#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yux s SER 2 N 0.00 -0.48 0.00 1.61 0.01 -1.26 -5.18 113.70 108.41 2yux s SER 2 Ca 0.00 0.03 0.00 0.00 1.31 0.00 0.00 55.95 57.29 2yux s SER 2 Cb 0.00 0.54 0.00 0.00 0.21 0.00 0.00 66.02 66.77 2yux s SER 2 CO 0.00 -0.86 0.00 -0.24 0.41 0.00 0.00 173.24 172.55 2yux n SER 3 N -0.07 0.00 0.00 2.44 2.88 -1.26 -5.13 113.62 112.48 2yux n SER 3 Ca -0.17 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.37 2yux n SER 3 Cb 0.63 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.09 2yux n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2yux n GLY 4 N -0.04 0.04 1.49 0.46 0.00 -1.26 -5.17 105.19 100.72 2yux n GLY 4 Ca 0.00 0.08 0.03 0.00 0.00 0.00 0.00 46.02 46.13 2yux n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2yux n SER 5 N -0.26 -8.04 -3.60 1.61 7.64 -1.26 -5.08 113.62 104.62 2yux n SER 5 Ca 0.00 1.74 -0.05 0.00 1.01 0.00 0.00 58.87 61.57 2yux n SER 5 Cb 0.00 -4.85 -0.03 0.00 -1.01 0.00 0.00 64.21 58.32 2yux n SER 5 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 2yux s SER 6 N -5.65 -0.15 0.00 6.43 0.15 -1.26 -5.18 113.70 108.04 2yux s SER 6 Ca 0.00 0.09 0.00 0.00 0.70 0.00 0.00 55.95 56.74 2yux s SER 6 Cb 0.00 0.14 0.00 0.00 -1.71 0.00 0.00 66.02 64.45 2yux s SER 6 CO 0.00 -0.20 0.00 0.61 1.20 0.00 0.00 173.24 174.85 2yux n GLY 7 N 0.24 1.30 2.19 9.45 0.00 -1.26 -5.06 105.19 112.06 2yux n GLY 7 Ca -0.02 -1.59 -0.22 0.00 0.00 0.00 0.00 46.02 44.19 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 -3.00 2.30 0.00 4.61 0.00 -1.26 -5.07 120.51 118.09 2yux n ALA 8 Ca 0.00 -3.41 0.00 0.00 0.00 0.00 0.00 53.44 50.03 2yux n ALA 8 Cb 0.00 -0.85 0.00 0.00 0.00 0.00 0.00 19.45 18.60 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 1.02 0.00 -3.68 0.00 7.64 -1.26 -5.16 113.62 112.17 2yux n SER 9 Ca 0.22 0.00 -0.10 0.00 1.01 0.00 0.00 58.87 60.01 2yux n SER 9 Cb 0.57 0.00 -0.10 0.00 -1.01 0.00 0.00 64.21 63.67 2yux n SER 9 CO 0.00 0.00 0.00 -0.51 -3.01 0.00 0.00 175.04 171.52 2yux s ILE 10 N -1.57 -0.19 0.00 0.44 -1.16 -1.26 -5.08 121.20 112.38 2yux s ILE 10 Ca 0.00 0.11 0.00 0.00 -0.51 0.00 0.00 60.65 60.25 2yux s ILE 10 Cb 0.00 -0.63 0.00 0.00 0.61 0.00 0.00 42.46 42.44 2yux s ILE 10 CO 0.00 0.05 0.00 -0.67 -2.81 0.00 0.00 174.94 171.51 2yux n ASP 11 N 4.57 0.00 -4.57 4.50 2.03 -1.26 -5.08 116.55 116.74 2yux n ASP 11 Ca -0.19 0.00 -0.35 0.00 0.52 0.00 0.00 54.79 54.77 2yux n ASP 11 Cb 0.54 0.00 -0.03 0.00 -0.72 0.00 0.00 41.12 40.90 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 0.00 3.79 -0.35 5.18 1.01 -1.26 -4.64 121.20 124.93 2yux s ILE 12 Ca 0.00 -1.21 0.13 0.00 0.00 0.00 0.00 60.65 59.57 2yux s ILE 12 Cb 0.00 -4.80 0.45 0.00 0.01 0.00 0.00 42.46 38.12 2yux s ILE 12 CO 0.00 -1.49 1.06 1.67 0.00 0.00 0.00 174.94 176.18 2yux n GLN 13 N 8.47 2.38 -3.25 2.79 7.27 -1.26 -4.93 117.38 128.85 2yux n GLN 13 Ca 0.44 -3.86 -0.13 0.00 0.07 0.00 0.00 57.00 53.52 2yux n GLN 13 Cb 0.47 -1.80 -0.05 0.00 2.41 0.00 0.00 30.24 31.27 2yux n GLN 13 CO 0.00 0.00 0.00 0.42 0.07 0.00 0.00 177.06 177.55 2yux s ILE 14 N -4.28 -0.48 0.09 1.69 1.01 -1.26 -5.13 121.20 112.84 2yux s ILE 14 Ca 0.38 -0.99 -0.29 0.00 0.00 0.00 0.00 60.65 59.74 2yux s ILE 14 Cb 0.41 -0.51 -0.05 0.00 0.01 0.00 0.00 42.46 42.32 2yux s ILE 14 CO -0.05 -0.46 0.94 0.27 0.00 0.00 0.00 174.94 175.63 2yux s ILE 15 N 1.26 4.58 0.00 2.92 -4.36 -1.26 -4.63 121.20 119.71 2yux s ILE 15 Ca 0.20 2.01 0.00 0.00 -0.26 0.00 0.00 60.65 62.60 2yux s ILE 15 Cb -0.09 -4.29 0.00 0.00 1.25 0.00 0.00 42.46 39.33 2yux s ILE 15 CO -0.05 0.30 0.00 -0.90 0.24 0.00 0.00 174.94 174.53 2yux n ASP 16 N 2.94 0.00 -4.77 4.36 5.75 -1.26 -5.15 116.55 118.42 2yux n ASP 16 Ca 0.02 0.00 -0.39 0.00 -0.01 0.00 0.00 54.79 54.41 2yux n ASP 16 Cb 0.50 0.00 -0.04 0.00 -1.03 0.00 0.00 41.12 40.55 2yux n ASP 16 