10 -0.15 -1.66 -3.33 0.00 0.00 175.10 170.06 2yux s TRP 30 N 2.13 1.29 0.00 1.54 -2.14 0.41 -2.81 118.94 119.35 2yux s TRP 30 Ca -0.02 -0.40 0.00 0.00 2.66 0.00 0.00 56.10 58.34 2yux s TRP 30 Cb -0.11 -0.74 0.00 0.00 -3.10 0.00 0.00 33.47 29.51 2yux s TRP 30 CO -0.09 0.06 0.00 0.41 -2.66 0.00 0.00 176.95 174.67 2yux n GLY 31 N 1.60 1.89 2.27 3.67 0.00 -1.25 0.71 105.19 114.07 2yux n GLY 31 Ca -0.19 0.25 -0.31 0.00 0.00 0.00 0.00 46.02 45.76 2yux n GLY 31 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2yux n GLU 32 N 12.22 3.02 -3.78 1.61 1.02 -1.26 -4.20 120.64 129.27 2yux n GLU 32 Ca 0.00 -3.63 -0.15 0.00 -0.02 0.00 0.00 57.16 53.37 2yux n GLU 32 Cb 0.00 -2.28 -0.16 0.00 -0.02 0.00 0.00 31.44 28.98 2yux n GLU 32 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 2yux s ASN 33 N -2.42 0.05 0.06 1.62 0.01 0.22 -3.44 114.94 111.05 2yux s ASN 33 Ca 0.59 0.04 0.07 0.00 -0.71 0.00 0.00 52.86 52.85 2yux s ASN 33 Cb 0.47 -0.05 -0.03 0.00 0.41 0.00 0.00 41.25 42.04 2yux s ASN 33 CO -0.02 -0.11 -0.16 -0.69 -1.51 0.00 0.00 177.10 174.61 2yux s VAL 34 N 0.91 2.97 -0.21 1.60 1.01 -1.06 -0.45 120.40 125.17 2yux s VAL 34 Ca -0.08 -1.21 -0.03 0.00 0.00 0.00 0.00 61.98 60.67 2yux s VAL 34 Cb -0.11 -2.30 -0.00 0.00 0.00 0.00 0.00 36.38 33.97 2yux s VAL 34 CO -0.03 0.27 -0.07 0.00 0.00 0.00 0.00 175.10 175.27 2yux s ALA 35 N -1.01 2.72 0.10 5.51 0.00 0.33 0.06 121.76 129.47 2yux s ALA 35 Ca 0.16 -1.17 0.03 0.00 0.00 0.00 0.00 51.96 50.98 2yux s ALA 35 Cb -0.11 -1.60 -0.04 0.00 0.00 0.00 0.00 23.12 21.37 2yux s ALA 35 CO 0.07 -0.40 0.11 -0.51 0.00 0.00 0.00 175.76 175.04 2yux s LEU 36 N 1.42 3.88 -0.24 0.00 1.43 -1.24 -0.03 118.68 123.90 2yux s LEU 36 Ca 0.05 -0.00 -0.02 0.00 -1.03 0.00 0.00 54.13 53.13 2yux s LEU 36 Cb -0.14 -2.53 0.13 0.00 0.03 0.00 0.00 46.19 43.68 2yux s LEU 36 CO -0.05 0.15 0.34 0.42 0.23 0.00 0.00 176.35 177.43 2yux s THR 37 N -1.49 -0.52 0.19 5.49 -4.23 0.54 -3.95 115.64 111.67 2yux s THR 37 Ca 0.30 -0.14 0.11 0.00 -1.18 0.00 0.00 61.69 60.78 2yux s THR 37 Cb -0.12 -0.81 -0.04 0.00 1.34 0.00 0.00 72.50 72.86 2yux s THR 37 CO 0.23 -0.19 -0.21 -1.66 -0.54 0.00 0.00 174.62 172.25 2yux s TRP 38 N 2.48 2.37 0.34 3.99 -2.14 -1.22 0.19 118.94 124.94 2yux s TRP 38 Ca 0.11 -0.33 0.02 0.00 2.66 0.00 0.00 56.10 58.55 2yux s TRP 38 Cb -0.15 -1.17 -0.03 0.00 -3.10 0.00 0.00 33.47 29.02 2yux s TRP 38 CO -0.18 0.50 0.52 0.95 -2.66 0.00 0.00 176.95 176.08 2yux s THR 39 N -1.65 4.90 0.89 0.66 -4.23 0.20 -4.82 115.64 111.58 2yux s THR 39 Ca 0.21 -0.62 -0.12 0.00 -1.18 0.00 0.00 61.69 59.98 2yux s THR 39 Cb -0.08 -3.77 0.13 0.00 1.34 0.00 0.00 72.50 70.11 2yux s THR 39 CO 0.11 -0.45 1.13 -2.16 -0.54 0.00 0.00 174.62 172.71 2yux s PRO 40 N -4.27 1.28 0.22 3.99 0.04 -1.26 -3.51 135.00 131.50 2yux s PRO 40 Ca 0.40 0.34 -0.30 0.00 0.04 0.00 0.00 61.00 61.49 2yux s PRO 40 Cb -0.10 -1.85 -0.09 0.00 0.04 0.00 0.00 34.50 32.51 2yux s PRO 40 CO 0.34 -2.11 1.10 -1.25 0.04 0.00 0.00 177.00 175.13 2yux s PRO 41 N -5.26 4.62 0.00 