#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 -7.91 -4.56 1.61 2.88 -1.26 -4.77 113.62 99.60 2yux n SER 2 Ca 0.00 1.22 -0.39 0.00 -1.33 0.00 0.00 58.87 58.37 2yux n SER 2 Cb 0.00 -5.28 -0.03 0.00 -0.75 0.00 0.00 64.21 58.15 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 -1.82 4.97 0.41 -3.46 1.04 -1.26 -4.50 113.70 109.09 2yux s SER 3 Ca 0.05 1.06 0.00 0.00 0.48 0.00 0.00 55.95 57.54 2yux s SER 3 Cb -0.02 -2.51 0.00 0.00 0.10 0.00 0.00 66.02 63.59 2yux s SER 3 CO 0.77 -2.48 0.00 0.61 0.98 0.00 0.00 173.24 173.12 2yux n GLY 4 N 5.82 1.12 2.96 7.32 0.00 -1.26 -4.89 105.19 116.26 2yux n GLY 4 Ca 0.30 0.32 -0.11 0.00 0.00 0.00 0.00 46.02 46.54 2yux n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2yux n SER 5 N 6.79 -7.44 -4.59 1.61 2.88 -1.26 -4.95 113.62 106.65 2yux n SER 5 Ca 0.00 0.65 -0.39 0.00 -1.33 0.00 0.00 58.87 57.80 2yux n SER 5 Cb 0.00 -4.41 -0.10 0.00 -0.75 0.00 0.00 64.21 58.95 2yux n SER 5 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2yux s SER 6 N -2.01 6.12 0.00 -3.46 0.15 -1.26 -4.74 113.70 108.50 2yux s SER 6 Ca 0.19 0.09 0.00 0.00 0.70 0.00 0.00 55.95 56.93 2yux s SER 6 Cb -0.04 -2.16 0.00 0.00 -1.71 0.00 0.00 66.02 62.11 2yux s SER 6 CO 0.72 -0.12 0.00 0.61 1.20 0.00 0.00 173.24 175.65 2yux n GLY 7 N 4.91 0.93 5.60 9.45 0.00 -1.26 -5.05 105.19 119.76 2yux n GLY 7 Ca -0.12 -0.33 0.00 0.00 0.00 0.00 0.00 46.02 45.57 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 -0.88 0.00 -0.08 4.61 0.00 -1.26 -3.11 120.51 119.80 2yux n ALA 8 Ca 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 53.44 53.35 2yux n ALA 8 Cb 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.41 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 3.53 1.84 -1.83 0.00 7.64 -1.26 -5.09 113.62 118.45 2yux n SER 9 Ca 0.00 0.56 -0.01 0.00 1.01 0.00 0.00 58.87 60.43 2yux n SER 9 Cb 0.00 -0.88 -0.01 0.00 -1.01 0.00 0.00 64.21 62.32 2yux n SER 9 CO 0.00 0.00 0.00 -0.38 -3.01 0.00 0.00 175.04 171.65 2yux n ILE 10 N -4.55 -8.40 -1.23 0.44 5.41 -1.18 -4.91 119.36 104.92 2yux n ILE 10 Ca -0.14 1.72 0.00 0.00 1.00 0.00 0.00 62.75 65.32 2yux n ILE 10 Cb 0.39 -4.84 0.00 0.00 -0.71 0.00 0.00 39.64 34.48 2yux n ILE 10 CO 0.00 0.00 0.00 -0.67 0.00 0.00 0.00 176.55 175.88 2yux n ASP 11 N 1.00 -6.66 -4.57 4.38 2.03 -1.26 -4.51 116.55 106.96 2yux n ASP 11 Ca -0.06 1.45 -0.41 0.00 0.52 0.00 0.00 54.79 56.29 2yux n ASP 11 Cb 0.09 -3.76 -0.02 0.00 -0.72 0.00 0.00 41.12 36.71 2yux n ASP 11 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 2yux s ILE 12 N -5.00 3.99 0.38 5.18 1.01 -1.26 -4.95 121.20 120.54 2yux s ILE 12 Ca 0.00 -1.37 0.04 0.00 0.00 0.00 0.00 60.65 59.32 2yux s ILE 12 Cb 0.00 -5.07 -0.01 0.00 0.01 0.00 0.00 42.46 37.39 2yux s ILE 12 CO 0.00 -1.90 0.55 -1.10 0.00 0.00 0.00 174.94 172.49 2yux s GLN 13 N 4.74 3.13 -0.01 2.79 -0.21 -1.26 -4.74 119.66 124.10 2yux s GLN 13 Ca 0.52 -0.75 -0.00 0.00 0.02 0.00 0.00 55.36 55.15 2yux s GLN 13 Cb 0.02 -2.71 0.00 0.00 1.00 0.00 0.00 33.01 31.32 2yux s GLN 13 CO 0.01 -0.06 0.01 -0.89 -2.12 0.00 0.00 175.29 172.24 2yux n ILE 14 N -1.82 -1.76 -3.42 1.08 5.41 -1.26 -4.88 119.36 112.71 2yux n ILE 14 Ca -0.00 0.43 -0.38 0.00 1.00 0.00 0.00 62.75 63.80 2yux n ILE 14 Cb 0.58 -2.62 -0.06 0.00 -0.71 0.00 0.00 39.64 36.83 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 -0.88 5.12 1.01 1.39 1.01 -1.26 -5.06 121.20 122.54 2yux s ILE 15 Ca 0.00 0.86 -0.18 0.00 0.00 0.00 0.00 60.65 61.34 2yux s ILE 15 Cb -0.00 -3.75 0.04 0.00 0.01 0.00 0.00 42.46 38.76 2yux s ILE 15 CO 0.01 0.44 -0.29 -0.67 0.00 0.00 0.00 174.94 174.43 2yux n ASP 16 N 2.86 -2.69 -4.22 3.58 -0.08 -1.26 -4.46 116.55 110.28 2yux n ASP 16 Ca -0.11 -0.17 -0.36 0.00 -1.51 0.00 0.00 54.79 52.64 2yux n ASP 16 Cb 0.52 -0.75 0.05 0.00 2.34 0.00 0.00 41.12 43.28 2yux n ASP 16 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 2yux n ARG 17 N -0.55 