#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 -2.42 -3.64 1.61 7.64 -1.26 -5.03 113.62 110.52 2yux n SER 2 Ca 0.00 0.59 -0.01 0.00 1.01 0.00 0.00 58.87 60.47 2yux n SER 2 Cb 0.00 2.43 -0.01 0.00 -1.01 0.00 0.00 64.21 65.62 2yux n SER 2 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2yux s SER 3 N -1.69 -0.10 0.00 6.43 1.04 -1.26 -5.14 113.70 112.98 2yux s SER 3 Ca 0.00 -0.17 0.00 0.00 0.48 0.00 0.00 55.95 56.26 2yux s SER 3 Cb 0.00 0.23 0.00 0.00 0.10 0.00 0.00 66.02 66.35 2yux s SER 3 CO 0.00 -0.42 0.00 0.61 0.98 0.00 0.00 173.24 174.41 2yux n GLY 4 N -0.42 -1.20 1.40 7.32 0.00 -1.26 -5.17 105.19 105.85 2yux n GLY 4 Ca -0.07 0.63 0.00 0.00 0.00 0.00 0.00 46.02 46.58 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 0.00 -7.57 -4.72 1.61 7.64 -1.26 -5.01 113.62 104.31 2yux n SER 5 Ca 0.00 1.51 -0.23 0.00 1.01 0.00 0.00 58.87 61.16 2yux n SER 5 Cb 0.00 -4.33 -0.07 0.00 -1.01 0.00 0.00 64.21 58.80 2yux n SER 5 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2yux s SER 6 N -4.61 4.58 0.39 6.43 0.01 -1.26 -5.03 113.70 114.21 2yux s SER 6 Ca 0.00 -0.83 0.00 0.00 1.31 0.00 0.00 55.95 56.43 2yux s SER 6 Cb 0.00 -0.68 0.00 0.00 0.21 0.00 0.00 66.02 65.55 2yux s SER 6 CO 0.00 -0.31 0.00 0.61 0.41 0.00 0.00 173.24 173.95 2yux n GLY 7 N -1.12 -1.67 3.99 3.44 0.00 -1.26 -5.15 105.19 103.42 2yux n GLY 7 Ca -0.03 0.34 -0.18 0.00 0.00 0.00 0.00 46.02 46.14 2yux n GLY 7 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2yux s ALA 8 N -1.84 4.49 -1.91 4.61 0.00 -1.26 -5.01 121.76 120.84 2yux s ALA 8 Ca 0.00 -1.79 0.21 0.00 0.00 0.00 0.00 51.96 50.38 2yux s ALA 8 Cb 0.00 -1.46 0.63 0.00 0.00 0.00 0.00 23.12 22.29 2yux s ALA 8 CO 0.00 -0.40 1.53 0.45 0.00 0.00 0.00 175.76 177.34 2yux n SER 9 N -1.88 3.87 -4.61 0.00 2.88 -1.26 -4.90 113.62 107.73 2yux n SER 9 Ca 0.09 -2.05 -0.43 0.00 -1.33 0.00 0.00 58.87 55.15 2yux n SER 9 Cb 0.60 -0.48 -0.02 0.00 -0.75 0.00 0.00 64.21 63.56 2yux n SER 9 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 2yux s ILE 10 N -1.14 4.00 -0.67 2.46 1.01 -1.26 -4.95 121.20 120.65 2yux s ILE 10 Ca 0.48 1.07 -0.21 0.00 0.00 0.00 0.00 60.65 61.98 2yux s ILE 10 Cb 0.25 -4.20 0.08 0.00 0.01 0.00 0.00 42.46 38.61 2yux s ILE 10 CO 0.31 -0.66 0.93 -1.81 0.00 0.00 0.00 174.94 173.71 2yux s ASP 11 N 3.44 6.22 -1.11 3.58 1.11 -1.26 -4.95 116.67 123.70 2yux s ASP 11 Ca 0.59 -1.19 -0.23 0.00 0.18 0.00 0.00 52.55 51.90 2yux s ASP 11 Cb -0.15 -2.39 -0.07 0.00 1.07 0.00 0.00 42.92 41.38 2yux s ASP 11 CO 0.29 -1.34 1.93 -0.63 1.18 0.00 0.00 175.17 176.60 2yux s ILE 12 N 3.65 3.54 0.24 0.77 1.01 -1.26 -4.92 121.20 124.23 2yux s ILE 12 Ca 0.21 -0.79 -0.12 0.00 0.00 0.00 0.00 60.65 59.94 2yux s ILE 12 