0.56 0.04 -1.26 -3.52 135.00 130.18 2yux s PRO 41 Ca 0.63 1.76 0.13 0.00 0.04 0.00 0.00 61.00 63.56 2yux s PRO 41 Cb -0.15 -3.24 0.54 0.00 0.04 0.00 0.00 34.50 31.69 2yux s PRO 41 CO 0.53 0.14 1.40 1.17 0.04 0.00 0.00 177.00 180.28 2yux n LYS 42 N 1.86 0.01 -4.31 4.56 4.81 -1.26 -4.63 118.16 119.20 2yux n LYS 42 Ca 0.01 0.28 -0.29 0.00 -0.87 0.00 0.00 58.31 57.44 2yux n LYS 42 Cb 0.45 -1.50 -0.11 0.00 0.02 0.00 0.00 35.03 33.89 2yux n LYS 42 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 2yux s ASP 43 N -2.99 3.94 -0.30 3.14 2.15 -1.26 -5.10 116.67 116.25 2yux s ASP 43 Ca 0.06 -0.53 -0.17 0.00 0.43 0.00 0.00 52.55 52.34 2yux s ASP 43 Cb 0.08 -0.58 0.17 0.00 -0.30 0.00 0.00 42.92 42.29 2yux s ASP 43 CO 0.23 0.18 1.19 1.51 -0.17 0.00 0.00 175.17 178.10 2yux s ASP 44 N -2.12 -0.16 0.00 -0.34 -4.77 -1.26 -4.92 116.67 103.09 2yux s ASP 44 Ca 0.18 0.09 0.00 0.00 -3.30 0.00 0.00 52.55 49.52 2yux s ASP 44 Cb -0.11 1.13 0.00 0.00 -1.09 0.00 0.00 42.92 42.86 2yux s ASP 44 CO 0.10 -0.03 0.00 0.61 0.70 0.00 0.00 175.17 176.55 2yux n GLY 45 N 5.43 -0.49 3.38 2.12 0.00 -1.26 -5.02 105.19 109.36 2yux n GLY 45 Ca -0.06 0.06 -0.45 0.00 0.00 0.00 0.00 46.02 45.57 2yux n GLY 45 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2yux s ASN 46 N -2.00 6.17 -0.52 1.61 3.84 -1.26 -4.50 114.94 118.27 2yux s ASN 46 Ca 0.00 -1.36 -0.00 0.00 0.21 0.00 0.00 52.86 51.71 2yux s ASN 46 Cb 0.00 -2.21 -0.00 0.00 -0.55 0.00 0.00 41.25 38.49 2yux s ASN 46 CO 0.00 -0.73 0.49 0.00 -2.79 0.00 0.00 177.10 174.07 2yux n ALA 47 N 5.37 -2.18 -1.48 1.71 0.00 -1.26 -4.74 120.51 117.93 2yux n ALA 47 Ca -0.12 0.00 -0.52 0.00 0.00 0.00 0.00 53.44 52.81 2yux n ALA 47 Cb 0.43 -1.17 -0.05 0.00 0.00 0.00 0.00 19.45 18.67 2yux n ALA 47 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2yux n ALA 48 N -1.58 -2.54 -1.57 0.00 0.00 -1.26 -4.68 120.51 108.88 2yux n ALA 48 Ca -0.00 0.49 -0.48 0.00 0.00 0.00 0.00 53.44 53.46 2yux n ALA 48 Cb 0.50 -1.77 -0.05 0.00 0.00 0.00 0.00 19.45 18.13 2yux n ALA 48 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2yux n ILE 49 N 0.82 0.37 0.23 0.00 -0.00 -1.26 -4.79 119.36 114.73 2yux n ILE 49 Ca 0.18 -0.27 -0.12 0.00 -0.00 0.00 0.00 62.75 62.54 2yux n ILE 49 Cb 0.20 -2.00 -0.06 0.00 -0.00 0.00 0.00 39.64 37.77 2yux n ILE 49 CO 0.00 0.00 0.00 0.71 -0.00 0.00 0.00 176.55 177.26 2yux h THR 50 N 6.55 0.20 -3.14 1.39 1.35 -1.80 -3.49 112.91 113.98 2yux h THR 50 Ca -0.39 -0.54 -0.17 0.00 -0.55 0.00 0.00 66.41 64.76 2yux h THR 50 Cb 1.28 0.30 -0.04 0.00 -1.73 0.00 0.00 68.15 67.96 2yux h THR 50 CO 0.98 0.04 -0.12 0.61 -0.25 0.00 0.00 175.52 176.78 2yux n GLY 51 N -0.07 2.83 3.02 5.82 0.00 -1.24 -4.69 105.19 110.86 2yux n GLY 51 Ca -0.09 -1.57 -0.20 0.00 0.00 0.00 0.00 46.02 44.15 2yux n GLY 51 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2yux s TYR 52 N -3.62 0.99 0.13 1.61 1.51 -1.26 -2.48 117.35 114.23 2yux s TYR 52 Ca 0.16 -0.23 -0.20 0.00 -1.01 0.00 0.00 57.07 55.80 2yux s TYR 52 Cb -0.00 -0.68 -0.07 0.00 -0.11 