0.03 0.00 -0.67 1.74 -1.26 -4.71 116.66 111.25 2yux n ARG 17 Ca 0.01 0.03 0.00 0.00 -0.77 0.00 0.00 57.85 57.12 2yux n ARG 17 Cb 0.53 -1.30 0.00 0.00 -1.02 0.00 0.00 32.46 30.66 2yux n ARG 17 CO 0.00 0.00 0.00 -0.35 -1.52 0.00 0.00 177.63 175.76 2yux n PRO 18 N 0.96 0.57 -2.26 5.56 -0.04 -1.26 -5.01 135.00 133.52 2yux n PRO 18 Ca 0.04 0.00 -0.03 0.00 -0.04 0.00 0.00 63.50 63.47 2yux n PRO 18 Cb 0.52 0.00 -0.01 0.00 -0.04 0.00 0.00 33.50 33.97 2yux n PRO 18 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2yux n GLY 19 N 3.76 4.10 3.78 0.55 0.00 -1.26 -4.70 105.19 111.41 2yux n GLY 19 Ca 0.00 -2.13 -0.29 0.00 0.00 0.00 0.00 46.02 43.60 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 -2.18 0.48 0.26 1.61 0.04 -1.26 -4.27 135.00 129.69 2yux s PRO 20 Ca 0.01 0.05 -0.30 0.00 0.04 0.00 0.00 61.00 60.80 2yux s PRO 20 Cb 0.00 -1.78 -0.09 0.00 0.04 0.00 0.00 34.50 32.66 2yux s PRO 20 CO 0.01 -2.60 1.09 -1.25 0.04 0.00 0.00 177.00 174.28 2yux s PRO 21 N -5.45 4.65 0.24 0.56 0.04 -1.26 -4.80 135.00 128.98 2yux s PRO 21 Ca 0.68 1.77 -0.10 0.00 0.04 0.00 0.00 61.00 63.39 2yux s PRO 21 Cb -0.11 -3.21 0.36 0.00 0.04 0.00 0.00 34.50 31.58 2yux s PRO 21 CO 0.54 0.22 1.41 1.04 0.04 0.00 0.00 177.00 180.25 2yux n GLN 22 N 1.38 -0.12 -3.54 4.56 6.02 -1.25 -4.66 117.38 119.77 2yux n GLN 22 Ca -0.01 1.40 -0.11 0.00 -0.01 0.00 0.00 57.00 58.28 2yux n GLN 22 Cb 0.45 -2.09 -0.03 0.00 1.02 0.00 0.00 30.24 29.59 2yux n GLN 22 CO 0.00 0.00 0.00 -1.50 -1.01 0.00 0.00 177.06 174.55 2yux s ILE 23 N -6.05 0.02 -0.08 5.09 -1.16 -1.26 -5.00 121.20 112.76 2yux s ILE 23 Ca -0.13 -0.29 -0.02 0.00 -0.51 0.00 0.00 60.65 59.69 2yux s ILE 23 Cb 0.23 -1.18 0.03 0.00 0.61 0.00 0.00 42.46 42.15 2yux s ILE 23 CO 0.69 -0.08 0.03 -0.69 -2.81 0.00 0.00 174.94 172.08 2yux s VAL 24 N -3.79 0.16 0.35 4.00 1.01 -1.26 -1.01 120.40 119.87 2yux s VAL 24 Ca 0.03 0.16 0.04 0.00 0.00 0.00 0.00 61.98 62.21 2yux s VAL 24 Cb -0.01 -0.43 -0.06 0.00 0.00 0.00 0.00 36.38 35.88 2yux s VAL 24 CO -0.10 0.15 0.05 -0.54 0.00 0.00 0.00 175.10 174.66 2yux s LYS 25 N 2.05 1.74 -0.30 2.72 1.02 0.50 -4.29 119.74 123.19 2yux s LYS 25 Ca 0.04 -1.98 -0.02 0.00 0.02 0.00 0.00 55.97 54.03 2yux s LYS 25 Cb -0.13 -1.01 0.05 0.00 -0.52 0.00 0.00 37.83 36.22 2yux s LYS 25 CO -0.05 -0.19 0.00 0.42 -0.92 0.00 0.00 175.35 174.61 2yux s ILE 26 N -3.17 2.99 0.30 2.17 1.01 -1.26 0.21 121.20 123.44 2yux s ILE 26 Ca 0.34 -1.39 0.05 0.00 0.00 0.00 0.00 60.65 59.65 2yux s ILE 26 Cb 0.08 -2.72 0.30 0.00 0.01 0.00 0.00 42.46 40.13 2yux s ILE 26 CO 0.16 -0.11 1.67 -0.33 0.00 0.00 0.00 174.94 176.32 2yux h GLU 27 N 8.00 0.31 0.00 2.79 4.39 0.19 -3.46 114.58 126.79 2yux h GLU 27 Ca -0.21 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.47 2yux h GLU 27 Cb 1.06 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.64 2yux h GLU 27 CO 0.53 0.21 0.00 -0.25 -1.16 0.00 0.00 179.01 178.34 2yux n ASP 28 N -5.11 0.00 -3.68 1.42 9.92 -1.11 -4.98 116.55 113.01 2yux n ASP 28 Ca 0.24 0.00 -0.13 0.00 -0.53 0.00 0.00 54.79 54.37 2yux n ASP 28 Cb 0.73 0.00 -0.13 0.00 -0.64 0.00 0.00 41.12 41.08 2yux n ASP 28 CO 0.00 0.00 0.00 0.54 0.13 0.00 0.00 177.20 177.87 2yux s VAL 29 N -2.00 -0.33 0.11 2.53 0.11 -1.26 0.13 120.40 119.68 2yux s VAL 29 Ca 0.00 0.24 0.03 0.00 -2.93 0.00 0.00 61.98 59.32 2yux s VAL 29 Cb 0.00 -0.45 -0.04 0.00 -1.53 0.00 0.00 36.38 34.36 2yux s VAL 29 CO 0.00 0.10 -0.09 -1.66 -3.33 0.00 0.00 175.10 170.12 2yux s TRP 30 N 2.13 1.02 0.00 1.54 -2.14 -0.70 -4.74 118.94 116.06 2yux s TRP 30 Ca -0.02 -0.77 0.00 0.00 2.66 0.00 0.00 56.10 57.97 2yux s TRP 30 Cb -0.11 -0.56 0.00 0.00 -3.10 0.00 0.00 33.47 29.70 2yux s TRP 30 CO -0.09 -0.04 0.00 0.41 -2.66 0.00 0.00 176.95 174.57 2yux n GLY 31 N 0.20 2.04 2.28 3.67 0.00 -1.21 -0.28 105.19 111.88 2yux n GLY 31 Ca -0.14 0.25 -0.29 0.00 0.00 0.00 0.00 46.02 45.84 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 