Cb -0.17 -4.44 -0.08 0.00 0.01 0.00 0.00 42.46 37.78 2yux s ILE 12 CO 0.07 -1.02 0.61 0.00 0.00 0.00 0.00 174.94 174.61 2yux s GLN 13 N 6.54 3.91 -0.31 2.79 -2.07 -1.26 -4.85 119.66 124.40 2yux s GLN 13 Ca 0.68 0.46 0.01 0.00 -1.82 0.00 0.00 55.36 54.69 2yux s GLN 13 Cb -0.02 -2.65 0.10 0.00 -1.09 0.00 0.00 33.01 29.35 2yux s GLN 13 CO 0.09 0.30 0.07 0.42 -1.32 0.00 0.00 175.29 174.85 2yux s ILE 14 N -1.79 1.49 0.80 3.63 1.01 -1.26 -5.11 121.20 119.97 2yux s ILE 14 Ca 0.47 -1.76 -0.14 0.00 0.00 0.00 0.00 60.65 59.23 2yux s ILE 14 Cb -0.12 -2.08 0.03 0.00 0.01 0.00 0.00 42.46 40.30 2yux s ILE 14 CO 0.20 -0.59 0.81 -0.38 0.00 0.00 0.00 174.94 174.97 2yux n ILE 15 N 4.60 1.62 -0.17 2.92 5.41 -1.26 -4.74 119.36 127.74 2yux n ILE 15 Ca -0.01 -0.28 0.02 0.00 1.00 0.00 0.00 62.75 63.49 2yux n ILE 15 Cb 0.42 -0.93 -0.01 0.00 -0.71 0.00 0.00 39.64 38.42 2yux n ILE 15 CO 0.00 0.00 0.00 -0.67 0.00 0.00 0.00 176.55 175.88 2yux n ASP 16 N -1.78 -1.00 -3.95 4.38 -0.08 -1.26 -4.90 116.55 107.97 2yux n ASP 16 Ca 0.11 0.08 -0.36 0.00 -1.51 0.00 0.00 54.79 53.11 2yux n ASP 16 Cb 0.51 -0.52 0.02 0.00 2.34 0.00 0.00 41.12 43.48 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 -1.79 0.00 0.18 -0.67 1.74 -1.26 -4.65 116.66 110.20 2yux n ARG 17 Ca -0.00 0.00 0.14 0.00 -0.77 0.00 0.00 57.85 57.21 2yux n ARG 17 Cb 0.08 -0.96 0.44 0.00 -1.02 0.00 0.00 32.46 31.00 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 -0.49 0.00 0.00 5.56 0.13 -1.86 -3.50 132.00 131.84 2yux h PRO 18 Ca -0.41 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.72 2yux h PRO 18 Cb 1.32 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.45 2yux h PRO 18 CO 0.31 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.49 2yux n GLY 19 N 0.61 -1.71 3.78 1.56 0.00 -1.26 -4.83 105.19 103.34 2yux n GLY 19 Ca 0.03 -1.52 -0.29 0.00 0.00 0.00 0.00 46.02 44.24 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 0.00 0.49 0.84 1.61 0.04 -1.26 -4.39 135.00 132.33 2yux s PRO 20 Ca 0.00 0.04 -0.12 0.00 0.04 0.00 0.00 61.00 60.97 2yux s PRO 20 Cb 0.00 -1.79 0.09 0.00 0.04 0.00 0.00 34.50 32.85 2yux s PRO 20 CO 0.00 -2.59 1.11 -1.25 0.04 0.00 0.00 177.00 174.31 2yux s PRO 21 N -5.45 1.75 0.06 0.56 0.04 -1.26 -4.86 135.00 125.83 2yux s PRO 21 Ca 0.68 0.52 -0.25 0.00 0.04 0.00 0.00 61.00 61.99 2yux s PRO 21 Cb -0.11 -1.89 -0.17 0.00 0.04 0.00 0.00 34.50 32.37 2yux s PRO 21 CO 0.54 -1.83 1.59 1.96 0.04 0.00 0.00 177.00 179.30 2yux h GLN 22 N -1.24 -0.12 -3.09 4.56 4.20 -1.67 -3.46 115.11 114.30 2yux h GLN 22 Ca -0.48 0.01 -0.03 0.00 0.06 0.00 0.00 58.65 58.20 2yux h GLN 22 Cb 1.29 0.03 -0.13 0.00 0.30 0.00 0.00 27.48 28.97 2yux h GLN 22 CO 0.60 0.03 0.12 -1.50 -0.67 0.00 0.00 