0.00 0.00 41.96 41.10 2yux s TYR 52 CO 0.12 -0.07 0.63 0.99 -1.11 0.00 0.00 175.55 176.10 2yux s THR 53 N 0.03 4.67 0.00 -0.71 2.01 -1.23 -3.71 115.64 116.70 2yux s THR 53 Ca -0.01 1.25 0.07 0.00 0.31 0.00 0.00 61.69 63.31 2yux s THR 53 Cb -0.07 -3.90 -0.02 0.00 0.01 0.00 0.00 72.50 68.51 2yux s THR 53 CO 0.00 0.44 -0.23 -0.63 -0.69 0.00 0.00 174.62 173.51 2yux s ILE 54 N -1.25 1.80 0.02 1.82 1.09 -1.01 -2.02 121.20 121.64 2yux s ILE 54 Ca 0.34 -1.06 -0.02 0.00 -1.10 0.00 0.00 60.65 58.81 2yux s ILE 54 Cb -0.19 -1.51 -0.01 0.00 -1.06 0.00 0.00 42.46 39.69 2yux s ILE 54 CO 0.21 0.42 0.02 -1.10 -0.10 0.00 0.00 174.94 174.39 2yux s GLN 55 N -0.75 0.38 0.24 2.79 -0.21 -1.21 0.16 119.66 121.06 2yux s GLN 55 Ca 0.09 -0.58 0.11 0.00 0.02 0.00 0.00 55.36 54.99 2yux s GLN 55 Cb -0.09 0.14 -0.05 0.00 1.00 0.00 0.00 33.01 34.02 2yux s GLN 55 CO 0.00 -0.07 -0.19 0.15 -2.12 0.00 0.00 175.29 173.05 2yux s LYS 56 N -1.58 1.55 0.09 2.91 1.02 -1.00 -3.20 119.74 119.53 2yux s LYS 56 Ca -0.14 -1.66 -0.21 0.00 0.02 0.00 0.00 55.97 53.98 2yux s LYS 56 Cb -0.08 -1.61 0.05 0.00 -0.52 0.00 0.00 37.83 35.67 2yux s LYS 56 CO -0.01 0.31 0.51 0.00 -0.92 0.00 0.00 175.35 175.24 2yux s ALA 57 N -2.41 -1.31 0.49 5.17 0.00 -1.05 -1.61 121.76 121.03 2yux s ALA 57 Ca 0.26 0.43 0.09 0.00 0.00 0.00 0.00 51.96 52.73 2yux s ALA 57 Cb -0.05 0.58 0.04 0.00 0.00 0.00 0.00 23.12 23.69 2yux s ALA 57 CO 0.12 -0.60 0.64 -0.51 0.00 0.00 0.00 175.76 175.40 2yux s ASP 58 N -2.36 5.33 -0.21 0.00 1.01 -1.26 -1.25 116.67 117.93 2yux s ASP 58 Ca -0.02 -0.66 0.14 0.00 0.71 0.00 0.00 52.55 52.72 2yux s ASP 58 Cb -0.00 -0.21 0.76 0.00 1.01 0.00 0.00 42.92 44.47 2yux s ASP 58 CO -0.07 -1.00 1.65 1.17 0.21 0.00 0.00 175.17 177.13 2yux n LYS 59 N -1.98 4.51 0.00 8.23 0.00 -1.24 -1.23 118.16 126.44 2yux n LYS 59 Ca 0.10 -2.91 0.00 0.00 0.00 0.00 0.00 58.31 55.51 2yux n LYS 59 Cb 0.61 -2.17 0.00 0.00 0.00 0.00 0.00 35.03 33.46 2yux n LYS 59 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.40 177.76 2yux n LYS 60 N 0.65 1.07 -0.02 1.64 0.00 -1.26 -4.86 118.16 115.39 2yux n LYS 60 Ca 0.26 0.00 -0.02 0.00 -0.00 0.00 0.00 58.31 58.55 2yux n LYS 60 Cb 1.10 -0.89 -0.02 0.00 -0.00 0.00 0.00 35.03 35.22 2yux n LYS 60 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.40 177.83 2yux n SER 61 N -2.07 4.19 -0.84 -5.58 7.64 -1.26 -5.00 113.62 110.71 2yux n SER 61 Ca 0.00 -0.00 -0.11 0.00 1.01 0.00 0.00 58.87 59.77 2yux n SER 61 Cb 0.39 0.51 -0.05 0.00 -1.01 0.00 0.00 64.21 64.05 2yux n SER 61 CO 0.00 0.00 0.00 0.23 -3.01 0.00 0.00 175.04 172.26 2yux n MET 62 N -2.16 -1.47 -1.73 1.43 2.81 -0.37 -4.89 117.12 110.74 2yux n MET 62 Ca -0.05 0.86 -0.42 0.00 -1.81 0.00 0.00 57.70 56.28 2yux n MET 62 Cb 0.60 -5.16 -0.03 0.00 -0.71 0.00 0.00 33.22 27.92 2yux n MET 62 CO 0.00 0.00 0.00 -1.83 1.51 0.00 0.00 175.97 175.65 2yux s GLU 63 N -2.83 4.15 -0.31 0.03 -1.05 -1.26 -4.65 118.70 112.77 2yux s GLU 63 Ca 0.00 2.56 -0.19 0.00 -0.15 0.00 0.00 54.97 57.18 2yux s GLU 63 Cb 0.00 -3.89 -0.01 