13.02 3.29 -3.91 1.61 1.02 -1.26 -4.29 120.64 130.12 2yux n GLU 32 Ca 0.00 -3.99 -0.11 0.00 -0.02 0.00 0.00 57.16 53.04 2yux n GLU 32 Cb 0.00 -2.27 -0.11 0.00 -0.02 0.00 0.00 31.44 29.03 2yux n GLU 32 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 2yux s ASN 33 N -2.95 0.08 -0.03 1.62 2.20 0.62 -3.54 114.94 112.94 2yux s ASN 33 Ca 0.53 -0.21 0.06 0.00 -0.94 0.00 0.00 52.86 52.30 2yux s ASN 33 Cb 0.43 0.15 -0.01 0.00 -2.00 0.00 0.00 41.25 39.81 2yux s ASN 33 CO -0.07 -0.24 -0.22 -0.69 -2.94 0.00 0.00 177.10 172.95 2yux s VAL 34 N -0.97 1.76 -0.29 3.54 1.01 -1.08 -1.71 120.40 122.65 2yux s VAL 34 Ca -0.11 -0.94 -0.09 0.00 0.00 0.00 0.00 61.98 60.84 2yux s VAL 34 Cb -0.06 -1.47 -0.02 0.00 0.00 0.00 0.00 36.38 34.83 2yux s VAL 34 CO 0.00 0.50 0.13 0.00 0.00 0.00 0.00 175.10 175.72 2yux s ALA 35 N -0.41 3.25 0.12 5.51 0.00 0.34 -1.00 121.76 129.58 2yux s ALA 35 Ca 0.05 -1.28 0.03 0.00 0.00 0.00 0.00 51.96 50.76 2yux s ALA 35 Cb -0.10 -2.28 -0.04 0.00 0.00 0.00 0.00 23.12 20.70 2yux s ALA 35 CO 0.00 -0.74 0.16 -0.51 0.00 0.00 0.00 175.76 174.68 2yux s LEU 36 N 1.62 4.01 -0.24 0.00 1.43 -1.22 0.82 118.68 125.11 2yux s LEU 36 Ca 0.05 0.04 -0.03 0.00 -1.03 0.00 0.00 54.13 53.16 2yux s LEU 36 Cb -0.16 -2.64 0.12 0.00 0.03 0.00 0.00 46.19 43.55 2yux s LEU 36 CO 0.06 0.11 0.34 0.42 0.23 0.00 0.00 176.35 177.51 2yux s THR 37 N -1.60 -0.54 0.09 5.49 -4.23 0.56 -3.95 115.64 111.47 2yux s THR 37 Ca 0.32 -0.09 0.09 0.00 -1.18 0.00 0.00 61.69 60.83 2yux s THR 37 Cb -0.11 -0.79 -0.04 0.00 1.34 0.00 0.00 72.50 72.90 2yux s THR 37 CO 0.25 -0.15 -0.22 -1.66 -0.54 0.00 0.00 174.62 172.30 2yux s TRP 38 N 2.49 2.43 0.42 3.99 -2.14 -1.09 0.19 118.94 125.23 2yux s TRP 38 Ca 0.11 -0.32 -0.02 0.00 2.66 0.00 0.00 56.10 58.53 2yux s TRP 38 Cb -0.15 -1.35 -0.03 0.00 -3.10 0.00 0.00 33.47 28.84 2yux s TRP 38 CO -0.15 0.30 0.66 0.95 -2.66 0.00 0.00 176.95 176.05 2yux s THR 39 N -1.02 4.82 0.63 0.66 -4.23 -0.18 -4.82 115.64 111.50 2yux s THR 39 Ca 0.15 -0.21 -0.14 0.00 -1.18 0.00 0.00 61.69 60.31 2yux s THR 39 Cb -0.10 -3.79 -0.02 0.00 1.34 0.00 0.00 72.50 69.92 2yux s THR 39 CO 0.06 -0.63 1.05 -2.16 -0.54 0.00 0.00 174.62 172.41 2yux s PRO 40 N -4.53 3.21 0.57 3.99 0.04 -1.26 -3.77 135.00 133.25 2yux s PRO 40 Ca 0.44 1.08 -0.16 0.00 0.04 0.00 0.00 61.00 62.40 2yux s PRO 40 Cb -0.10 -2.02 -0.05 0.00 0.04 0.00 0.00 34.50 32.37 2yux s PRO 40 CO 0.40 -0.89 1.05 -1.25 0.04 0.00 0.00 177.00 176.35 2yux s PRO 41 N -4.48 3.46 -0.08 0.56 0.04 -1.26 -4.02 135.00 129.23 2yux s PRO 41 Ca 0.61 1.19 0.15 0.00 0.04 0.00 0.00 61.00 62.99 2yux s PRO 41 Cb -0.15 -2.05 -0.23 0.00 0.04 0.00 0.00 34.50 32.11 2yux s PRO 41 CO 0.44 -0.69 0.49 1.63 0.04 0.00 0.00 177.00 178.91 2yux n LYS 42 N -1.85 0.65 -3.61 4.56 4.76 -1.26 -4.55 118.16 116.86 2yux n LYS 42 Ca 0.08 0.18 -0.36 0.00 -2.87 0.00 0.00 58.31 55.34 2yux n LYS 42 Cb 0.53 -1.70 -0.06 0.00 -1.84 0.00 0.00 35.03 31.96 2yux n LYS 42 CO 0.00 0.00 0.00 -0.40 -1.37 0.00 0.00 177.40 175.63 2yux n ASP 43 N -2.91 4.27 -0.33 4.39 5.68 -1.26 -4.90 116.55 121.49 2yux n ASP 43 Ca -0.21 -3.16 0.24 0.00 -0.50 0.00 0.00 54.79 51.16 2yux n ASP 43 Cb 1.04 -1.04 0.45 0.00 -1.14 0.00 0.00 41.12 40.43 2yux n ASP 43 CO 0.00 0.00 0.00 -2.24 -1.33 0.00 0.00 177.20 173.63 2yux h ASP 44 N 5.87 -0.01 0.00 -1.12 3.04 -2.01 -3.42 116.42 118.77 2yux h ASP 44 Ca 0.17 0.26 0.00 0.00 -3.24 0.00 0.00 57.03 54.22 2yux h ASP 44 Cb 0.79 0.35 0.00 0.00 -1.04 0.00 0.00 39.33 39.44 2yux h ASP 44 CO 0.88 -0.37 0.00 0.61 -2.04 0.00 0.00 179.24 178.31 2yux n GLY 45 N -1.36 0.87 1.33 7.15 0.00 -1.26 -4.36 105.19 107.55 2yux n GLY 45 Ca 0.31 -0.72 -0.00 0.00 0.00 0.00 0.00 46.02 45.60 2yux n GLY 45 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2yux n ASN 46 N 1.87 -0.17 -0.14 1.61 2.85 -1.26 -4.50 115.26 115.52 2yux n ASN 46 Ca 0.00 -0.89 0.00 0.00 -0.11 