178.83 177.41 2yux s ILE 23 N -5.66 0.02 -0.15 2.54 -1.16 -1.26 -4.95 121.20 110.58 2yux s ILE 23 Ca -0.14 -0.18 -0.03 0.00 -0.51 0.00 0.00 60.65 59.80 2yux s ILE 23 Cb 0.05 -1.05 0.05 0.00 0.61 0.00 0.00 42.46 42.12 2yux s ILE 23 CO 0.65 -0.10 0.03 -0.69 -2.81 0.00 0.00 174.94 172.02 2yux s VAL 24 N -3.67 0.40 0.43 4.00 1.01 -1.26 -0.42 120.40 120.89 2yux s VAL 24 Ca 0.01 -0.26 0.05 0.00 0.00 0.00 0.00 61.98 61.78 2yux s VAL 24 Cb -0.00 -0.80 -0.06 0.00 0.00 0.00 0.00 36.38 35.52 2yux s VAL 24 CO -0.12 -0.05 0.01 -0.54 0.00 0.00 0.00 175.10 174.41 2yux s LYS 25 N 1.93 2.01 -0.35 2.72 1.02 0.52 -4.31 119.74 123.27 2yux s LYS 25 Ca 0.02 -2.18 0.04 0.00 0.02 0.00 0.00 55.97 53.86 2yux s LYS 25 Cb -0.15 -1.55 0.10 0.00 -0.52 0.00 0.00 37.83 35.71 2yux s LYS 25 CO -0.07 -0.15 0.08 0.42 -0.92 0.00 0.00 175.35 174.71 2yux s ILE 26 N -2.79 2.16 0.29 2.17 1.01 -1.26 0.14 121.20 122.91 2yux s ILE 26 Ca 0.27 -2.35 -0.01 0.00 0.00 0.00 0.00 60.65 58.56 2yux s ILE 26 Cb 0.08 -2.59 0.41 0.00 0.01 0.00 0.00 42.46 40.36 2yux s ILE 26 CO 0.14 -0.63 1.48 1.21 0.00 0.00 0.00 174.94 177.13 2yux n GLU 27 N 4.19 -0.08 0.00 2.79 2.13 0.80 -4.81 120.64 125.66 2yux n GLU 27 Ca 0.04 1.43 0.00 0.00 0.66 0.00 0.00 57.16 59.28 2yux n GLU 27 Cb 0.41 -2.23 0.00 0.00 0.27 0.00 0.00 31.44 29.89 2yux n GLU 27 CO 0.00 0.00 0.00 -3.47 -0.41 0.00 0.00 177.13 173.25 2yux n ASP 28 N -5.43 0.00 -3.68 4.31 -0.08 -1.16 -4.99 116.55 105.51 2yux n ASP 28 Ca 0.20 0.00 -0.13 0.00 -1.51 0.00 0.00 54.79 53.36 2yux n ASP 28 Cb 0.66 0.00 -0.13 0.00 2.34 0.00 0.00 41.12 43.99 2yux n ASP 28 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 2yux s VAL 29 N -2.00 -0.30 0.06 5.18 0.11 -1.26 0.14 120.40 122.32 2yux s VAL 29 Ca 0.00 0.23 0.05 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 34.37 2yux s VAL 29 CO 0.00 0.09 -0.14 -1.66 -3.33 0.00 0.00 175.10 170.06 2yux s TRP 30 N 2.05 1.23 0.00 1.54 -2.14 0.69 -4.64 118.94 117.67 2yux s TRP 30 Ca -0.03 -0.41 0.00 0.00 2.66 0.00 0.00 56.10 58.32 2yux s TRP 30 Cb -0.11 -0.71 0.00 0.00 -3.10 0.00 0.00 33.47 29.55 2yux s TRP 30 CO -0.09 0.05 0.00 0.41 -2.66 0.00 0.00 176.95 174.66 2yux n GLY 31 N 1.56 1.81 1.92 3.67 0.00 0.77 0.97 105.19 115.89 2yux n GLY 31 Ca -0.20 0.28 -0.22 0.00 0.00 0.00 0.00 46.02 45.88 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 12.09 2.61 -4.07 1.61 1.02 -1.26 -3.81 120.64 128.82 2yux n GLU 32 Ca 0.00 -3.43 -0.19 0.00 -0.02 0.00 0.00 57.16 53.51 2yux n GLU 32 Cb 0.00 -2.14 -0.16 0.00 -0.02 0.00 0.00 31.44 29.11 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 -2.37 0.87 0.08 1.62 0.01 0.27 -3.92 114.94 111.50 2yux s ASN 33 Ca 0.55 -0.10 0.06 0.00 -0.71 0.00 0.00 52.86 52.66 2yux s