0.00 -0.44 0.00 0.00 34.13 29.79 2yux s GLU 63 CO 0.00 -0.89 0.59 -1.58 0.95 0.00 0.00 175.26 174.33 2yux s TRP 64 N 3.65 3.21 -0.08 4.83 0.52 -1.25 -3.59 118.94 126.23 2yux s TRP 64 Ca 0.84 0.48 0.03 0.00 0.02 0.00 0.00 56.10 57.47 2yux s TRP 64 Cb -0.43 -2.95 -0.02 0.00 -1.15 0.00 0.00 33.47 28.92 2yux s TRP 64 CO 0.38 -0.47 -0.18 -0.06 0.02 0.00 0.00 176.95 176.64 2yux s PHE 65 N 2.53 2.64 -0.05 -1.98 0.40 -0.63 -4.91 117.98 115.98 2yux s PHE 65 Ca 0.23 -0.54 -0.29 0.00 -0.60 0.00 0.00 56.93 55.73 2yux s PHE 65 Cb -0.15 -1.69 -0.07 0.00 0.51 0.00 0.00 43.02 41.62 2yux s PHE 65 CO 0.12 -0.10 1.97 0.99 0.70 0.00 0.00 175.22 178.90 2yux s THR 66 N -0.15 3.12 -0.19 0.64 2.01 -1.26 -2.39 115.64 117.42 2yux s THR 66 Ca -0.02 0.14 -0.21 0.00 0.31 0.00 0.00 61.69 61.91 2yux s THR 66 Cb -0.14 -3.11 -0.21 0.00 0.01 0.00 0.00 72.50 69.05 2yux s THR 66 CO 0.04 -0.03 0.31 0.58 -0.69 0.00 0.00 174.62 174.82 2yux h VAL 67 N 6.04 1.00 -3.43 3.82 2.07 0.12 -3.48 116.25 122.39 2yux h VAL 67 Ca -0.45 -2.22 -0.04 0.00 0.82 0.00 0.00 66.70 64.80 2yux h VAL 67 Cb 1.23 2.40 -0.11 0.00 -1.52 0.00 0.00 31.29 33.29 2yux h VAL 67 CO 0.95 0.41 -0.06 -0.51 0.02 0.00 0.00 177.57 178.38 2yux s ILE 68 N -2.37 0.04 0.03 4.57 -1.16 -1.16 -4.97 121.20 116.19 2yux s ILE 68 Ca -0.27 -0.84 0.00 0.00 -0.51 0.00 0.00 60.65 59.04 2yux s ILE 68 Cb 0.05 -1.52 -0.02 0.00 0.61 0.00 0.00 42.46 41.57 2yux s ILE 68 CO 0.62 -0.20 -0.04 -1.61 -2.81 0.00 0.00 174.94 170.91 2yux s GLU 69 N -3.87 0.36 -0.93 3.50 2.02 -1.26 -2.41 118.70 116.10 2yux s GLU 69 Ca 0.09 -0.67 -0.10 0.00 0.02 0.00 0.00 54.97 54.31 2yux s GLU 69 Cb 0.00 0.06 0.01 0.00 0.10 0.00 0.00 34.13 34.30 2yux s GLU 69 CO -0.05 -0.04 0.66 0.72 0.02 0.00 0.00 175.26 176.58 2yux n HIS 70 N 1.49 -2.03 -1.82 1.61 8.25 -1.26 -4.91 115.22 116.55 2yux n HIS 70 Ca -0.23 0.68 -0.12 0.00 -0.26 0.00 0.00 57.72 57.79 2yux n HIS 70 Cb 0.55 -3.06 0.07 0.00 1.12 0.00 0.00 29.99 28.68 2yux n HIS 70 CO 0.00 0.00 0.00 0.98 0.64 0.00 0.00 176.34 177.96 2yux n TYR 71 N -3.19 -3.66 0.00 4.41 9.36 -1.24 -4.77 117.16 118.07 2yux n TYR 71 Ca -0.20 -0.62 0.00 0.00 3.32 0.00 0.00 57.90 60.40 2yux n TYR 71 Cb 0.63 -0.39 0.00 0.00 -0.63 0.00 0.00 39.34 38.94 2yux n TYR 71 CO 0.00 0.00 0.00 1.58 0.22 0.00 0.00 176.86 178.66 2yux n HIS 72 N -2.47 0.00 -0.19 2.98 -0.00 -1.26 -3.73 115.22 110.55 2yux n HIS 72 Ca 0.07 0.00 -0.11 0.00 0.46 0.00 0.00 57.72 58.14 2yux n HIS 72 Cb 0.25 0.00 0.10 0.00 -0.12 0.00 0.00 29.99 30.23 2yux n HIS 72 CO 0.00 0.00 0.00 0.54 0.46 0.00 0.00 176.34 177.34 2yux n ARG 73 N -1.91 -2.83 0.00 1.57 3.00 -1.26 -4.91 116.66 110.32 2yux n ARG 73 Ca 0.00 -0.54 0.03 0.00 -0.01 0.00 0.00 57.85 57.33 2yux n ARG 73 Cb 0.00 -0.67 0.00 0.00 0.00 0.00 0.00 32.46 31.80 2yux n ARG 73 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.63 177.88 2yux n THR 74 N -3.91 0.00 -4.82 0.55 -2.24 -1.26 -4.85 114.28 97.76 2yux n THR 74 Ca 0.05 -0.44 -0.27 0.00 -2.27 0.00 0.00 64.05 61.11 2yux n THR 74 Cb 0.21 1.08 -0.15 