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 2yux s ARG 17 N -1.99 4.37 0.02 0.11 0.52 -1.26 -4.86 118.95 115.86 2yux s ARG 17 Ca 0.00 1.72 -0.30 0.00 -0.52 0.00 0.00 55.73 56.62 2yux s ARG 17 Cb 0.00 -2.87 -0.05 0.00 0.52 0.00 0.00 34.95 32.55 2yux s ARG 17 CO 0.00 -0.01 1.18 -1.25 0.02 0.00 0.00 175.30 175.24 2yux s PRO 18 N -1.96 4.42 0.00 3.54 0.04 -1.26 -5.03 135.00 134.74 2yux s PRO 18 Ca 0.51 1.72 0.00 0.00 0.04 0.00 0.00 61.00 63.27 2yux s PRO 18 Cb -0.28 -3.42 0.00 0.00 0.04 0.00 0.00 34.50 30.84 2yux s PRO 18 CO 0.36 -0.30 0.00 0.41 0.04 0.00 0.00 177.00 177.51 2yux n GLY 19 N 3.24 -2.72 3.78 0.56 0.00 -1.26 -4.66 105.19 104.12 2yux n GLY 19 Ca 0.09 -0.91 -0.29 0.00 0.00 0.00 0.00 46.02 44.91 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 -1.05 0.50 0.49 1.61 0.04 -1.26 -4.58 135.00 130.75 2yux s PRO 20 Ca 0.00 0.05 -0.20 0.00 0.04 0.00 0.00 61.00 60.89 2yux s PRO 20 Cb 0.00 -1.79 -0.08 0.00 0.04 0.00 0.00 34.50 32.67 2yux s PRO 20 CO 0.00 -2.59 1.04 -1.25 0.04 0.00 0.00 177.00 174.24 2yux s PRO 21 N -5.45 3.78 0.26 0.56 0.04 -1.26 -4.74 135.00 128.19 2yux s PRO 21 Ca 0.68 1.35 -0.03 0.00 0.04 0.00 0.00 61.00 63.03 2yux s PRO 21 Cb -0.11 -2.09 0.55 0.00 0.04 0.00 0.00 34.50 32.89 2yux s PRO 21 CO 0.54 -0.45 1.63 1.96 0.04 0.00 0.00 177.00 180.73 2yux h GLN 22 N 1.51 0.13 -2.37 4.56 4.20 -1.56 -3.44 115.11 118.13 2yux h GLN 22 Ca -0.49 -0.01 0.12 0.00 0.06 0.00 0.00 58.65 58.33 2yux h GLN 22 Cb 1.22 -0.03 -0.12 0.00 0.30 0.00 0.00 27.48 28.85 2yux h GLN 22 CO 0.59 0.09 0.46 -1.50 -0.67 0.00 0.00 178.83 177.80 2yux s ILE 23 N -6.05 0.00 -0.12 2.54 -1.16 -1.26 -4.95 121.20 110.20 2yux s ILE 23 Ca -0.13 -0.24 -0.03 0.00 -0.51 0.00 0.00 60.65 59.74 2yux s ILE 23 Cb 0.24 -1.34 0.05 0.00 0.61 0.00 0.00 42.46 42.01 2yux s ILE 23 CO 0.76 0.00 0.07 -0.69 -2.81 0.00 0.00 174.94 172.27 2yux s VAL 24 N -3.24 0.00 0.41 4.00 1.01 -1.26 -0.52 120.40 120.79 2yux s VAL 24 Ca 0.07 0.04 0.04 0.00 0.00 0.00 0.00 61.98 62.13 2yux s VAL 24 Cb -0.01 -0.46 -0.05 0.00 0.00 0.00 0.00 36.38 35.86 2yux s VAL 24 CO -0.05 -0.06 0.05 -0.54 0.00 0.00 0.00 175.10 174.49 2yux s LYS 25 N 2.11 1.92 -0.35 2.72 1.02 0.54 -3.31 119.74 124.39 2yux s LYS 25 Ca 0.03 -2.14 0.02 0.00 0.02 0.00 0.00 55.97 53.90 2yux s LYS 25 Cb -0.14 -1.19 0.10 0.00 -0.52 0.00 0.00 37.83 36.08 2yux s LYS 25 CO -0.06 -0.25 0.07 0.42 -0.92 0.00 0.00 175.35 174.61 2yux s ILE 26 N -3.02 2.59 0.34 2.17 1.01 -1.26 0.20 121.20 123.22 2yux s ILE 26 Ca 0.26 -2.14 0.16 0.00 0.00 0.00 0.00 60.65 58.93 2yux s ILE 26 Cb 0.06 -2.81 0.35 0.00 0.01 0.00 0.00 42.46 40.07 2yux s ILE 26 CO 0.13 -0.54 1.49 -0.62 0.00 0.00 0.00 174.94 175.40 2yux n GLU 27 N 4.38 -0.06 0.00 2.79 -0.58 0.12 -4.79 120.64 122.50 2yux n GLU 27 Ca -0.00 1.33 0.00 0.00 -0.42 0.00 0.00 57.16 58.06 2yux n GLU 27 Cb 0.42 -2.31 0.00 0.00 -0.57 0.00 0.00 31.44 28.97 2yux n GLU 27 CO 0.00 0.00 0.00 -0.25 -0.48 0.00 0.00 177.13 176.40 2yux n ASP 28 N -5.19 0.00 -3.68 1.62 9.92 -1.13 -4.98 116.55 113.11 2yux n ASP 28 Ca 0.33 0.00 -0.13 0.00 -0.53 0.00 0.00 54.79 54.46 2yux n ASP 28 Cb 1.10 0.00 -0.13 0.00 -0.64 0.00 0.00 41.12 41.45 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 -0.32 0.06 2.53 0.11 -1.26 0.15 120.40 119.68 2yux s VAL 29 Ca 0.00 0.24 0.04 0.00 -2.93 0.00 0.00 61.98 59.33 2yux s VAL 29 Cb 0.00 -0.45 -0.03 0.00 -1.53 0.00 0.00 36.38 34.38 2yux s VAL 29 CO 0.00 0.10 -0.12 -1.66 -3.33 0.00 0.00 175.10 170.08 2yux s TRP 30 N 2.11 1.07 0.00 1.54 -2.14 0.02 -4.83 118.94 116.69 2yux s TRP 30 Ca -0.02 -0.48 0.00 0.00 2.66 0.00 0.00 56.10 58.26 2yux s TRP 30 Cb -0.11 -0.61 0.00 0.00 -3.10 0.00 0.00 33.47 29.65 2yux s TRP 30 CO -0.09 0.02 0.00 0.41 -2.66 0.00 0.00 176.95 174.63 2yux n GLY 31 N 1.30 1.99 1.54 3.67 0.00 -1.20 0.51 105.19 113.00 2yux n GLY 31 Ca -0.21 0.32 -0.13 0.00 0.00 0.00 0.00 