ASN 33 Cb 0.45 -0.39 -0.04 0.00 0.41 0.00 0.00 41.25 41.68 2yux s ASN 33 CO 0.02 -0.08 -0.10 -0.69 -1.51 0.00 0.00 177.10 174.75 2yux s VAL 34 N 1.02 3.40 -0.22 1.60 1.01 -0.91 -0.22 120.40 126.07 2yux s VAL 34 Ca -0.10 -1.14 -0.02 0.00 0.00 0.00 0.00 61.98 60.72 2yux s VAL 34 Cb -0.14 -2.55 0.01 0.00 0.00 0.00 0.00 36.38 33.70 2yux s VAL 34 CO -0.01 0.20 -0.07 0.00 0.00 0.00 0.00 175.10 175.21 2yux s ALA 35 N -1.14 2.70 0.09 5.51 0.00 0.36 -2.06 121.76 127.22 2yux s ALA 35 Ca 0.20 -1.27 0.04 0.00 0.00 0.00 0.00 51.96 50.93 2yux s ALA 35 Cb -0.11 -1.61 -0.04 0.00 0.00 0.00 0.00 23.12 21.36 2yux s ALA 35 CO 0.12 -0.54 0.05 -0.51 0.00 0.00 0.00 175.76 174.88 2yux s LEU 36 N 1.40 3.67 -0.24 0.00 1.43 -1.20 -0.14 118.68 123.60 2yux s LEU 36 Ca 0.04 -0.08 -0.02 0.00 -1.03 0.00 0.00 54.13 53.04 2yux s LEU 36 Cb -0.15 -2.37 0.12 0.00 0.03 0.00 0.00 46.19 43.82 2yux s LEU 36 CO -0.05 0.17 0.29 0.42 0.23 0.00 0.00 176.35 177.41 2yux s THR 37 N -1.38 -0.44 0.15 5.49 -4.23 0.36 -3.88 115.64 111.72 2yux s THR 37 Ca 0.28 -0.21 0.10 0.00 -1.18 0.00 0.00 61.69 60.67 2yux s THR 37 Cb -0.12 -0.82 -0.04 0.00 1.34 0.00 0.00 72.50 72.86 2yux s THR 37 CO 0.21 -0.26 -0.18 -1.66 -0.54 0.00 0.00 174.62 172.19 2yux s TRP 38 N 2.41 2.49 0.34 3.99 -2.14 -0.89 0.19 118.94 125.34 2yux s TRP 38 Ca 0.09 -0.28 -0.02 0.00 2.66 0.00 0.00 56.10 58.55 2yux s TRP 38 Cb -0.15 -1.27 -0.04 0.00 -3.10 0.00 0.00 33.47 28.90 2yux s TRP 38 CO -0.20 0.44 0.58 0.95 -2.66 0.00 0.00 176.95 176.06 2yux s THR 39 N -1.42 5.05 0.76 0.66 -4.23 0.44 -4.78 115.64 112.13 2yux s THR 39 Ca 0.20 -0.17 -0.11 0.00 -1.18 0.00 0.00 61.69 60.43 2yux s THR 39 Cb -0.09 -3.81 0.05 0.00 1.34 0.00 0.00 72.50 69.98 2yux s THR 39 CO 0.11 -0.49 1.08 -2.16 -0.54 0.00 0.00 174.62 172.62 2yux s PRO 40 N -4.04 2.41 0.49 3.99 0.04 -1.26 -3.34 135.00 133.29 2yux s PRO 40 Ca 0.42 0.75 -0.20 0.00 0.04 0.00 0.00 61.00 62.02 2yux s PRO 40 Cb -0.10 -1.95 -0.08 0.00 0.04 0.00 0.00 34.50 32.41 2yux s PRO 40 CO 0.35 -1.42 1.04 -1.25 0.04 0.00 0.00 177.00 175.75 2yux s PRO 41 N -5.12 3.77 0.00 0.56 0.04 -1.26 -3.92 135.00 129.07 2yux s PRO 41 Ca 0.60 1.34 0.29 0.00 0.04 0.00 0.00 61.00 63.27 2yux s PRO 41 Cb -0.14 -2.09 1.18 0.00 0.04 0.00 0.00 34.50 33.49 2yux s PRO 41 CO 0.54 -0.45 1.85 1.63 0.04 0.00 0.00 177.00 180.61 2yux n LYS 42 N -1.05 0.42 -4.17 4.56 5.02 -1.26 -4.81 118.16 116.87 2yux n LYS 42 Ca 0.09 -0.12 -0.27 0.00 -2.02 0.00 0.00 58.31 55.99 2yux n LYS 42 Cb 0.53 -1.50 -0.07 0.00 -0.02 0.00 0.00 35.03 33.96 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 -2.66 4.93 0.00 4.39 2.15 -1.26 -5.00 116.67 119.22 2yux s ASP 43 Ca 0.24 -0.32 0.00 0.00 0.43 0.00 0.00 52.55 52.89 2yux s ASP 43 Cb 