0.00 -2.10 0.00 0.00 70.33 69.38 2yux n THR 74 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2yux s SER 75 N -0.97 2.69 -0.18 3.42 1.04 -1.26 -3.38 113.70 115.06 2yux s SER 75 Ca 0.05 -0.51 -0.09 0.00 0.48 0.00 0.00 55.95 55.88 2yux s SER 75 Cb 0.05 -0.25 0.06 0.00 0.10 0.00 0.00 66.02 65.99 2yux s SER 75 CO 0.15 0.21 0.43 0.00 0.98 0.00 0.00 173.24 175.01 2yux s ALA 76 N -0.73 -1.13 0.20 5.32 0.00 -1.25 -5.04 121.76 119.12 2yux s ALA 76 Ca 0.09 1.60 -0.30 0.00 0.00 0.00 0.00 51.96 53.35 2yux s ALA 76 Cb -0.09 -1.02 -0.08 0.00 0.00 0.00 0.00 23.12 21.93 2yux s ALA 76 CO 0.01 -0.33 1.04 0.99 0.00 0.00 0.00 175.76 177.47 2yux s THR 77 N 1.57 3.92 0.28 0.00 2.01 -1.26 -3.62 115.64 118.53 2yux s THR 77 Ca -0.09 1.76 0.06 0.00 0.31 0.00 0.00 61.69 63.73 2yux s THR 77 Cb -0.09 -4.12 -0.02 0.00 0.01 0.00 0.00 72.50 68.28 2yux s THR 77 CO -0.13 0.35 0.39 -0.63 -0.69 0.00 0.00 174.62 173.91 2yux s ILE 78 N -0.62 4.77 0.19 1.82 -1.09 0.11 -4.93 121.20 121.46 2yux s ILE 78 Ca 0.46 -1.01 0.04 0.00 -2.23 0.00 0.00 60.65 57.91 2yux s ILE 78 Cb -0.28 -3.67 -0.02 0.00 -1.58 0.00 0.00 42.46 36.91 2yux s ILE 78 CO 0.35 -0.26 0.17 0.35 -1.23 0.00 0.00 174.94 174.31 2yux n THR 79 N -1.49 0.00 -3.28 2.92 -2.24 -1.26 -2.57 114.28 106.36 2yux n THR 79 Ca -0.06 -1.40 -0.14 0.00 -2.27 0.00 0.00 64.05 60.19 2yux n THR 79 Cb 0.57 0.70 0.01 0.00 -2.10 0.00 0.00 70.33 69.52 2yux n THR 79 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 2yux n GLU 80 N -0.37 -1.70 -3.79 -0.78 1.02 -1.22 -4.94 120.64 108.86 2yux n GLU 80 Ca 0.04 1.42 -0.18 0.00 -0.02 0.00 0.00 57.16 58.42 2yux n GLU 80 Cb 0.35 -4.25 -0.17 0.00 -0.02 0.00 0.00 31.44 27.35 2yux n GLU 80 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2yux s LEU 81 N -3.73 0.74 0.35 -4.62 1.43 -1.26 -5.07 118.68 106.53 2yux s LEU 81 Ca 0.11 0.01 -0.25 0.00 -1.03 0.00 0.00 54.13 52.98 2yux s LEU 81 Cb -0.02 -0.19 -0.10 0.00 0.03 0.00 0.00 46.19 45.91 2yux s LEU 81 CO 0.81 -0.17 0.97 0.54 0.23 0.00 0.00 176.35 178.73 2yux s VAL 82 N 1.53 4.13 -0.68 -1.59 0.11 -1.26 -4.46 120.40 118.18 2yux s VAL 82 Ca -0.03 1.67 -0.23 0.00 -2.93 0.00 0.00 61.98 60.46 2yux s VAL 82 Cb -0.13 -3.88 0.07 0.00 -1.53 0.00 0.00 36.38 30.91 2yux s VAL 82 CO -0.03 0.05 1.00 -0.63 -3.33 0.00 0.00 175.10 172.17 2yux s ILE 83 N -1.70 4.29 0.00 7.04 1.01 -1.26 -3.44 121.20 127.13 2yux s ILE 83 Ca 0.53 -0.36 0.00 0.00 0.00 0.00 0.00 60.65 60.82 2yux s ILE 83 Cb -0.18 -4.71 0.00 0.00 0.01 0.00 0.00 42.46 37.58 2yux s ILE 83 CO 0.23 -1.50 0.00 0.61 0.00 0.00 0.00 174.94 174.28 2yux n GLY 84 N 5.36 1.02 3.88 6.18 0.00 -1.15 -5.00 105.19 115.49 2yux n GLY 84 Ca -0.02 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.80 2yux n GLY 84 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2yux s ASN 85 N 0.00 5.43 0.20 1.61 0.01 -1.22 -4.90 114.94 116.06 2yux s ASN 85 Ca 0.00 -0.44 0.09 0.00 -0.71 0.00 0.00 52.86 51.80 2yux s ASN 85 Cb 0.00 -1.02 -0.04 0.00 0.41 0.00 0.00 41.25 40.60 2yux s ASN 85 CO 0.00 -0.38 -0.18 -1.83 -1.51 0.00 0.00 177.10 173.21 2yux s GLU 86 N -4.04 1.37 0.18 -0.60 1.03 -1.26 -2.82 118.70 112.56 2yux s GLU 86 Ca 0.42 -1.53 -0.01 0.00 0.03 0.00 0.00 54.97 53.88 2yux s GLU 86 Cb -0.06 -1.36 -0.04 0.00 -0.80 0.00 0.00 34.13 31.86 2yux s GLU 86 CO 0.28 0.26 0.10 0.71 -1.33 0.00 0.00 175.26 175.27 2yux s TYR 87 N -2.41 1.11 0.25 4.83 1.51 -1.06 -3.68 117.35 117.89 2yux s TYR 87 Ca 0.21 -1.30 0.12 0.00 -1.01 0.00 0.00 57.07 55.09 2yux s TYR 87 Cb -0.04 -0.58 -0.05 0.00 -0.11 0.00 0.00 41.96 41.18 2yux s TYR 87 CO 0.08 -0.55 -0.20 0.71 -1.11 0.00 0.00 175.55 174.49 2yux s TYR 88 N -4.06 2.33 0.02 2.71 2.02 -0.38 -3.04 117.35 116.95 2yux s TYR 88 Ca 0.34 -0.33 0.02 0.00 -0.37 0.00 0.00 57.07 56.73 2yux s TYR 88 Cb 0.07 -1.06 -0.01 0.00 -0.40 0.00 0.00 41.96 40.56 2yux s TYR 88 CO 0.09 0.64 -0.06 -0.06 -1.57 0.00 0.00 175.55 174.58 2yux s PHE 89 N -2.22 0.56 -0.10 2.71 0.08 -1.26 -2.54 117.98 115.21 2yux s PHE 89 Ca 0.27 -0.29 -0.03 0.00 0.12 0.00 0.00 56.93 57.00 2yux s PHE 89 Cb -0.06 -0.35 0.05 0.00 -0.57 0.00 0.00 43.02 42.09 2yux s PHE 89 CO 0.14 -0.04 0.16 1.03 -0.10 0.00 0.00 175.22 176.40 2yux s ARG 90 N -0.83 0.05 -0.12 0.44 0.52 -1.19 -3.18 118.95 114.64 2yux s ARG 90 Ca -0.04 0.49 -0.09 0.00 -0.52 0.00 0.00 55.73 55.58 2yux s ARG 90 Cb -0.06 -0.44 -0.04 0.00 0.52 0.00 0.00 34.95 34.92 2yux s ARG 90 CO 0.00 -0.36 0.18 0.08 0.02 0.00 0.00 175.30 175.22 2yux s VAL 91 N 2.29 5.43 0.48 3.52 1.01 -1.25 -3.33 120.40 128.53 2yux s VAL 91 Ca 0.03 0.30 0.04 0.00 0.00 0.00 0.00 61.98 62.36 2yux s VAL 91 Cb -0.13 -3.46 -0.03 0.00 0.00 0.00 0.00 36.38 32.77 2yux s VAL 91 CO -0.06 0.58 0.09 -0.36 0.00 0.00 0.00 175.10 175.35 2yux s PHE 92 N -0.81 2.10 -0.12 5.22 0.40 -0.86 -3.51 117.98 120.40 2yux s PHE 92 Ca 0.15 -0.82 0.01 0.00 -0.60 0.00 0.00 56.93 55.68 2yux s PHE 92 Cb -0.13 -1.75 -0.01 0.00 0.51 0.00 0.00 43.02 41.64 2yux s PHE 92 CO 0.04 0.17 -0.15 -1.12 0.70 0.00 0.00 175.22 174.86 2yux s SER 93 N -3.90 3.82 0.26 1.36 0.01 -1.26 -3.58 113.70 110.41 2yux s SER 93 Ca 0.22 -0.37 0.11 0.00 1.31 0.00 0.00 55.95 57.22 2yux s SER 93 Cb 0.03 -1.55 -0.05 0.00 0.21 0.00 0.00 66.02 64.66 2yux s SER 93 CO 0.12 0.17 -0.19 -1.61 0.41 0.00 0.00 173.24 172.14 2yux s GLU 94 N 0.33 1.62 0.05 12.44 0.41 -1.04 -2.81 118.70 129.70 2yux s GLU 94 Ca -0.12 -1.73 0.00 0.00 -0.41 0.00 0.00 54.97 52.71 2yux s GLU 94 Cb -0.16 -1.67 0.00 0.00 -1.78 0.00 0.00 34.13 30.51 2yux s GLU 94 CO 0.06 0.31 0.00 0.27 -0.49 0.00 0.00 175.26 175.41 2yux n ASN 95 N -0.55 -0.48 0.07 -0.19 6.94 -1.26 -2.86 115.26 116.94 2yux n ASN 95 Ca -0.06 0.25 0.00 0.00 -0.02 0.00 0.00 54.58 54.76 2yux n ASN 95 Cb 0.60 0.67 0.00 0.00 -2.36 0.00 0.00 39.78 38.69 2yux n ASN 95 CO 0.00 0.00 0.00 0.23 -1.03 0.00 0.00 177.26 176.46 2yux n MET 96 N -2.32 0.00 -0.01 -3.83 2.81 -1.26 -4.76 117.12 107.75 2yux n MET 96 Ca 0.00 0.00 -0.10 0.00 -1.81 0.00 0.00 57.70 55.79 2yux n MET 96 Cb 0.00 0.00 -0.07 0.00 -0.71 0.00 0.00 33.22 32.44 2yux n MET 96 