0.00 0.00 54.58 53.58 2yux n ASN 46 Cb 0.00 0.07 0.00 0.00 1.24 0.00 0.00 39.78 41.10 2yux n ASN 46 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2yux n ALA 47 N -0.14 1.37 -1.42 5.20 0.00 -1.26 -4.77 120.51 119.50 2yux n ALA 47 Ca -0.03 -0.73 -0.15 0.00 0.00 0.00 0.00 53.44 52.54 2yux n ALA 47 Cb 0.48 -0.14 -0.06 0.00 0.00 0.00 0.00 19.45 19.72 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 -0.07 -0.22 -3.07 0.00 0.00 -1.26 -2.94 120.51 112.95 2yux n ALA 48 Ca 0.00 0.23 -0.14 0.00 0.00 0.00 0.00 53.44 53.54 2yux n ALA 48 Cb 0.54 -1.52 0.01 0.00 0.00 0.00 0.00 19.45 18.48 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 -1.97 -7.73 0.03 0.00 2.08 -1.26 -4.87 119.36 105.64 2yux n ILE 49 Ca -0.15 0.80 -0.13 0.00 0.56 0.00 0.00 62.75 63.83 2yux n ILE 49 Cb 0.48 -5.43 -0.08 0.00 -0.75 0.00 0.00 39.64 33.85 2yux n ILE 49 CO 0.00 0.00 0.00 0.74 0.56 0.00 0.00 176.55 177.85 2yux h THR 50 N 2.52 0.00 -0.47 1.39 2.02 -1.42 -3.48 112.91 113.46 2yux h THR 50 Ca -0.16 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.02 2yux h THR 50 Cb 0.91 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.32 2yux h THR 50 CO 0.15 0.00 0.00 0.61 0.37 0.00 0.00 175.52 176.65 2yux n GLY 51 N -1.38 2.37 3.00 2.16 0.00 -1.24 -4.87 105.19 105.23 2yux n GLY 51 Ca -0.06 -0.61 -0.10 0.00 0.00 0.00 0.00 46.02 45.25 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 -2.16 0.37 -0.05 1.61 2.02 -1.20 -1.44 117.35 116.49 2yux s TYR 52 Ca 0.00 -0.54 0.01 0.00 -0.37 0.00 0.00 57.07 56.18 2yux s TYR 52 Cb 0.00 -0.25 -0.03 0.00 -0.40 0.00 0.00 41.96 41.28 2yux s TYR 52 CO 0.00 -0.17 -0.07 0.99 -1.57 0.00 0.00 175.55 174.73 2yux s THR 53 N -1.51 3.69 0.08 -0.71 2.01 0.20 -1.38 115.64 118.03 2yux s THR 53 Ca -0.14 -0.54 0.08 0.00 0.31 0.00 0.00 61.69 61.40 2yux s THR 53 Cb -0.10 -2.53 -0.04 0.00 0.01 0.00 0.00 72.50 69.85 2yux s THR 53 CO -0.01 0.56 -0.17 -0.63 -0.69 0.00 0.00 174.62 173.67 2yux s ILE 54 N -0.85 2.87 -0.13 1.82 1.09 -1.17 -0.41 121.20 124.42 2yux s ILE 54 Ca 0.13 -1.35 -0.08 0.00 -1.10 0.00 0.00 60.65 58.26 2yux s ILE 54 Cb -0.11 -2.27 0.05 0.00 -1.06 0.00 0.00 42.46 39.06 2yux s ILE 54 CO 0.03 0.20 0.31 -1.10 -0.10 0.00 0.00 174.94 174.28 2yux s GLN 55 N -1.85 0.30 0.17 2.79 -0.21 -1.04 -1.11 119.66 118.71 2yux s GLN 55 Ca 0.17 0.59 0.07 0.00 0.02 0.00 0.00 55.36 56.21 2yux s GLN 55 Cb -0.11 -0.02 -0.04 0.00 1.00 0.00 0.00 33.01 33.84 2yux s GLN 55 CO 0.08 -0.13 -0.01 -1.59 -2.12 0.00 0.00 175.29 171.52 2yux s LYS 56 N 1.06 2.39 0.21 2.91 -2.85 -1.23 -2.15 119.74 120.07 2yux s LYS 56 Ca -0.07 -1.11 -0.11 0.00 -1.00 0.00 0.00 55.97 53.67 2yux s LYS 56 Cb -0.08 -2.35 -0.01 0.00 -2.06 0.00 0.00 37.83 33.34 2yux s LYS 56 CO -0.08 0.45 0.39 0.00 0.10 0.00 0.00 175.35 176.22 2yux s ALA 57 N -1.72 -0.10 0.44 0.59 0.00 -1.06 -1.69 121.76 118.22 2yux s ALA 57 Ca 0.27 -0.90 0.03 0.00 0.00 0.00 0.00 51.96 51.36 2yux s ALA 57 Cb -0.09 1.03 -0.03 0.00 0.00 0.00 0.00 23.12 24.02 2yux s ALA 57 CO 0.18 -0.77 0.06 0.34 0.00 0.00 0.00 175.76 175.57 2yux s ASP 58 N -3.01 3.39 -0.11 0.00 -1.08 -1.25 -1.56 116.67 113.05 2yux s ASP 58 Ca 0.21 -1.60 0.08 0.00 -0.52 0.00 0.00 52.55 50.72 2yux s ASP 58 Cb 0.01 0.35 0.43 0.00 -1.46 0.00 0.00 42.92 42.25 2yux s ASP 58 CO 0.06 -0.81 1.18 0.29 0.52 0.00 0.00 175.17 176.41 2yux n LYS 59 N -1.03 2.96 -0.07 4.34 4.76 -1.25 -2.37 118.16 125.50 2yux n LYS 59 Ca -0.11 -1.65 -0.11 0.00 -2.87 0.00 0.00 58.31 53.57 2yux n LYS 59 Cb 0.66 -1.84 -0.10 0.00 -1.84 0.00 0.00 35.03 31.91 2yux n LYS 59 CO 0.00 0.00 0.00 0.87 -1.37 0.00 0.00 177.40 176.90 2yux h LYS 60 N 2.15 0.00 0.00 1.97 1.79 -1.95 -3.43 116.57 117.10 2yux h LYS 60 Ca 0.00 0.00 -0.07 0.00 -2.18 0.00 0.00 60.65 58.40 2yux h LYS 60 Cb 1.21 0.00 -0.09 0.00 -1.58 0.00 0.00 32.23 31.77 2yux h LYS 60 CO 0.23 0.76 -0.27 0.43 -1.08 0.00 0.00 179.45 179.52 2yux n SER 61 N -4.65 -0.26 -3.54 0.86 7.64 -1.26 -4.99 113.62 107.42 2yux n SER 61 Ca -0.08 -1.59 -0.26 0.00 1.01 0.00 0.00 58.87 57.95 2yux n SER 61 Cb 0.37 0.06 0.00 0.00 -1.01 0.00 0.00 64.21 63.63 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 0.05 -4.02 -2.52 1.43 2.81 -1.00 -4.89 117.12 108.98 2yux n MET 62 Ca -0.10 0.54 -0.42 0.00 -1.81 0.00 0.00 57.70 55.91 2yux n MET 62 Cb 0.67 -5.31 -0.03 0.00 -0.71 0.00 0.00 33.22 27.83 2yux n MET 62 CO 0.00 0.00 0.00 -1.21 1.51 0.00 0.00 175.97 176.27 2yux s GLU 63 N -6.22 4.50 -0.17 0.03 2.02 -1.26 -4.87 118.70 112.74 2yux s GLU 63 Ca 0.49 1.66 -0.07 0.00 0.02 0.00 0.00 54.97 57.07 2yux s GLU 63 Cb -0.25 -3.36 -0.04 0.00 0.10 0.00 0.00 34.13 30.57 2yux s GLU 63 CO 0.60 -0.13 0.06 -1.58 0.02 0.00 0.00 175.26 174.24 2yux s TRP 64 N 0.77 3.26 -0.25 1.61 0.52 -1.26 -3.81 118.94 119.77 2yux s TRP 64 Ca 0.55 0.09 0.01 0.00 0.02 0.00 0.00 56.10 56.77 2yux s TRP 64 Cb -0.27 -2.05 0.07 0.00 -1.15 0.00 0.00 33.47 30.07 2yux s TRP 64 CO 0.30 0.19 -0.02 -0.06 0.02 0.00 0.00 176.95 177.39 2yux s PHE 65 N 0.23 2.37 -0.47 -1.98 0.40 -0.68 -4.97 117.98 112.87 2yux s PHE 65 Ca 0.04 -1.83 -0.42 0.00 -0.60 0.00 0.00 56.93 54.11 2yux s PHE 65 Cb -0.12 -1.71 -0.18 0.00 0.51 0.00 0.00 43.02 41.52 2yux s PHE 65 CO 0.00 -0.80 1.86 2.41 0.70 0.00 0.00 175.22 179.40 2yux n THR 66 N 4.67 0.00 0.05 0.64 -1.04 -1.26 -3.56 114.28 113.78 2yux n THR 66 Ca -0.09 0.00 -0.22 0.00 -2.04 0.00 0.00 64.05 61.70 2yux n THR 66 Cb 0.44 -0.47 -0.14 0.00 -1.82 0.00 0.00 70.33 68.33 2yux n THR 66 CO 0.00 0.00 0.00 0.58 -0.64 0.00 0.00 175.07 175.01 2yux h VAL 67 N 6.02 1.15 -3.04 12.58 2.07 -1.48 -3.49 116.25 130.06 2yux h VAL 67 Ca -0.19 -2.49 0.04 0.00 0.82 0.00 0.00 66.70 64.87 2yux h VAL 67 Cb 1.33 2.87 -0.07 0.00 -1.52 0.00 0.00 31.29 33.90 2yux h VAL 67 CO 1.00 0.75 0.20 -0.51 0.02 0.00 0.00 177.57 179.03 2yux s ILE 68 N -2.50 0.00 0.01 4.57 -1.16 -1.19 -4.99 121.20 115.94 2yux s ILE 68 Ca -0.16 -0.77 0.00 0.00 -0.51 0.00 0.00 60.65 59.21 2yux s ILE 68 Cb 0.04 -1.75 -0.01 0.00 0.61 0.00 0.00 42.46 41.35 2yux s ILE 68 CO 0.82 -0.01 -0.02 -1.61 -2.81 0.00 0.00 174.94 171.31 2yux s GLU 69 N -3.88 0.23 -0.88 3.50 0.41 -1.26 -3.07 118.70 113.75 2yux s GLU 69 Ca 0.09 -0.42 -0.06 0.00 -0.41 0.00 0.00 54.97 54.17 2yux s GLU 69 Cb -0.04 0.04 0.00 0.00 -1.78 0.00 0.00 34.13 32.35 2yux s GLU 69 CO 0.02 -0.03 0.67 0.72 -0.49 0.00 0.00 175.26 176.15 2yux n HIS 70 N 2.08 -2.25 -2.53 1.61 8.25 -1.23 -4.97 115.22 116.19 2yux n HIS 70 Ca -0.20 0.81 -0.24 0.00 -0.26 0.00 0.00 57.72 57.83 2yux n HIS 70 Cb 0.57 -3.27 0.12 0.00 1.12 0.00 0.00 29.99 28.52 2yux n HIS 70 CO 0.00 0.00 0.00 -0.47 0.64 0.00 0.00 176.34 176.51 2yux s TYR 71 N -3.11 1.56 0.01 4.41 5.04 -0.48 -4.78 117.35 120.00 2yux s TYR 71 Ca 0.11 -0.24 -0.01 0.00 -2.44 0.00 0.00 57.07 54.50 2yux s TYR 71 Cb -0.05 -3.08 -0.00 0.00 0.35 0.00 0.00 41.96 39.18 2yux s TYR 71 CO 0.85 -1.80 -0.02 1.58 -1.34 0.00 0.00 175.55 174.83 2yux n HIS 72 N -2.92 0.00 -0.48 4.97 -0.00 -1.26 -3.27 115.22 112.26 2yux n HIS 72 Ca 0.15 0.00 -0.29 0.00 0.46 0.00 0.00 57.72 58.04 2yux n HIS 72 Cb 0.60 -0.03 0.24 0.00 -0.12 0.00 0.00 29.99 30.69 2yux n HIS 72 CO 0.00 0.00 0.00 -2.13 0.46 0.00 0.00 176.34 174.67 2yux n ARG 73 N -2.76 -2.72 -0.20 1.57 0.63 -1.26 -4.86 116.66 107.06 2yux n ARG 73 Ca -0.01 -0.78 0.06 0.00 -0.92 0.00 0.00 57.85 56.20 2yux n ARG 73 Cb 0.03 -1.96 0.16 0.00 0.45 0.00 0.00 32.46 31.14 2yux n ARG 73 CO 0.00 0.00 0.00 0.25 -2.51 0.00 0.00 177.63 175.37 2yux n THR 74 N -4.99 1.08 -3.91 5.15 -2.24 -1.26 -4.86 114.28 103.24 2yux n THR 74 Ca 0.03 -1.05 -0.11 0.00 -2.27 0.00 0.00 64.05 60.66 2yux n THR 74 Cb 0.56 0.46 -0.13 0.00 -2.10 0.00 0.00 70.33 69.12 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 -1.05 0.09 -0.18 3.42 1.04 -1.26 -2.69 113.70 113.08 2yux s SER 75 Ca 0.25 -0.20 -0.13 0.00 0.48 0.00 0.00 55.95 56.35 2yux