46.02 45.99 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 13.34 2.30 -3.97 1.61 1.02 -1.26 -4.06 120.64 129.61 2yux n GLU 32 Ca 0.00 -3.39 -0.22 0.00 -0.02 0.00 0.00 57.16 53.53 2yux n GLU 32 Cb 0.00 -1.98 -0.17 0.00 -0.02 0.00 0.00 31.44 29.27 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 -2.60 1.41 0.09 1.62 0.01 0.18 -3.61 114.94 112.05 2yux s ASN 33 Ca 0.49 -0.14 0.03 0.00 -0.71 0.00 0.00 52.86 52.53 2yux s ASN 33 Cb 0.43 -0.51 -0.04 0.00 0.41 0.00 0.00 41.25 41.54 2yux s ASN 33 CO 0.01 -0.12 0.11 -0.69 -1.51 0.00 0.00 177.10 174.90 2yux s VAL 34 N 1.47 4.63 -0.19 1.60 1.01 -1.03 -0.80 120.40 127.08 2yux s VAL 34 Ca -0.02 -0.78 -0.01 0.00 0.00 0.00 0.00 61.98 61.17 2yux s VAL 34 Cb -0.13 -3.26 0.01 0.00 0.00 0.00 0.00 36.38 32.99 2yux s VAL 34 CO -0.03 0.08 -0.14 0.00 0.00 0.00 0.00 175.10 175.01 2yux s ALA 35 N -1.48 2.52 0.11 5.51 0.00 0.41 -0.76 121.76 128.07 2yux s ALA 35 Ca 0.30 -1.19 0.04 0.00 0.00 0.00 0.00 51.96 51.11 2yux s ALA 35 Cb -0.12 -1.38 -0.04 0.00 0.00 0.00 0.00 23.12 21.59 2yux s ALA 35 CO 0.23 -0.36 0.10 -0.51 0.00 0.00 0.00 175.76 175.22 2yux s LEU 36 N 1.33 3.79 -0.25 0.00 1.43 -1.11 0.13 118.68 123.99 2yux s LEU 36 Ca 0.05 -0.07 -0.02 0.00 -1.03 0.00 0.00 54.13 53.06 2yux s LEU 36 Cb -0.14 -2.44 0.13 0.00 0.03 0.00 0.00 46.19 43.77 2yux s LEU 36 CO -0.08 0.13 0.33 0.42 0.23 0.00 0.00 176.35 177.38 2yux s THR 37 N -1.53 -0.51 0.25 5.49 -4.23 0.52 -3.78 115.64 111.85 2yux s THR 37 Ca 0.30 -0.19 0.10 0.00 -1.18 0.00 0.00 61.69 60.72 2yux s THR 37 Cb -0.11 -0.84 -0.05 0.00 1.34 0.00 0.00 72.50 72.84 2yux s THR 37 CO 0.22 -0.23 -0.11 -1.66 -0.54 0.00 0.00 174.62 172.31 2yux s TRP 38 N 2.46 2.51 0.19 3.99 -2.14 -1.17 0.20 118.94 124.98 2yux s TRP 38 Ca 0.10 -0.27 0.06 0.00 2.66 0.00 0.00 56.10 58.66 2yux s TRP 38 Cb -0.15 -1.13 -0.04 0.00 -3.10 0.00 0.00 33.47 29.05 2yux s TRP 38 CO -0.20 0.63 0.10 0.95 -2.66 0.00 0.00 176.95 175.76 2yux s THR 39 N -2.24 4.19 0.77 0.66 -4.23 0.32 -4.83 115.64 110.28 2yux s THR 39 Ca 0.29 -1.29 -0.11 0.00 -1.18 0.00 0.00 61.69 59.40 2yux s THR 39 Cb -0.06 -3.15 0.06 0.00 1.34 0.00 0.00 72.50 70.68 2yux s THR 39 CO 0.17 -0.16 1.09 -2.16 -0.54 0.00 0.00 174.62 173.01 2yux s PRO 40 N -3.20 2.28 0.51 3.99 0.04 -1.26 -2.75 135.00 134.61 2yux s PRO 40 Ca 0.30 0.71 -0.19 0.00 0.04 0.00 0.00 61.00 61.86 2yux s PRO 40 Cb -0.09 -1.93 -0.07 0.00 0.04 0.00 0.00 34.50 32.44 2yux s PRO 40 CO 0.22 -1.50 1.04 -1.25 0.04 0.00 0.00 177.00 175.55 2yux s PRO 41 N -5.13 3.68 0.00 0.56 0.04 -1.26 -3.54 135.00 129.34 2yux s PRO 41 Ca 0.60 1.30 0.29 0.00 0.04 0.00 0.00 61.00 63.23 2yux s PRO 41 Cb -0.14 -2.08 1.46 0.00 0.04 0.00 0.00 34.50 33.77 2yux s PRO 41 CO 0.54 -0.52 1.99 1.63 0.04 0.00 0.00 177.00 180.69 2yux n LYS 42 N -1.27 0.42 -5.19 4.56 5.02 -1.26 -4.69 118.16 115.75 2yux n LYS 42 Ca 0.09 0.01 -0.32 0.00 -2.02 0.00 0.00 58.31 56.08 2yux n LYS 42 Cb 0.53 -1.50 -0.16 0.00 -0.02 0.00 0.00 35.03 33.88 2yux n LYS 42 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2yux s ASP 43 N -2.56 3.26 -0.39 4.39 2.15 -1.26 -5.03 116.67 117.23 2yux s ASP 43 Ca 0.28 -0.46 0.00 0.00 0.43 0.00 0.00 52.55 52.80 2yux s ASP 43 Cb 0.19 -0.87 0.26 0.00 -0.30 0.00 0.00 42.92 42.20 2yux s ASP 43 CO 0.43 0.26 1.10 -0.90 -0.17 0.00 0.00 175.17 175.89 2yux n ASP 44 N 2.88 -1.89 -0.01 -0.34 5.75 -1.26 -4.90 116.55 116.78 2yux n ASP 44 Ca -0.17 -2.26 -0.01 0.00 -0.01 0.00 0.00 54.79 52.34 2yux n ASP 44 Cb 0.52 1.10 -0.00 0.00 -1.03 0.00 0.00 41.12 41.71 2yux n ASP 44 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2yux n GLY 45 N 1.67 -0.02 3.15 6.12 0.00 -1.26 -4.89 105.19 109.95 2yux n GLY 45 Ca 0.05 -0.01 -0.31 0.00 0.00 0.00 0.00 46.02 45.75 2yux n GLY 45 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2yux s ASN 46 N -4.85 2.89 -0.97 1.61 -0.87 -1.26 -4.71 114.94 