0.20 -1.11 0.00 0.00 -0.30 0.00 0.00 42.92 41.70 2yux s ASP 43 CO 0.51 0.10 0.00 -0.90 -0.17 0.00 0.00 175.17 174.71 2yux n ASP 44 N -0.07 0.00 0.00 -0.34 5.75 -1.26 -4.87 116.55 115.76 2yux n ASP 44 Ca -0.10 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.68 2yux n ASP 44 Cb 0.55 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.64 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 0.00 -2.07 0.38 6.12 0.00 -1.26 -4.91 105.19 103.45 2yux n GLY 45 Ca 0.00 0.70 -0.04 0.00 0.00 0.00 0.00 46.02 46.67 2yux n GLY 45 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2yux h ASN 46 N 0.00 -1.44 -2.96 1.61 2.35 -1.92 -3.04 115.58 110.18 2yux h ASN 46 Ca 0.00 0.28 -0.61 0.00 -0.55 0.00 0.00 56.30 55.42 2yux h ASN 46 Cb 0.00 0.72 -0.41 0.00 0.05 0.00 0.00 38.32 38.68 2yux h ASN 46 CO 0.00 -0.30 -0.68 0.00 -1.65 0.00 0.00 177.43 174.80 2yux s ALA 47 N -5.90 3.12 -0.16 -0.83 0.00 -1.26 -5.03 121.76 111.70 2yux s ALA 47 Ca -0.14 -3.42 -0.38 0.00 0.00 0.00 0.00 51.96 48.02 2yux s ALA 47 Cb 0.17 -2.01 -0.14 0.00 0.00 0.00 0.00 23.12 21.14 2yux s ALA 47 CO 0.69 -2.06 1.74 0.00 0.00 0.00 0.00 175.76 176.13 2yux n ALA 48 N 2.28 0.15 -1.57 0.00 0.00 -1.15 -4.73 120.51 115.49 2yux n ALA 48 Ca 0.22 0.37 -0.36 0.00 0.00 0.00 0.00 53.44 53.66 2yux n ALA 48 Cb 0.38 -2.30 0.08 0.00 0.00 0.00 0.00 19.45 17.61 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 4.51 4.11 -0.02 0.00 -0.00 -1.26 -4.53 119.36 122.18 2yux n ILE 49 Ca 0.24 -0.44 -0.04 0.00 -0.00 0.00 0.00 62.75 62.52 2yux n ILE 49 Cb 0.20 -1.36 -0.01 0.00 -0.00 0.00 0.00 39.64 38.46 2yux n ILE 49 CO 0.00 0.00 0.00 0.35 -0.00 0.00 0.00 176.55 176.90 2yux n THR 50 N -2.21 0.21 -2.85 1.39 -2.24 -1.18 -5.00 114.28 102.40 2yux n THR 50 Ca 0.15 -0.06 0.00 0.00 -2.27 0.00 0.00 64.05 61.87 2yux n THR 50 Cb 0.49 -1.22 0.00 0.00 -2.10 0.00 0.00 70.33 67.49 2yux n THR 50 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2yux n GLY 51 N 2.96 2.56 2.98 3.38 0.00 -1.25 -4.77 105.19 111.05 2yux n GLY 51 Ca -0.07 -1.02 -0.13 0.00 0.00 0.00 0.00 46.02 44.79 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 -6.54 -0.25 0.19 1.61 1.51 -1.22 -1.81 117.35 110.83 2yux s TYR 52 Ca 0.00 0.65 -0.12 0.00 -1.01 0.00 0.00 57.07 56.60 2yux s TYR 52 Cb 0.00 -0.04 -0.07 0.00 -0.11 0.00 0.00 41.96 41.74 2yux s TYR 52 CO 0.00 -0.22 0.54 0.99 -1.11 0.00 0.00 175.55 175.76 2yux s THR 53 N 1.39 4.91 0.08 -0.71 2.01 -1.26 -3.28 115.64 118.77 2yux s THR 53 Ca -0.08 0.62 0.06 0.00 0.31 0.00 0.00 61.69 62.61 2yux s THR 53 Cb -0.11 -3.67 -0.03 0.00 0.01 0.00 0.00 72.50 68.70 2yux s THR 53 CO -0.07 0.08 -0.16 -0.63 -0.69 0.00 0.00 174.62 173.15 2yux s ILE 54 N -1.65 1.26 0.05 1.82 1.09 -1.19 -1.24 121.20 