s SER 75 Cb 0.14 0.06 0.05 0.00 0.10 0.00 0.00 66.02 66.36 2yux s SER 75 CO 0.16 -0.13 0.45 0.00 0.98 0.00 0.00 173.24 174.70 2yux s ALA 76 N -0.63 -1.15 -0.08 5.32 0.00 -1.25 -5.03 121.76 118.93 2yux s ALA 76 Ca -0.07 1.47 -0.21 0.00 0.00 0.00 0.00 51.96 53.15 2yux s ALA 76 Cb -0.04 -0.88 -0.04 0.00 0.00 0.00 0.00 23.12 22.16 2yux s ALA 76 CO -0.00 -0.25 0.61 0.99 0.00 0.00 0.00 175.76 177.11 2yux s THR 77 N 0.84 5.10 0.44 0.00 2.01 -1.26 -3.40 115.64 119.37 2yux s THR 77 Ca -0.05 1.25 -0.01 0.00 0.31 0.00 0.00 61.69 63.20 2yux s THR 77 Cb -0.06 -3.95 -0.01 0.00 0.01 0.00 0.00 72.50 68.49 2yux s THR 77 CO -0.07 0.28 0.68 -0.63 -0.69 0.00 0.00 174.62 174.19 2yux s ILE 78 N 0.71 4.38 0.14 1.82 -1.09 -0.17 -4.89 121.20 122.11 2yux s ILE 78 Ca 0.33 -0.34 0.02 0.00 -2.23 0.00 0.00 60.65 58.43 2yux s ILE 78 Cb -0.17 -3.63 -0.01 0.00 -1.58 0.00 0.00 42.46 37.07 2yux s ILE 78 CO 0.15 -0.48 0.09 1.07 -1.23 0.00 0.00 174.94 174.54 2yux n THR 79 N -2.07 0.00 -3.55 2.92 5.66 -1.26 -2.63 114.28 113.34 2yux n THR 79 Ca -0.00 -0.94 -0.21 0.00 -3.05 0.00 0.00 64.05 59.85 2yux n THR 79 Cb 0.57 0.41 0.05 0.00 -1.55 0.00 0.00 70.33 69.81 2yux n THR 79 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 2yux n GLU 80 N -0.29 -3.80 -5.07 1.09 1.02 -1.23 -4.94 120.64 107.42 2yux n GLU 80 Ca 0.01 0.68 -0.32 0.00 -0.02 0.00 0.00 57.16 57.50 2yux n GLU 80 Cb 0.24 -5.22 -0.16 0.00 -0.02 0.00 0.00 31.44 26.28 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 -6.29 2.33 0.02 -4.62 1.43 -1.23 -5.08 118.68 105.24 2yux s LEU 81 Ca 0.20 -0.44 -0.15 0.00 -1.03 0.00 0.00 54.13 52.71 2yux s LEU 81 Cb -0.05 -1.47 -0.06 0.00 0.03 0.00 0.00 46.19 44.64 2yux s LEU 81 CO 0.79 0.21 0.43 0.54 0.23 0.00 0.00 176.35 178.55 2yux s VAL 82 N 0.08 5.00 -0.72 -1.59 0.11 -1.26 -4.48 120.40 117.55 2yux s VAL 82 Ca -0.09 0.86 -0.26 0.00 -2.93 0.00 0.00 61.98 59.55 2yux s VAL 82 Cb -0.15 -3.73 0.04 0.00 -1.53 0.00 0.00 36.38 31.00 2yux s VAL 82 CO 0.06 0.55 1.22 -0.63 -3.33 0.00 0.00 175.10 172.97 2yux s ILE 83 N -1.11 3.83 0.00 7.04 1.01 -1.26 -3.19 121.20 127.52 2yux s ILE 83 Ca 0.25 0.33 0.00 0.00 0.00 0.00 0.00 60.65 61.23 2yux s ILE 83 Cb -0.17 -4.87 0.00 0.00 0.01 0.00 0.00 42.46 37.43 2yux s ILE 83 CO 0.14 -1.76 0.00 0.61 0.00 0.00 0.00 174.94 173.94 2yux n GLY 84 N 5.35 2.51 3.95 6.18 0.00 -1.23 -4.93 105.19 117.02 2yux n GLY 84 Ca 0.02 -0.27 -0.23 0.00 0.00 0.00 0.00 46.02 45.54 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 6.25 0.38 1.61 0.01 -1.19 -4.89 114.94 117.11 2yux s ASN 85 Ca 0.00 0.35 0.08 0.00 -0.71 0.00 0.00 52.86 52.58 2yux s ASN 85 Cb 0.00 -1.93 -0.02 0.00 0.41 0.00 0.00 41.25 39.71 2yux s ASN 85 CO 0.00 -0.30 0.38 -1.61 -1.51 0.00 0.00 177.10 174.06 2yux s GLU 86 N -4.28 2.69 -0.01 -0.60 2.02 -1.26 -3.33 118.70 113.93 2yux s GLU 86 Ca 0.40 -1.36 -0.19 0.00 0.02 0.00 0.00 54.97 53.84 2yux s GLU 86 Cb -0.10 -2.50 0.04 0.00 0.10 0.00 0.00 34.13 31.67 2yux s GLU 86 CO 0.35 -0.07 0.41 0.71 0.02 0.00 0.00 175.26 176.67 2yux s TYR 87 N -2.37 -0.29 0.53 1.61 2.02 -1.15 -3.78 117.35 113.92 2yux s TYR 87 Ca 0.46 0.43 0.05 0.00 -0.37 0.00 0.00 57.07 57.64 2yux s TYR 87 Cb -0.06 0.18 0.03 0.00 -0.40 0.00 0.00 41.96 41.72 2yux s TYR 87 CO 0.28 -0.47 0.38 0.71 -1.57 0.00 0.00 175.55 174.88 2yux s TYR 88 N -1.55 1.71 0.07 2.71 2.02 -0.60 -1.80 117.35 119.91 2yux s TYR 88 Ca -0.11 -0.82 -0.26 0.00 -0.37 0.00 0.00 57.07 55.50 2yux s TYR 88 Cb -0.03 -1.92 0.07 0.00 -0.40 0.00 0.00 41.96 39.68 2yux s TYR 88 CO 0.04 -0.42 0.64 -0.06 -1.57 0.00 0.00 175.55 174.18 2yux s PHE 89 N -2.76 -0.59 -0.25 2.71 0.08 -1.26 -2.57 117.98 113.35 2yux s PHE 89 Ca 0.34 0.66 -0.11 0.00 0.12 0.00 0.00 56.93 57.93 2yux s PHE 89 Cb -0.02 0.50 0.09 0.00 -0.57 0.00 0.00 43.02 43.02 2yux s PHE 89 CO 0.21 -0.74 0.58 1.03 -0.10 0.00 0.00 175.22 176.19 2yux s ARG 90 N -2.68 0.54 -0.19 0.44 0.52 -0.92 -3.51 