106.79 2yux s ASN 46 Ca -0.02 -0.54 -0.01 0.00 -1.57 0.00 0.00 52.86 50.72 2yux s ASN 46 Cb 0.01 -1.33 -0.01 0.00 -0.02 0.00 0.00 41.25 39.89 2yux s ASN 46 CO 0.02 0.08 0.81 0.00 -2.57 0.00 0.00 177.10 175.45 2yux n ALA 47 N 3.97 -1.78 -0.85 0.60 0.00 -1.26 -4.73 120.51 116.46 2yux n ALA 47 Ca -0.20 -0.01 -0.36 0.00 0.00 0.00 0.00 53.44 52.87 2yux n ALA 47 Cb 0.52 -2.72 0.10 0.00 0.00 0.00 0.00 19.45 17.35 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 -3.45 -4.95 -2.62 0.00 0.00 -1.26 -4.47 120.51 103.76 2yux n ALA 48 Ca -0.20 -1.27 -0.43 0.00 0.00 0.00 0.00 53.44 51.54 2yux n ALA 48 Cb 0.63 -1.17 -0.02 0.00 0.00 0.00 0.00 19.45 18.88 2yux n ALA 48 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2yux s ILE 49 N -2.12 4.47 0.10 0.00 1.09 -1.26 -4.41 121.20 119.07 2yux s ILE 49 Ca 0.46 1.52 0.23 0.00 -1.10 0.00 0.00 60.65 61.75 2yux s ILE 49 Cb -0.02 -4.43 0.21 0.00 -1.06 0.00 0.00 42.46 37.16 2yux s ILE 49 CO 0.67 -0.59 1.78 0.71 -0.10 0.00 0.00 174.94 177.41 2yux h THR 50 N 5.85 0.60 -0.40 2.92 1.35 -1.87 -3.48 112.91 117.87 2yux h THR 50 Ca -0.22 -1.24 0.00 0.00 -0.55 0.00 0.00 66.41 64.40 2yux h THR 50 Cb 1.06 1.84 0.00 0.00 -1.73 0.00 0.00 68.15 69.32 2yux h THR 50 CO 1.04 0.25 0.00 0.61 -0.25 0.00 0.00 175.52 177.17 2yux n GLY 51 N 0.27 0.62 2.87 5.82 0.00 -1.26 -4.67 105.19 108.84 2yux n GLY 51 Ca 0.00 -0.67 -0.16 0.00 0.00 0.00 0.00 46.02 45.19 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 -2.06 -0.19 -0.01 1.61 1.51 -1.26 -2.60 117.35 114.34 2yux s TYR 52 Ca 0.00 0.60 -0.24 0.00 -1.01 0.00 0.00 57.07 56.42 2yux s TYR 52 Cb 0.00 -0.20 -0.04 0.00 -0.11 0.00 0.00 41.96 41.60 2yux s TYR 52 CO 0.00 -0.25 0.74 0.99 -1.11 0.00 0.00 175.55 175.92 2yux s THR 53 N 2.02 4.90 0.02 -0.71 2.01 -1.26 -3.75 115.64 118.88 2yux s THR 53 Ca -0.00 1.55 0.05 0.00 0.31 0.00 0.00 61.69 63.60 2yux s THR 53 Cb -0.12 -4.08 -0.03 0.00 0.01 0.00 0.00 72.50 68.28 2yux s THR 53 CO -0.06 0.30 -0.13 -0.63 -0.69 0.00 0.00 174.62 173.41 2yux s ILE 54 N 0.41 3.14 -0.02 1.82 1.01 -0.79 -1.26 121.20 125.50 2yux s ILE 54 Ca 0.38 -1.01 -0.02 0.00 0.00 0.00 0.00 60.65 60.00 2yux s ILE 54 Cb -0.19 -2.34 0.00 0.00 0.01 0.00 0.00 42.46 39.95 2yux s ILE 54 CO 0.21 0.36 0.05 -1.10 0.00 0.00 0.00 174.94 174.47 2yux s GLN 55 N -1.42 0.08 0.08 2.79 -0.21 -1.04 0.54 119.66 120.48 2yux s GLN 55 Ca 0.16 0.04 0.06 0.00 0.02 0.00 0.00 55.36 55.64 2yux s GLN 55 Cb -0.11 0.04 -0.04 0.00 1.00 0.00 0.00 33.01 33.90 2yux s GLN 55 CO 0.06 -0.01 -0.09 -1.59 -2.12 0.00 0.00 175.29 171.54 2yux s LYS 56 N -0.05 2.26 -0.07 2.91 -2.85 -1.26 -2.33 119.74 118.35 2yux s LYS 56 Ca -0.01 -0.94 -0.20 0.00 -1.00 0.00 0.00 55.97 53.82 2yux s LYS 56 Cb -0.01 -2.36 0.04 0.00 -2.06 0.00 0.00 37.83 33.44 2yux s LYS 56 CO 0.00 0.53 0.46 0.00 0.10 0.00 0.00 175.35 176.44 2yux s ALA 57 N -1.17 -1.17 0.62 0.59 0.00 -0.79 -3.40 121.76 116.46 2yux s ALA 57 Ca 0.21 0.86 0.07 0.00 0.00 0.00 0.00 51.96 53.10 2yux s ALA 57 Cb -0.11 -0.16 0.10 0.00 0.00 0.00 0.00 23.12 22.95 2yux s ALA 57 CO 0.13 -0.28 0.86 -0.51 0.00 0.00 0.00 175.76 175.95 2yux s ASP 58 N -0.90 4.86 -0.05 0.00 1.01 -1.25 0.48 116.67 120.82 2yux s ASP 58 Ca -0.10 -0.75 0.09 0.00 0.71 0.00 0.00 52.55 52.50 2yux s ASP 58 Cb -0.03 0.28 0.34 0.00 1.01 0.00 0.00 42.92 44.52 2yux s ASP 58 CO 0.05 -1.52 1.17 0.29 0.21 0.00 0.00 175.17 175.37 2yux n LYS 59 N -2.42 2.26 0.02 8.23 4.76 -1.22 -2.73 118.16 127.06 2yux n LYS 59 Ca 0.16 -1.33 -0.13 0.00 -2.87 0.00 0.00 58.31 54.15 2yux n LYS 59 Cb 0.61 -1.54 -0.09 0.00 -1.84 0.00 0.00 35.03 32.17 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 1.91 -0.07 0.00 1.97 1.79 -1.94 -3.42 116.57 116.82 2yux h LYS 60 Ca 0.00 0.00 -0.11 0.00 -2.18 0.00 0.00 60.65 58.37 2yux h LYS 60 Cb 0.80 0.02 -0.11 0.00 -1.58 0.00 0.00 32.23 31.36 2yux h LYS 60 CO 0.11 0.36 -0.23 0.43 -1.08 0.00 0.00 179.45 179.04 2yux n SER 61 N -4.91 -0.85 -3.98 0.86 7.64 -1.26 -5.00 113.62 106.12 2yux n SER 61 Ca -0.08 -1.66 -0.27 0.00 1.01 0.00 0.00 58.87 57.87 2yux n SER 61 Cb 0.24 0.28 -0.02 0.00 -1.01 0.00 0.00 64.21 63.70 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 -0.15 -2.81 -3.74 1.43 2.81 -1.11 -4.93 117.12 108.61 2yux n MET 62 Ca -0.22 0.36 -0.37 0.00 -1.81 0.00 0.00 57.70 55.67 2yux n MET 62 Cb 0.64 -4.34 -0.07 0.00 -0.71 0.00 0.00 33.22 28.74 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 -6.63 3.80 0.18 0.03 2.02 -1.26 -4.96 118.70 111.89 2yux s GLU 63 Ca 0.05 -0.05 0.08 0.00 0.02 0.00 0.00 54.97 55.07 2yux s GLU 63 Cb -0.02 -3.28 -0.04 0.00 0.10 0.00 0.00 34.13 30.89 2yux s GLU 63 CO 0.90 0.57 -0.07 -1.58 0.02 0.00 0.00 175.26 175.11 2yux s TRP 64 N -0.48 2.69 0.00 1.61 0.52 -1.26 -3.82 118.94 118.20 2yux s TRP 64 Ca 0.15 -0.20 0.06 0.00 0.02 0.00 0.00 56.10 56.13 2yux s TRP 64 Cb -0.13 -1.31 0.10 0.00 -1.15 0.00 0.00 33.47 30.99 2yux s TRP 64 CO 0.04 0.52 1.01 1.19 0.02 0.00 0.00 176.95 179.73 2yux n PHE 65 N -0.03 0.00 -1.61 -1.98 3.01 -1.22 -5.02 117.46 110.61 2yux n PHE 65 Ca -0.10 -0.13 0.00 0.00 1.01 0.00 0.00 57.45 58.23 2yux n PHE 65 Cb 0.55 -0.05 0.00 0.00 -0.01 0.00 0.00 39.48 39.98 2yux n PHE 65 CO 0.00 0.00 0.00 2.41 1.01 0.00 0.00 176.76 180.18 2yux n THR 66 N 0.12 -4.37 0.00 4.37 -1.04 -1.26 -4.96 114.28 107.14 2yux n THR 66 Ca 0.01 2.05 0.00 0.00 -2.04 0.00 0.00 64.05 64.07 2yux n THR 66 Cb 0.80 -3.00 0.00 0.00 -1.82 0.00 0.00 70.33 66.31 2yux n THR 66 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 2yux n VAL 67 N -1.63 0.00 -3.68 12.58 0.31 0.19 -4.68 118.33 121.41 2yux n VAL 67 Ca 0.00 0.00 -0.12 0.00 -0.01 0.00 0.00 64.34 64.21 2yux n VAL 67 Cb 0.21 -0.76 -0.06 0.00 -0.91 0.00 0.00 33.84 32.32 2yux n VAL 67 CO 0.00 0.00 0.00 -0.51 -1.32 0.00 0.00 176.83 175.00 2yux s ILE 68 N -1.90 0.07 0.00 2.52 1.10 -0.89 -4.96 121.20 117.14 2yux s ILE 68 Ca 0.00 -0.54 0.01 0.00 -0.51 0.00 0.00 60.65 59.61 2yux s ILE 68 Cb 0.00 -0.99 -0.01 0.00 0.15 0.00 0.00 42.46 41.61 2yux s ILE 68 CO 0.00 -0.30 -0.04 -1.61 -2.11 0.00 0.00 174.94 170.89 2yux s GLU 69 N -2.72 0.30 -0.92 3.50 2.02 -1.26 -1.88 118.70 117.74 2yux s GLU 69 Ca -0.04 -0.20 -0.09 0.00 0.02 0.00 0.00 54.97 54.67 2yux s GLU 69 Cb -0.00 -0.26 0.00 0.00 0.10 0.00 0.00 34.13 33.97 2yux s GLU 69 CO -0.04 0.07 0.68 0.72 0.02 0.00 0.00 175.26 176.70 2yux n HIS 70 N 2.80 -2.16 -1.35 1.61 8.25 -1.26 -4.96 115.22 118.14 2yux n HIS 70 Ca -0.14 0.74 0.00 0.00 -0.26 0.00 0.00 57.72 58.06 2yux n HIS 70 Cb 0.58 -3.24 0.00 0.00 1.12 0.00 0.00 29.99 28.45 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 -3.05 -2.65 0.00 4.41 9.36 -1.25 -4.83 117.16 119.16 2yux n TYR 71 Ca -0.17 0.00 0.00 0.00 3.32 0.00 0.00 57.90 61.05 2yux n TYR 71 Cb 0.61 0.00 0.00 0.00 -0.63 0.00 0.00 39.34 39.32 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 -1.21 0.00 -0.28 2.98 -0.00 -1.26 -4.18 115.22 111.26 2yux n HIS 72 Ca 0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 57.72 57.61 2yux n HIS 72 Cb 0.00 0.12 0.11 0.00 -0.00 0.00 0.00 29.99 30.22 2yux n HIS 72 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.34 176.88 2yux n ARG 73 N -1.74 -1.36 0.00 1.57 5.12 -1.26 -4.88 116.66 114.11 2yux n ARG 73 Ca 0.00 -0.53 0.02 0.00 -1.93 0.00 0.00 57.85 55.41 2yux n ARG 73 Cb 0.00 -0.97 0.02 0.00 -1.16 0.00 0.00 32.46 30.35 2yux n ARG 73 CO 0.00 0.00 0.00 0.25 -1.93 0.00 0.00 177.63 175.95 2yux n THR 74 N -3.89 0.00 -4.54 0.55 -2.24 -1.26 -4.87 114.28 98.03 2yux n THR 74 Ca 0.05 -0.50 -0.21 0.00 -2.27 0.00 0.00 64.05 61.12 2yux n THR 74 Cb 0.22 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 -0.32 1.45 -0.08 3.42 1.04 -1.26 -3.05 113.70 114.89 2yux s SER 75 Ca 0.04 -0.22 -0.07 0.00 0.48 0.00 0.00 55.95 56.18 2yux s SER 75 Cb 