121.35 2yux s ILE 54 Ca 0.43 -1.34 -0.09 0.00 -1.10 0.00 0.00 60.65 58.54 2yux s ILE 54 Cb -0.13 -1.18 0.00 0.00 -1.06 0.00 0.00 42.46 40.09 2yux s ILE 54 CO 0.20 -0.17 0.19 -1.10 -0.10 0.00 0.00 174.94 173.97 2yux s GLN 55 N -1.74 0.74 0.16 2.79 -0.21 -1.12 -1.52 119.66 118.76 2yux s GLN 55 Ca 0.00 -0.72 0.09 0.00 0.02 0.00 0.00 55.36 54.75 2yux s GLN 55 Cb -0.10 0.30 -0.04 0.00 1.00 0.00 0.00 33.01 34.17 2yux s GLN 55 CO 0.03 -0.22 -0.19 -1.59 -2.12 0.00 0.00 175.29 171.20 2yux s LYS 56 N -2.94 1.28 -0.27 2.91 -2.85 -1.26 -1.37 119.74 115.24 2yux s LYS 56 Ca -0.02 -1.39 -0.03 0.00 -1.00 0.00 0.00 55.97 53.53 2yux s LYS 56 Cb 0.01 -1.38 0.16 0.00 -2.06 0.00 0.00 37.83 34.56 2yux s LYS 56 CO -0.06 0.28 0.51 0.00 0.10 0.00 0.00 175.35 176.19 2yux s ALA 57 N -1.93 -1.74 1.10 0.59 0.00 -1.22 -4.01 121.76 114.55 2yux s ALA 57 Ca 0.15 1.54 -0.16 0.00 0.00 0.00 0.00 51.96 53.49 2yux s ALA 57 Cb -0.06 -1.89 0.13 0.00 0.00 0.00 0.00 23.12 21.30 2yux s ALA 57 CO 0.07 -1.22 0.31 -0.25 0.00 0.00 0.00 175.76 174.66 2yux n ASP 58 N 5.41 -2.11 -1.49 0.00 8.00 -1.26 -0.99 116.55 124.10 2yux n ASP 58 Ca -0.04 -0.04 -0.04 0.00 0.71 0.00 0.00 54.79 55.39 2yux n ASP 58 Cb 0.50 -1.08 0.18 0.00 -0.02 0.00 0.00 41.12 40.71 2yux n ASP 58 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 2yux n LYS 59 N -2.65 2.59 -0.08 -1.24 4.76 -1.10 -0.89 118.16 119.54 2yux n LYS 59 Ca 0.02 -1.80 -0.18 0.00 -2.87 0.00 0.00 58.31 53.49 2yux n LYS 59 Cb 0.59 -1.83 -0.06 0.00 -1.84 0.00 0.00 35.03 31.89 2yux n LYS 59 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 2yux n LYS 60 N -0.00 0.35 0.00 1.97 4.01 -1.26 -4.79 118.16 118.44 2yux n LYS 60 Ca 0.24 0.15 0.00 0.00 -0.51 0.00 0.00 58.31 58.20 2yux n LYS 60 Cb 0.97 -1.09 0.00 0.00 -0.51 0.00 0.00 35.03 34.40 2yux n LYS 60 CO 0.00 0.00 0.00 0.45 -1.11 0.00 0.00 177.40 176.74 2yux n SER 61 N -3.72 1.02 -2.20 4.39 2.88 -1.25 -4.99 113.62 109.74 2yux n SER 61 Ca -0.32 -0.38 -0.06 0.00 -1.33 0.00 0.00 58.87 56.78 2yux n SER 61 Cb 0.73 0.96 -0.01 0.00 -0.75 0.00 0.00 64.21 65.14 2yux n SER 61 CO 0.00 0.00 0.00 1.15 -1.23 0.00 0.00 175.04 174.96 2yux n MET 62 N -1.06 -2.33 -2.48 -1.46 0.00 -0.07 -4.85 117.12 104.86 2yux n MET 62 Ca 0.00 0.28 -0.42 0.00 0.00 0.00 0.00 57.70 57.56 2yux n MET 62 Cb 0.00 -4.74 -0.03 0.00 0.00 0.00 0.00 33.22 28.45 2yux n MET 62 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 175.97 174.76 2yux s GLU 63 N -4.49 4.47 -0.26 3.17 2.02 -1.26 -4.86 118.70 117.49 2yux s GLU 63 Ca 0.00 1.70 -0.17 0.00 0.02 0.00 0.00 54.97 56.52 2yux s GLU 63 Cb 0.00 -3.36 -0.03 0.00 0.10 0.00 0.00 34.13 30.84 2yux s GLU 63 CO 0.00 -0.18 0.47 -1.58 0.02 0.00 0.00 175.26 173.99 2yux s TRP 64 N 