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2yux n GLY 98 N -1.28 -0.53 3.84 0.00 0.00 -1.26 -5.10 105.19 100.85 2yux n GLY 98 Ca -0.04 -0.09 -0.37 0.00 0.00 0.00 0.00 46.02 45.53 2yux n GLY 98 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2yux s LEU 99 N 0.00 4.25 -0.06 0.99 2.01 -1.26 -4.11 118.68 120.51 2yux s LEU 99 Ca 0.00 0.40 -0.34 0.00 0.01 0.00 0.00 54.13 54.20 2yux s LEU 99 Cb 0.00 -2.03 -0.12 0.00 0.01 0.00 0.00 46.19 44.05 2yux s LEU 99 CO 0.00 0.39 1.86 -1.54 1.01 0.00 0.00 176.35 178.06 2yux n SER 100 N 2.12 3.45 -0.33 2.29 3.41 -1.12 -4.82 113.62 118.62 2yux n SER 100 Ca -0.20 0.98 0.09 0.00 -0.26 0.00 0.00 58.87 59.48 2yux n SER 100 Cb 0.55 -1.39 0.19 0.00 -0.26 0.00 0.00 64.21 63.30 2yux n SER 100 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2yux n GLU 101 N 6.35 -0.08 -4.19 4.33 1.02 -1.26 -4.28 120.64 122.53 2yux n GLU 101 Ca 0.22 1.44 -0.30 0.00 -0.02 0.00 0.00 57.16 58.50 2yux n GLU 101 Cb 0.30 -2.21 -0.09 0.00 -0.02 0.00 0.00 31.44 29.42 2yux n GLU 101 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2yux s ASP 102 N -5.16 4.66 -0.01 1.62 1.11 -1.26 -5.13 116.67 112.50 2yux s ASP 102 Ca -0.13 -0.30 0.07 0.00 0.18 0.00 0.00 52.55 52.36 2yux s ASP 102 Cb 0.26 -0.99 -0.02 0.00 1.07 0.00 0.00 42.92 43.25 2yux s ASP 102 CO 0.73 0.18 -0.21 0.00 1.18 0.00 0.00 175.17 177.05 2yux s ALA 103 N -1.25 1.79 -0.65 5.23 0.00 -1.26 -3.95 121.76 121.66 2yux s ALA 103 Ca 0.23 -0.94 -0.26 0.00 0.00 0.00 0.00 51.96 50.99 2yux s ALA 103 Cb -0.11 -0.44 0.04 0.00 0.00 0.00 0.00 23.12 22.60 2yux s ALA 103 CO 0.16 0.43 1.14 0.99 0.00 0.00 0.00 175.76 178.48 2yux s THR 104 N -0.54 4.02 0.23 0.00 2.01 -1.23 -4.91 115.64 115.22 2yux s THR 104 Ca 0.08 0.37 -0.28 0.00 0.31 0.00 0.00 61.69 62.16 2yux s THR 104 Cb -0.08 -4.76 -0.09 0.00 0.01 0.00 0.00 72.50 67.58 2yux s THR 104 CO -0.00 -1.53 0.89 -0.32 -0.69 0.00 0.00 174.62 172.97 2yux s MET 105 N 4.92 4.76 -0.17 4.92 1.75 -1.26 -3.94 119.30 130.28 2yux s MET 105 Ca 0.34 1.38 -0.40 0.00 -1.25 0.00 0.00 55.69 55.76 2yux s MET 105 Cb -0.10 -3.24 -0.17 0.00 2.84 0.00 0.00 34.83 34.16 2yux s MET 105 CO 0.17 0.52 1.52 0.25 -0.65 0.00 0.00 175.02 176.83 2yux n THR 106 N 1.45 0.13 -0.47 10.11 -2.24 -1.19 -4.74 114.28 117.33 2yux n THR 106 Ca -0.03 -0.02 0.39 0.00 -2.27 0.00 0.00 64.05 62.12 2yux n THR 106 Cb 0.48 -0.84 0.67 0.00 -2.10 0.00 0.00 70.33 68.54 2yux n THR 106 CO 0.00 0.00 0.00 0.11 -0.57 0.00 0.00 175.07 174.61 2yux h LYS 107 N 5.57 0.07 -5.36 -0.78 1.79 -1.93 -3.39 116.57 112.54 2yux h LYS 107 Ca -0.47 -0.00 -0.46 0.00 -2.18 0.00 0.00 60.65 57.54 2yux h LYS 107 Cb 1.35 -0.02 -0.14 0.00 -1.58 0.00 0.00 32.23 31.84 2yux h LYS 107 CO 0.87 0.05 -0.66 -1.21 -1.08 0.00 0.00 179.45 177.42 2yux s GLU 108 N -5.24 1.50 0.62 3.15 0.41 -1.26 -5.16 118.70 112.72 2yux s GLU 108 Ca -0.07 -1.76 -0.00 0.00 -0.41 0.00 0.00 54.97 52.72 2yux s GLU 108 Cb 0.29 -0.98 0.06 0.00 -1.78 0.00 0.00 34.13 31.73 2yux s GLU 108 CO 0.83 -0.02 0.87 -1.54 -0.49 0.00 0.00 175.26 174.90 2yux s