0.03 -0.21 0.02 0.00 0.10 0.00 0.00 66.02 65.97 2yux s SER 75 CO 0.05 0.14 0.22 0.00 0.98 0.00 0.00 173.24 174.62 2yux s ALA 76 N -0.20 -0.53 -0.24 5.32 0.00 -1.25 -5.03 121.76 119.84 2yux s ALA 76 Ca 0.03 0.64 -0.13 0.00 0.00 0.00 0.00 51.96 52.50 2yux s ALA 76 Cb -0.06 -0.38 -0.04 0.00 0.00 0.00 0.00 23.12 22.64 2yux s ALA 76 CO -0.00 -0.11 0.27 0.99 0.00 0.00 0.00 175.76 176.91 2yux s THR 77 N 0.22 5.27 0.54 0.00 2.01 -1.26 -2.75 115.64 119.67 2yux s THR 77 Ca -0.01 0.40 -0.13 0.00 0.31 0.00 0.00 61.69 62.26 2yux s THR 77 Cb -0.02 -3.61 -0.06 0.00 0.01 0.00 0.00 72.50 68.82 2yux s THR 77 CO -0.00 0.27 0.96 -0.63 -0.69 0.00 0.00 174.62 174.53 2yux s ILE 78 N 1.38 4.65 0.31 1.82 -1.09 0.06 -4.87 121.20 123.46 2yux s ILE 78 Ca 0.12 0.95 0.06 0.00 -2.23 0.00 0.00 60.65 59.55 2yux s ILE 78 Cb -0.15 -3.79 -0.02 0.00 -1.58 0.00 0.00 42.46 36.93 2yux s ILE 78 CO 0.07 -0.84 0.20 0.35 -1.23 0.00 0.00 174.94 173.49 2yux n THR 79 N -2.01 0.00 -3.36 2.92 -2.24 -1.26 -2.47 114.28 105.86 2yux n THR 79 Ca 0.05 -2.08 -0.13 0.00 -2.27 0.00 0.00 64.05 59.62 2yux n THR 79 Cb 0.54 0.94 0.00 0.00 -2.10 0.00 0.00 70.33 69.71 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 -0.63 -1.56 -4.40 -0.78 1.02 -1.24 -4.98 120.64 108.08 2yux n GLU 80 Ca 0.02 1.27 -0.20 0.00 -0.02 0.00 0.00 57.16 58.24 2yux n GLU 80 Cb 0.52 -4.13 -0.15 0.00 -0.02 0.00 0.00 31.44 27.66 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 -4.11 1.88 -0.13 -4.62 1.43 -1.25 -5.10 118.68 106.78 2yux s LEU 81 Ca 0.06 -0.18 -0.20 0.00 -1.03 0.00 0.00 54.13 52.78 2yux s LEU 81 Cb -0.01 -0.53 -0.04 0.00 0.03 0.00 0.00 46.19 45.64 2yux s LEU 81 CO 0.82 0.09 0.55 -0.69 0.23 0.00 0.00 176.35 177.35 2yux s VAL 82 N 0.02 5.12 0.12 -1.59 1.01 -1.26 -4.66 120.40 119.16 2yux s VAL 82 Ca -0.00 1.09 -0.31 0.00 0.00 0.00 0.00 61.98 62.76 2yux s VAL 82 Cb -0.07 -3.89 -0.08 0.00 0.00 0.00 0.00 36.38 32.35 2yux s VAL 82 CO 0.00 0.26 1.40 -0.63 0.00 0.00 0.00 175.10 176.12 2yux s ILE 83 N 0.99 3.27 0.00 2.22 1.01 -1.26 -3.73 121.20 123.70 2yux s ILE 83 Ca 0.29 0.91 0.00 0.00 0.00 0.00 0.00 60.65 61.85 2yux s ILE 83 Cb -0.16 -3.59 0.00 0.00 0.01 0.00 0.00 42.46 38.73 2yux s ILE 83 CO 0.12 0.07 0.00 0.61 0.00 0.00 0.00 174.94 175.74 2yux n GLY 84 N 3.48 0.74 3.48 6.18 0.00 -1.14 -4.98 105.19 112.94 2yux n GLY 84 Ca 0.11 -0.01 -0.11 0.00 0.00 0.00 0.00 46.02 46.01 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 -1.50 -0.48 -0.00 1.61 0.01 -1.24 -5.03 114.94 108.30 2yux s ASN 85 Ca 0.00 0.10 0.07 0.00 -0.71 0.00 0.00 52.86 52.32 2yux s ASN 85 Cb 0.00 0.49 -0.03 0.00 0.41 0.00 0.00 41.25 42.12 2yux s ASN 85 CO 0.00 -0.75 -0.20 -0.70 -1.51 0.00 0.00 177.10 173.94 2yux s GLU 86 N -3.04 2.17 0.31 -0.60 -6.30 -1.26 -2.26 118.70 107.71 2yux s GLU 86 Ca 0.01 -0.90 0.03 0.00 -2.50 0.00 0.00 54.97 51.61 2yux s GLU 86 Cb -0.01 -2.17 -0.05 0.00 0.00 0.00 0.00 34.13 31.90 2yux s GLU 86 CO -0.08 0.57 0.10 0.71 0.02 0.00 0.00 175.26 176.57 2yux s TYR 87 N -0.76 1.73 0.13 5.30 1.51 -1.10 -3.37 117.35 120.79 2yux s TYR 87 Ca 0.12 -1.15 0.07 0.00 -1.01 0.00 0.00 57.07 55.11 2yux s TYR 87 Cb -0.10 -1.06 -0.04 0.00 -0.11 0.00 0.00 41.96 40.65 2yux s TYR 87 CO 0.02 -0.24 -0.17 0.71 -1.11 0.00 0.00 175.55 174.75 2yux s TYR 88 N -3.50 1.65 -0.03 2.71 2.02 0.18 -3.47 117.35 116.90 2yux s TYR 88 Ca 0.35 -0.49 0.03 0.00 -0.37 0.00 0.00 57.07 56.59 2yux s TYR 88 Cb 0.07 -0.86 0.00 0.00 -0.40 0.00 0.00 41.96 40.78 2yux s TYR 88 CO 0.15 0.23 -0.10 -0.06 -1.57 0.00 0.00 175.55 174.20 2yux s PHE 89 N -1.87 1.09 -0.10 2.71 0.08 -1.26 -1.88 117.98 116.75 2yux s PHE 89 Ca 0.11 -0.29 0.01 0.00 0.12 0.00 0.00 56.93 56.88 2yux s PHE 89 Cb -0.06 -0.78 0.02 0.00 -0.57 0.00 0.00 43.02 41.63 2yux s PHE 89 CO 0.05 -0.13 -0.13 0.50 -0.10 0.00 0.00 175.22 175.41 2yux s ARG 90 N 0.24 1.98 -0.20 0.44 3.00 -0.98 -3.38 