118.95 113.15 2yux s ARG 90 Ca -0.04 1.17 -0.09 0.00 -0.52 0.00 0.00 55.73 56.26 2yux s ARG 90 Cb -0.01 0.35 -0.05 0.00 0.52 0.00 0.00 34.95 35.77 2yux s ARG 90 CO -0.03 -0.18 0.10 0.08 0.02 0.00 0.00 175.30 175.28 2yux s VAL 91 N 2.11 5.10 -0.13 3.52 1.01 -1.26 -2.50 120.40 128.26 2yux s VAL 91 Ca -0.07 0.08 0.01 0.00 0.00 0.00 0.00 61.98 62.00 2yux s VAL 91 Cb -0.09 -3.32 -0.01 0.00 0.00 0.00 0.00 36.38 32.97 2yux s VAL 91 CO -0.17 0.44 -0.17 -0.36 0.00 0.00 0.00 175.10 174.84 2yux s PHE 92 N 0.43 2.73 0.54 5.22 0.40 0.46 -3.95 117.98 123.80 2yux s PHE 92 Ca 0.06 -0.85 -0.20 0.00 -0.60 0.00 0.00 56.93 55.34 2yux s PHE 92 Cb -0.12 -1.81 -0.06 0.00 0.51 0.00 0.00 43.02 41.54 2yux s PHE 92 CO -0.01 -0.33 1.16 -1.12 0.70 0.00 0.00 175.22 175.62 2yux s SER 93 N 0.45 5.70 0.24 1.36 0.01 -1.26 0.61 113.70 120.80 2yux s SER 93 Ca -0.12 2.25 0.04 0.00 1.31 0.00 0.00 55.95 59.43 2yux s SER 93 Cb -0.16 -2.59 -0.05 0.00 0.21 0.00 0.00 66.02 63.42 2yux s SER 93 CO 0.05 -1.24 -0.01 -1.61 0.41 0.00 0.00 173.24 170.84 2yux s GLU 94 N -3.18 1.37 0.14 12.44 0.41 -0.52 -2.83 118.70 126.52 2yux s GLU 94 Ca 0.72 -1.69 0.00 0.00 -0.41 0.00 0.00 54.97 53.59 2yux s GLU 94 Cb -0.26 -0.70 0.00 0.00 -1.78 0.00 0.00 34.13 31.39 2yux s GLU 94 CO 0.30 -0.07 0.00 0.27 -0.49 0.00 0.00 175.26 175.26 2yux n ASN 95 N -0.44 -1.23 0.00 -0.19 6.94 -1.26 -2.98 115.26 116.10 2yux n ASN 95 Ca -0.05 0.27 0.00 0.00 -0.02 0.00 0.00 54.58 54.77 2yux n ASN 95 Cb 0.64 1.49 0.00 0.00 -2.36 0.00 0.00 39.78 39.55 2yux n ASN 95 CO 0.00 0.00 0.00 1.15 -1.03 0.00 0.00 177.26 177.38 2yux n MET 96 N -2.78 0.00 0.24 -3.83 0.00 -1.26 -4.44 117.12 105.05 2yux n MET 96 Ca 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 57.70 57.55 2yux n MET 96 Cb 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 33.22 33.14 2yux n MET 96 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2yux n GLY 98 N -1.36 -0.84 3.97 0.00 0.00 -1.26 -5.16 105.19 100.55 2yux n GLY 98 Ca -0.11 -0.16 -0.23 0.00 0.00 0.00 0.00 46.02 45.52 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 3.11 0.02 0.99 2.01 -1.26 -4.10 118.68 119.44 2yux s LEU 99 Ca 0.00 -0.03 -0.30 0.00 0.01 0.00 0.00 54.13 53.82 2yux s LEU 99 Cb 0.00 -2.66 -0.04 0.00 0.01 0.00 0.00 46.19 43.50 2yux s LEU 99 CO 0.00 -1.44 0.96 -0.94 1.01 0.00 0.00 176.35 175.94 2yux s SER 100 N -4.53 7.37 0.29 2.29 1.04 -1.13 -4.93 113.70 114.11 2yux s SER 100 Ca 0.60 1.66 0.05 0.00 0.48 0.00 0.00 55.95 58.74 2yux s SER 100 Cb -0.09 -2.56 0.75 0.00 0.10 0.00 0.00 66.02 64.21 2yux s SER 100 CO 0.41 -0.21 1.71 -0.08 0.98 0.00 0.00 173.24 176.05 2yux h GLU 101 N 6.54 0.43 -6.48 4.02 4.22 -1.94 -3.40 114.58 117.98 2yux h GLU 101 Ca -0.41 -0.03 -0.62 0.00 0.08 0.00 0.00 59.36 58.38 2yux h GLU 101 Cb 1.22 -0.10 -0.20 0.00 0.50 0.00 0.00 28.75 30.17 2yux h GLU 101 CO 0.74 0.29 -0.83 0.16 -2.18 0.00 0.00 179.01 177.19 2yux s ASP 102 N -5.20 3.12 0.04 1.04 1.47 -1.26 -5.13 116.67 110.75 2yux s ASP 102 Ca -0.11 -0.81 0.05 0.00 1.18 0.00 0.00 52.55 52.86 2yux s ASP 102 Cb 0.25 -0.21 -0.02 0.00 -0.34 0.00 0.00 42.92 42.60 2yux s ASP 102 CO 0.78 0.10 -0.15 0.00 0.68 0.00 0.00 175.17 176.58 2yux s ALA 103 N -1.52 1.23 -0.48 2.11 0.00 -1.26 -4.03 121.76 117.81 2yux s ALA 103 Ca 0.16 -0.86 -0.18 0.00 0.00 0.00 0.00 51.96 51.08 2yux s ALA 103 Cb -0.08 -0.19 0.05 0.00 0.00 0.00 0.00 23.12 22.90 2yux s ALA 103 CO 0.07 0.23 0.55 0.99 0.00 0.00 0.00 175.76 177.61 2yux s THR 104 N -0.87 4.98 0.20 0.00 2.01 -1.25 -4.98 115.64 115.72 2yux s THR 104 Ca 0.02 -0.54 -0.14 0.00 0.31 0.00 0.00 61.69 61.33 2yux s THR 104 Cb -0.08 -4.21 -0.08 0.00 0.01 0.00 0.00 72.50 68.14 2yux s THR 104 CO 0.01 -0.68 0.61 -0.32 -0.69 0.00 0.00 174.62 173.55 2yux s MET 105 N 2.36 4.00 -0.04 4.92 1.75 -1.26 -4.00 119.30 127.03 2yux s MET 105 Ca 0.13 0.55 -0.36 0.00 -1.25 0.00 0.00 55.69 54.76 2yux s MET 105 Cb -0.19 -2.79 -0.14 0.00 2.84 0.00 0.00 34.83 34.55 2yux s MET 105 CO 0.12 0.38 1.68 0.25 -0.65 0.00 0.00 175.02 176.80 2yux n THR 106 N 0.42 0.28 -0.67 10.11 -2.24 -1.23 -4.75 114.28 116.20 2yux n THR 106 Ca -0.02 -0.05 0.51 0.00 -2.27 0.00 0.00 64.05 62.22 2yux n THR 106 Cb 0.52 -1.47 0.81 0.00 -2.10 0.00 0.00 70.33 68.09 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 7.17 0.00 -4.31 -0.78 1.79 -1.95 -3.39 116.57 115.09 2yux h LYS 107 Ca -0.47 0.00 -0.16 0.00 -2.18 0.00 0.00 60.65 57.84 2yux h LYS 107 Cb 1.29 0.00 -0.15 0.00 -1.58 0.00 0.00 32.23 31.79 2yux h LYS 107 CO 0.91 0.00 -0.61 -1.21 -1.08 0.00 0.00 179.45 177.45 2yux s GLU 108 N -4.86 0.88 0.77 3.15 2.02 -1.26 -5.17 118.70 114.23 2yux s GLU 108 Ca -0.05 -1.35 -0.08 0.00 0.02 0.00 0.00 54.97 53.51 2yux s GLU 108 Cb 0.26 0.25 0.10 0.00 0.10 0.00 0.00 34.13 34.85 2yux s GLU 108 CO 0.88 -0.25 1.08 -1.54 0.02 0.00 0.00 175.26 175.46 2yux s SER 109 N -3.01 4.35 -0.28 -0.19 1.04 -1.26 -4.94 113.70 109.41 2yux s SER 109 Ca 0.19 0.28 -0.08 0.00 0.48 0.00 0.00 55.95 56.83 2yux s SER 109 Cb 0.07 -0.75 -0.01 0.00 0.10 0.00 0.00 66.02 65.43 2yux s SER 109 CO -0.01 -1.90 0.09 0.00 0.98 0.00 0.00 173.24 172.40 2yux s ALA 110 N -3.38 3.15 -0.30 5.32 0.00 -0.75 -4.96 121.76 120.84 2yux s ALA 110 Ca 0.64 -1.33 -0.23 0.00 0.00 0.00 0.00 51.96 51.05 2yux s ALA 110 Cb -0.08 -2.18 -0.00 0.00 0.00 0.00 0.00 23.12 20.85 2yux s ALA 110 CO 0.47 -0.77 0.76 0.08 0.00 0.00 0.00 175.76 176.30 2yux s VAL 111 N 1.57 4.82 0.41 0.00 1.01 -1.26 -2.95 120.40 123.99 2yux s VAL 111 Ca 0.04 1.14 -0.25 0.00 0.00 0.00 0.00 61.98 62.92 2yux s VAL 111 Cb -0.16 -4.12 -0.08 0.00 0.00 0.00 0.00 36.38 32.01 2yux s VAL 111 CO 0.04 -0.23 1.15 -0.63 0.00 0.00 0.00 175.10 175.43 2yux s ILE 112 N 2.89 3.24 -0.24 2.22 -1.09 -1.21 -4.93 121.20 122.09 2yux s ILE 112 Ca 0.31 1.01 -0.32 0.00 -2.23 0.00 0.00 60.65 59.43 2yux s ILE 112 Cb -0.14 -3.55 0.16 0.00 -1.58 0.00 0.00 42.46 37.35 2yux s ILE 112 CO 0.12 0.07 1.25 0.00 -1.23 0.00 0.00 174.94 175.15 2yux s ALA 113 N -1.47 -2.08 -0.61 9.38 0.00 -1.26 -3.50 121.76 122.22 2yux s ALA 113 Ca 0.58 1.76 -0.11 0.00 0.00 0.00 0.00 51.96 54.19 2yux s ALA 113 Cb -0.29 -0.92 0.16 0.00 0.00 0.00 0.00 23.12 22.07 2yux s ALA 113 CO 0.36 -0.37 0.51 -0.98 0.00 0.00 0.00 175.76 175.28 2yux s ARG 114 N -1.48 2.90 0.02 0.00 1.70 -1.26 -3.30 118.95 117.53 2yux s ARG 114 Ca 0.07 -2.08 -0.29 0.00 -0.47 0.00 0.00 55.73 52.96 2yux s ARG 114 Cb -0.01 -4.11 0.11 0.00 -0.57 0.00 0.00 34.95 30.37 2yux s ARG 114 CO -0.05 -1.24 1.19 0.34 -1.08 0.00 0.00 175.30 174.46 2yux s ASP 115 N 2.37 -0.10 0.00 -2.89 2.15 -1.26 -5.01 116.67 111.93 2yux s ASP 115 Ca 0.10 -0.19 0.00 0.00 0.43 0.00 0.00 52.55 52.89 2yux s ASP 115 Cb -0.21 0.25 0.00 0.00 -0.30 0.00 0.00 42.92 42.65 2yux s ASP 115 CO -0.03 -0.45 0.00 0.61 -0.17 0.00 0.00 175.17 175.13 2yux n GLY 116 N -0.46 1.68 3.19 2.66 0.00 -1.26 -4.83 105.19 106.16 2yux n GLY 116 Ca -0.07 -1.87 -0.18 0.00 0.00 0.00 0.00 46.02 43.90 2yux n GLY 116 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2yux s LYS 117 N 3.14 0.86 0.00 1.61 -2.85 -1.26 -5.08 119.74 116.16 2yux s LYS 117 Ca 0.00 -1.04 0.00 0.00 -1.00 0.00 0.00 55.97 53.93 2yux s LYS 117 Cb 0.00 -0.79 0.00 0.00 -2.06 0.00 0.00 37.83 34.98 2yux s LYS 117 CO 0.00 0.16 0.00 1.51 0.10 0.00 0.00 175.35 177.12 2yux n ILE 118 N 1.01 -0.49 -0.90 3.79 3.06 -1.26 -4.86 119.36 119.71 2yux n ILE 118 Ca -0.19 0.00 0.08 0.00 -2.50 0.00 0.00 62.75 60.14 2yux n ILE 118 Cb 0.55 0.00 0.30 0.00 0.54 0.00 0.00 39.64 41.03 2yux n ILE 118 CO 0.00 0.00 0.00 -1.22 -2.50 0.00 0.00 176.55 172.83 2yux n TYR 119 N 0.10 1.27 0.36 9.51 4.01 -1.26 -5.26 117.16 125.89 2yux n TYR 119 Ca 0.00 -0.80 0.04 0.00 -0.16 0.00 0.00 57.90 56.99 2yux n TYR 119 Cb 0.00 -0.35 0.04 0.00 -0.31 0.00 0.00 39.34 38.72 2yux n TYR 119 CO 0.00 0.00 0.00 1.17 -0.46 0.00 0.00 176.86 177.57