SER 109 N -3.41 4.94 -0.24 -0.19 1.04 -1.26 -4.96 113.70 109.63 2yux s SER 109 Ca 0.30 -0.08 -0.03 0.00 0.48 0.00 0.00 55.95 56.62 2yux s SER 109 Cb 0.05 -0.62 0.02 0.00 0.10 0.00 0.00 66.02 65.56 2yux s SER 109 CO 0.11 -1.41 -0.05 0.00 0.98 0.00 0.00 173.24 172.88 2yux s ALA 110 N -2.93 2.75 -0.38 5.32 0.00 -1.17 -5.03 121.76 120.33 2yux s ALA 110 Ca 0.60 -1.38 -0.10 0.00 0.00 0.00 0.00 51.96 51.09 2yux s ALA 110 Cb -0.09 -1.72 0.04 0.00 0.00 0.00 0.00 23.12 21.35 2yux s ALA 110 CO 0.41 -0.71 0.20 0.14 0.00 0.00 0.00 175.76 175.80 2yux s VAL 111 N 1.38 4.36 0.00 0.00 -7.23 -1.26 -2.56 120.40 115.10 2yux s VAL 111 Ca 0.02 -1.03 -0.31 0.00 -1.81 0.00 0.00 61.98 58.84 2yux s VAL 111 Cb -0.16 -3.50 -0.10 0.00 0.56 0.00 0.00 36.38 33.18 2yux s VAL 111 CO -0.04 -0.29 1.94 -0.38 -0.31 0.00 0.00 175.10 176.02 2yux n ILE 112 N 4.95 0.70 -0.52 -0.62 2.08 -1.13 -4.79 119.36 120.04 2yux n ILE 112 Ca -0.12 -0.13 0.00 0.00 0.56 0.00 0.00 62.75 63.07 2yux n ILE 112 Cb 0.45 -2.18 0.00 0.00 -0.75 0.00 0.00 39.64 37.16 2yux n ILE 112 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 2yux n ALA 113 N 7.20 1.38 -1.52 -1.39 0.00 -1.26 -2.92 120.51 122.00 2yux n ALA 113 Ca 0.21 -0.56 -0.18 0.00 0.00 0.00 0.00 53.44 52.91 2yux n ALA 113 Cb 0.37 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.75 2yux n ALA 113 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.50 175.37 2yux n ARG 114 N -0.15 -1.49 -3.63 0.00 0.00 -1.26 -4.90 116.66 105.23 2yux n ARG 114 Ca 0.00 1.13 -0.12 0.00 -0.00 0.00 0.00 57.85 58.86 2yux n ARG 114 Cb 0.29 -5.51 -0.07 0.00 0.00 0.00 0.00 32.46 27.17 2yux n ARG 114 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.63 177.97 2yux s ASP 115 N -2.69 -0.76 0.27 6.15 -1.08 -1.26 -3.83 116.67 113.47 2yux s ASP 115 Ca 0.00 1.40 0.11 0.00 -0.52 0.00 0.00 52.55 53.54 2yux s ASP 115 Cb 0.00 1.40 -0.05 0.00 -1.46 0.00 0.00 42.92 42.81 2yux s ASP 115 CO 0.00 -0.24 -0.12 -0.83 0.52 0.00 0.00 175.17 174.50 2yux s GLY 116 N 0.66 1.79 0.46 2.66 0.00 -1.12 -4.76 107.32 107.01 2yux s GLY 116 Ca -0.02 -1.77 0.07 0.00 0.00 0.00 0.00 44.72 43.00 2yux s GLY 116 CO -0.05 -1.85 0.33 0.54 0.00 0.00 0.00 173.10 172.08 2yux s LYS 117 N -3.53 2.34 -0.23 2.90 -0.14 -1.26 -5.03 119.74 114.80 2yux s LYS 117 Ca 0.30 -1.80 -0.01 0.00 -1.36 0.00 0.00 55.97 53.10 2yux s LYS 117 Cb -0.06 -2.16 0.06 0.00 -1.68 0.00 0.00 37.83 33.99 2yux s LYS 117 CO 0.17 -0.32 -0.01 0.42 -0.76 0.00 0.00 175.35 174.84 2yux s ILE 118 N -2.62 1.16 -0.01 2.17 1.01 -1.26 -4.96 121.20 116.68 2yux s ILE 118 Ca 0.41 -1.01 0.04 0.00 0.00 0.00 0.00 60.65 60.08 2yux s ILE 118 Cb -0.01 -1.54 -0.01 0.00 0.01 0.00 0.00 42.46 40.92 2yux s ILE 118 CO 0.24 -0.18 -0.13 -0.47 0.00 0.00 0.00 174.94 174.40 2yux s TYR 119 N 1.56 1.19 -1.48 3.97 6.14 -1.26 -5.30 117.35 122.17 2yux s TYR 119 Ca -0.03 -0.24 0.00 0.00 0.64 0.00 0.00 57.07 57.44 2yux s TYR 119 Cb -0.18 -0.77 0.00 0.00 0.42 0.00 0.00 41.96 41.43 2yux s TYR 119 CO -0.08 -0.03 0.37 1.17 0.64 0.00 0.00 175.55 177.62