118.95 120.04 2yux s ARG 90 Ca -0.04 -0.47 -0.06 0.00 -1.00 0.00 0.00 55.73 54.15 2yux s ARG 90 Cb -0.10 -1.73 -0.03 0.00 0.00 0.00 0.00 34.95 33.09 2yux s ARG 90 CO 0.01 -0.08 0.04 0.08 0.00 0.00 0.00 175.30 175.34 2yux s VAL 91 N 1.05 4.32 0.26 7.11 1.01 -1.26 -2.51 120.40 130.38 2yux s VAL 91 Ca -0.06 -0.19 0.02 0.00 0.00 0.00 0.00 61.98 61.75 2yux s VAL 91 Cb -0.15 -2.96 0.05 0.00 0.00 0.00 0.00 36.38 33.32 2yux s VAL 91 CO -0.02 0.42 0.35 0.49 0.00 0.00 0.00 175.10 176.34 2yux n PHE 92 N 4.11 -2.97 -3.72 5.22 3.72 -0.39 -3.76 117.46 119.66 2yux n PHE 92 Ca -0.17 -0.76 -0.30 0.00 -0.05 0.00 0.00 57.45 56.18 2yux n PHE 92 Cb 0.52 -0.25 -0.14 0.00 -0.94 0.00 0.00 39.48 38.67 2yux n PHE 92 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 2yux s SER 93 N -2.49 3.84 0.87 4.37 0.01 -1.26 -4.22 113.70 114.82 2yux s SER 93 Ca 0.25 -2.17 -0.11 0.00 1.31 0.00 0.00 55.95 55.23 2yux s SER 93 Cb -0.02 -0.96 0.12 0.00 0.21 0.00 0.00 66.02 65.37 2yux s SER 93 CO 0.16 -0.34 1.09 -1.61 0.41 0.00 0.00 173.24 172.96 2yux s GLU 94 N 0.95 1.43 -0.00 12.44 0.41 -1.07 -3.57 118.70 129.29 2yux s GLU 94 Ca 0.14 0.93 -0.01 0.00 -0.41 0.00 0.00 54.97 55.62 2yux s GLU 94 Cb -0.21 -1.82 0.00 0.00 -1.78 0.00 0.00 34.13 30.32 2yux s GLU 94 CO -0.11 -2.15 0.06 0.27 -0.49 0.00 0.00 175.26 172.84 2yux n ASN 95 N -3.84 -0.04 -1.80 -0.19 6.94 -1.22 -3.59 115.26 111.52 2yux n ASN 95 Ca 0.08 -1.00 -0.12 0.00 -0.02 0.00 0.00 54.58 53.51 2yux n ASN 95 Cb 0.55 0.06 0.02 0.00 -2.36 0.00 0.00 39.78 38.05 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 -0.04 1.60 0.09 -3.83 0.00 -1.26 -4.01 117.12 109.67 2yux n MET 96 Ca 0.00 -1.14 0.00 0.00 0.00 0.00 0.00 57.70 56.57 2yux n MET 96 Cb 0.02 -1.46 0.00 0.00 0.00 0.00 0.00 33.22 31.78 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 1.06 0.97 3.85 0.00 0.00 -1.26 -5.16 105.19 104.65 2yux n GLY 98 Ca 0.00 -0.14 -0.28 0.00 0.00 0.00 0.00 46.02 45.60 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 4.03 -0.07 0.99 2.01 -1.26 -3.38 118.68 121.00 2yux s LEU 99 Ca 0.00 0.04 -0.29 0.00 0.01 0.00 0.00 54.13 53.89 2yux s LEU 99 Cb 0.00 -2.64 -0.02 0.00 0.01 0.00 0.00 46.19 43.54 2yux s LEU 99 CO 0.00 0.10 0.98 -0.94 1.01 0.00 0.00 176.35 177.51 2yux s SER 100 N -2.87 7.27 0.48 2.29 1.04 -1.23 -4.92 113.70 115.76 2yux s SER 100 Ca 0.32 1.55 0.23 0.00 0.48 0.00 0.00 55.95 58.54 2yux s SER 100 Cb -0.11 -2.55 1.20 0.00 0.10 0.00 0.00 66.02 64.65 2yux s SER 100 CO 0.25 -0.37 1.98 -0.33 0.98 0.00 0.00 173.24 175.76 2yux h GLU 101 N 6.98 0.00 -5.40 4.02 5.08 -1.95 -3.42 114.58 119.90 2yux h GLU 101 Ca -0.35 0.00 -0.62 0.00 -1.00 0.00 0.00 59.36 57.39 2yux h GLU 101 Cb 1.17 0.00 -0.10 0.00 0.50 0.00 0.00 28.75 30.32 2yux h GLU 101 CO 0.81 0.19 -0.48 -0.51 -1.00 0.00 0.00 179.01 178.02 2yux s ASP 102 N -6.38 6.27 0.10 1.42 1.01 -1.26 -5.09 116.67 112.74 2yux s ASP 102 Ca -0.02 0.31 0.05 0.00 0.71 0.00 0.00 52.55 53.60 2yux s ASP 102 Cb 0.13 -2.09 -0.03 0.00 1.01 0.00 0.00 42.92 41.94 2yux s ASP 102 CO 0.63 0.25 -0.12 0.00 0.21 0.00 0.00 175.17 176.14 2yux s ALA 103 N -0.09 1.23 -0.53 5.23 0.00 -1.26 -4.34 121.76 122.00 2yux s ALA 103 Ca 0.10 -1.17 -0.10 0.00 0.00 0.00 0.00 51.96 50.79 2yux s ALA 103 Cb -0.11 -0.03 0.13 0.00 0.00 0.00 0.00 23.12 23.11 2yux s ALA 103 CO 0.00 0.05 0.42 0.99 0.00 0.00 0.00 175.76 177.22 2yux s THR 104 N -2.08 4.46 0.22 0.00 2.01 -1.25 -4.97 115.64 114.05 2yux s THR 104 Ca 0.04 -1.90 -0.30 0.00 0.31 0.00 0.00 61.69 59.85 2yux s THR 104 Cb -0.05 -3.91 -0.09 0.00 0.01 0.00 0.00 72.50 68.47 2yux s THR 104 CO 0.01 -0.82 1.13 -0.32 -0.69 0.00 0.00 174.62 173.93 2yux s MET 105 N 1.18 4.57 -0.41 4.92 1.75 -1.26 -4.26 119.30 125.79 2yux s MET 105 Ca 0.07 1.81 -0.46 0.00 -1.25 0.00 0.00 55.69 55.87 2yux s MET 105 Cb -0.25 -3.23 -0.20 0.00 2.84 0.00 0.00 34.83 34.00 2yux s MET 105 CO -0.01 0.07 1.53 0.25 -0.65 0.00 0.00 175.02 176.21 2yux n THR 106 N 1.93 0.01 -0.43 10.11 -2.24 -1.22 -4.70 114.28 117.74 2yux n THR 106 Ca 0.02 -0.00 0.38 0.00 -2.27 0.00 0.00 64.05 62.17 2yux n THR 106 Cb 0.45 -0.46 0.65 0.00 -2.10 0.00 0.00 70.33 68.87 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 4.80 0.01 -5.49 -0.78 1.79 -1.90 -3.38 116.57 111.62 2yux h LYS 107 Ca -0.45 -0.00 -0.43 0.00 -2.18 0.00 0.00 60.65 57.59 2yux h LYS 107 Cb 1.38 -0.00 -0.19 0.00 -1.58 0.00 0.00 32.23 31.84 2yux h LYS 107 CO 0.93 0.01 -0.76 -1.21 -1.08 0.00 0.00 179.45 177.33 2yux s GLU 108 N -5.35 1.04 0.91 3.15 2.02 -1.26 -5.15 118.70 114.05 2yux s GLU 108 Ca -0.08 -1.23 -0.14 0.00 0.02 0.00 0.00 54.97 53.54 2yux s GLU 108 Cb 0.32 -0.95 0.15 0.00 0.10 0.00 0.00 34.13 33.74 2yux s GLU 108 CO 0.81 0.19 1.21 -1.54 0.02 0.00 0.00 175.26 175.95 2yux s SER 109 N -2.41 3.60 -0.12 -0.19 1.04 -1.26 -4.92 113.70 109.44 2yux s SER 109 Ca 0.09 0.64 0.02 0.00 0.48 0.00 0.00 55.95 57.18 2yux s SER 109 Cb -0.05 -0.98 0.01 0.00 0.10 0.00 0.00 66.02 65.10 2yux s SER 109 CO 0.03 -2.46 -0.20 0.00 0.98 0.00 0.00 173.24 171.60 2yux s ALA 110 N -3.58 2.03 -0.24 5.32 0.00 -1.23 -5.03 121.76 119.02 2yux s ALA 110 Ca 0.67 -0.94 -0.06 0.00 0.00 0.00 0.00 51.96 51.62 2yux s ALA 110 Cb -0.09 -0.91 -0.02 0.00 0.00 0.00 0.00 23.12 22.09 2yux s ALA 110 CO 0.52 -0.02 0.04 0.14 0.00 0.00 0.00 175.76 176.44 2yux s VAL 111 N 0.84 4.10 0.39 0.00 -7.23 -1.26 -2.73 120.40 114.51 2yux s VAL 111 Ca -0.08 -0.25 -0.25 0.00 -1.81 0.00 0.00 61.98 59.60 2yux s VAL 111 Cb -0.15 -2.90 -0.09 0.00 0.56 0.00 0.00 36.38 33.80 2yux s VAL 111 CO -0.01 0.36 1.09 -0.63 -0.31 0.00 0.00 175.10 175.61 2yux s ILE 112 N 1.53 3.50 -0.24 -0.62 -1.09 -0.96 -4.98 121.20 118.34 2yux s ILE 112 Ca 0.06 1.21 -0.28 0.00 -2.23 0.00 0.00 60.65 59.41 2yux s ILE 112 Cb -0.15 -3.65 0.15 0.00 -1.58 0.00 0.00 42.46 37.23 2yux s ILE 112 CO 0.02 0.06 1.15 0.00 -1.23 0.00 0.00 174.94 174.95 2yux s ALA 113 N -1.54 -2.03 -0.84 9.38 0.00 -1.26 -2.88 121.76 122.60 2yux s ALA 113 Ca 0.57 1.74 -0.06 0.00 0.00 0.00 0.00 51.96 54.21 2yux s ALA 113 Cb -0.26 -1.25 -0.05 0.00 0.00 0.00 0.00 23.12 21.56 2yux s ALA 113 CO 0.32 -0.24 2.01 0.54 0.00 0.00 0.00 175.76 178.40 2yux n ARG 114 N 1.24 1.89 -3.76 0.00 1.74 -1.26 -3.26 116.66 113.26 2yux n ARG 114 Ca -0.09 -1.40 -0.29 0.00 -0.77 0.00 0.00 57.85 55.30 2yux n ARG 114 Cb 0.57 -2.44 -0.16 0.00 -1.02 0.00 0.00 32.46 29.42 2yux n ARG 114 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 2yux s ASP 115 N 3.62 3.58 -0.27 0.55 2.15 -1.26 -4.93 116.67 120.11 2yux s ASP 115 Ca 0.37 -1.27 -0.09 0.00 0.43 0.00 0.00 52.55 52.00 2yux s ASP 115 Cb 0.10 -0.79 -0.03 0.00 -0.30 0.00 0.00 42.92 41.90 2yux s ASP 115 CO -0.02 -0.35 0.11 -0.83 -0.17 0.00 0.00 175.17 173.91 2yux s GLY 116 N 1.69 1.82 0.09 2.66 0.00 -1.26 -4.41 107.32 107.91 2yux s GLY 116 Ca 0.04 -1.19 -0.02 0.00 0.00 0.00 0.00 44.72 43.55 2yux s GLY 116 CO -0.17 0.60 0.12 0.28 0.00 0.00 0.00 173.10 173.93 2yux n LYS 117 N 4.97 -0.15 -3.72 2.90 4.76 -1.26 -5.10 118.16 120.56 2yux n LYS 117 Ca -0.15 -0.19 -0.13 0.00 -2.87 0.00 0.00 58.31 54.98 2yux n LYS 117 Cb 0.51 -0.13 -0.13 0.00 -1.84 0.00 0.00 35.03 33.44 2yux n LYS 117 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 2yux s ILE 118 N -1.26 -0.10 0.00 -0.18 1.01 -1.26 -5.15 121.20 114.25 2yux s ILE 118 Ca 0.07 0.18 0.00 0.00 0.00 0.00 0.00 60.65 60.89 2yux s ILE 118 Cb -0.00 -0.38 0.00 0.00 0.01 0.00 0.00 42.46 42.09 2yux s ILE 118 CO 0.05 0.07 0.00 0.00 0.00 0.00 0.00 174.94 175.06 2yux n TYR 119 N 4.43 0.00 1.91 3.97 4.19 -1.26 -5.33 117.16 125.07 2yux n TYR 119 Ca -0.22 0.00 0.16 0.00 3.31 0.00 0.00 57.90 61.15 2yux n TYR 119 Cb 0.52 0.00 0.87 0.00 0.49 0.00 0.00 39.34 41.22 2yux n TYR 119 CO 0.00 0.00 0.00 1.17 0.91 0.00 0.00 176.86 178.94