0.92 3.26 0.00 1.61 0.52 -1.26 -4.24 118.94 119.75 2yux s TRP 64 Ca 0.56 0.57 -0.00 0.00 0.02 0.00 0.00 56.10 57.25 2yux s TRP 64 Cb -0.28 -2.68 -0.00 0.00 -1.15 0.00 0.00 33.47 29.36 2yux s TRP 64 CO 0.30 -0.27 -0.01 0.34 0.02 0.00 0.00 176.95 177.33 2yux n PHE 65 N 5.48 0.00 0.00 -1.98 7.35 -1.26 -5.07 117.46 121.99 2yux n PHE 65 Ca -0.05 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.64 2yux n PHE 65 Cb 0.50 -0.01 0.00 0.00 0.35 0.00 0.00 39.48 40.32 2yux n PHE 65 CO 0.00 0.00 0.00 2.41 -0.76 0.00 0.00 176.76 178.41 2yux n THR 66 N -2.56 0.00 0.00 -2.13 -1.04 -1.26 -5.03 114.28 102.26 2yux n THR 66 Ca -0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 2yux n THR 66 Cb 0.01 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.52 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 -0.68 0.00 -3.75 12.58 0.31 -0.58 -4.67 118.33 121.55 2yux n VAL 67 Ca 0.00 0.00 -0.09 0.00 -0.01 0.00 0.00 64.34 64.24 2yux n VAL 67 Cb 0.00 -0.74 -0.03 0.00 -0.91 0.00 0.00 33.84 32.16 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 -1.85 0.02 0.02 2.52 -1.16 -0.79 -4.98 121.20 114.98 2yux s ILE 68 Ca 0.00 -0.80 -0.03 0.00 -0.51 0.00 0.00 60.65 59.31 2yux s ILE 68 Cb 0.00 -1.63 -0.01 0.00 0.61 0.00 0.00 42.46 41.42 2yux s ILE 68 CO 0.00 -0.09 0.04 -1.61 -2.81 0.00 0.00 174.94 170.48 2yux s GLU 69 N -3.88 0.43 -0.18 3.50 2.02 -1.26 -3.17 118.70 116.16 2yux s GLU 69 Ca 0.10 -0.61 -0.16 0.00 0.02 0.00 0.00 54.97 54.31 2yux s GLU 69 Cb -0.02 0.16 0.02 0.00 0.10 0.00 0.00 34.13 34.40 2yux s GLU 69 CO -0.01 -0.09 0.27 -2.39 0.02 0.00 0.00 175.26 173.05 2yux n HIS 70 N 1.31 -1.07 -3.70 1.61 1.44 -1.26 -4.97 115.22 108.57 2yux n HIS 70 Ca -0.22 0.45 -0.07 0.00 -2.01 0.00 0.00 57.72 55.87 2yux n HIS 70 Cb 0.56 -1.28 -0.00 0.00 0.12 0.00 0.00 29.99 29.39 2yux n HIS 70 CO 0.00 0.00 0.00 0.98 -2.81 0.00 0.00 176.34 174.51 2yux n TYR 71 N 0.69 -1.00 0.00 -1.40 9.36 -1.21 -4.86 117.16 118.74 2yux n TYR 71 Ca -0.04 -0.60 0.00 0.00 3.32 0.00 0.00 57.90 60.58 2yux n TYR 71 Cb 0.57 -0.11 0.00 0.00 -0.63 0.00 0.00 39.34 39.17 2yux n TYR 71 CO 0.00 0.00 0.00 0.72 0.22 0.00 0.00 176.86 177.80 2yux n HIS 72 N -0.74 0.00 -0.61 2.98 8.25 -1.26 -3.46 115.22 120.37 2yux n HIS 72 Ca -0.01 0.00 -0.21 0.00 -0.26 0.00 0.00 57.72 57.24 2yux n HIS 72 Cb 0.16 0.25 0.13 0.00 1.12 0.00 0.00 29.99 31.65 2yux n HIS 72 CO 0.00 0.00 0.00 -2.13 0.64 0.00 0.00 176.34 174.85 2yux n ARG 73 N -2.08 -1.76 -0.22 -0.41 3.00 -1.26 -4.79 116.66 109.14 2yux n ARG 73 Ca 0.00 -0.52 0.06 0.00 -0.00 0.00 0.00 57.85 57.39 2yux n ARG 73 Cb 0.00 -1.43 0.17 0.00 0.00 0.00 0.00 32.46 31.21 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 -4.21 1.16 -3.88 5.15 -2.24 -1.26 -4.84 114.28 104.16 2yux n THR 74 Ca 0.04 -1.10 -0.12 0.00 -2.27 0.00 0.00 64.05 60.60 2yux n THR 74 Cb 0.41 0.41 -0.13 0.00 -2.10 0.00 0.00 70.33 68.92 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 -1.10 0.00 -0.08 3.42 1.04 -1.26 -2.09 113.70 113.63 2yux s SER 75 Ca 0.27 -0.03 -0.12 0.00 0.48 0.00 0.00 55.95 56.54 2yux s SER 75 Cb 0.15 0.11 0.03 0.00 0.10 0.00 0.00 66.02 66.41 2yux s SER 75 CO 0.16 -0.09 0.32 0.00 0.98 0.00 0.00 173.24 174.60 2yux s ALA 76 N -0.34 -0.79 -0.20 5.32 0.00 -1.25 -5.01 121.76 119.49 2yux s ALA 76 Ca -0.04 0.69 -0.17 0.00 0.00 0.00 0.00 51.96 52.44 2yux s ALA 76 Cb -0.03 -0.31 -0.04 0.00 0.00 0.00 0.00 23.12 22.75 2yux s ALA 76 CO -0.00 -0.19 0.45 0.99 0.00 0.00 0.00 175.76 177.01 2yux s THR 77 N -0.38 5.16 0.02 0.00 2.01 -1.26 -3.25 115.64 117.95 2yux s THR 77 Ca -0.05 0.82 -0.18 0.00 0.31 0.00 0.00 61.69 62.59 2yux s THR 77 Cb -0.03 -3.78 -0.06 0.00 0.01 0.00 0.00 72.50 68.63 2yux s THR 77 CO 0.02 0.22 0.52 -0.63 -0.69 0.00 0.00 174.62 174.06 2yux s ILE 78 N 1.42 4.88 0.51 1.82 -1.09 -0.87 -4.89 121.20 122.99 2yux s ILE 78 Ca 0.21 1.10 0.02 0.00 -2.23 0.00 0.00 60.65 59.75 2yux s ILE 78 Cb -0.15 -3.85 -0.01 0.00 -1.58 0.00 0.00 42.46 36.88 2yux s ILE 78 CO 0.09 0.52 0.06 0.42 -1.23 0.00 0.00 174.94 174.80 2yux s THR 79 N -0.81 1.26 -0.96 2.92 -4.23 -1.26 -2.15 115.64 110.41 2yux s THR 79 Ca 0.28 -1.93 -0.05 0.00 -1.18 0.00 0.00 61.69 58.81 2yux s THR 79 Cb -0.18 -2.19 -0.06 0.00 1.34 0.00 0.00 72.50 71.41 2yux s THR 79 CO 0.16 0.00 0.84 -0.62 -0.54 0.00 0.00 174.62 174.47 2yux n GLU 80 N -1.33 -2.04 -5.15 3.99 1.02 -1.25 -5.02 120.64 110.87 2yux n GLU 80 Ca -0.16 0.84 -0.30 0.00 -0.02 0.00 0.00 57.16 57.52 2yux n GLU 80 Cb 0.67 -5.52 -0.16 0.00 -0.02 0.00 0.00 31.44 26.40 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 -5.14 2.03 -0.08 -4.62 1.43 -1.26 -5.12 118.68 105.92 2yux s LEU 81 Ca 0.40 -0.46 -0.18 0.00 -1.03 0.00 0.00 54.13 52.86 2yux s LEU 81 Cb -0.05 -1.25 -0.05 0.00 0.03 0.00 0.00 46.19 44.87 2yux s LEU 81 CO 0.69 0.23 0.49 -0.69 0.23 0.00 0.00 176.35 177.29 2yux s VAL 82 N -0.18 5.11 0.24 -1.59 1.01 -1.26 -4.64 120.40 119.09 2yux s VAL 82 Ca -0.02 0.99 -0.30 0.00 0.00 0.00 0.00 61.98 62.66 2yux s VAL 82 Cb -0.12 -3.82 -0.09 0.00 0.00 0.00 0.00 36.38 32.35 2yux s VAL 82 CO 0.03 0.39 1.07 -0.63 0.00 0.00 0.00 175.10 175.95 2yux s ILE 83 N 0.18 3.73 0.00 2.22 1.01 -1.26 -3.76 121.20 123.31 2yux s ILE 83 Ca 0.26 1.66 0.00 0.00 0.00 0.00 0.00 60.65 62.57 2yux s ILE 83 Cb -0.16 -4.06 0.00 0.00 0.01 0.00 0.00 42.46 38.25 2yux s ILE 83 CO 0.12 0.36 0.00 0.61 0.00 0.00 0.00 174.94 176.03 2yux n GLY 84 N 1.52 1.69 3.55 6.18 0.00 -1.22 -4.99 105.19 111.92 2yux n GLY 84 Ca -0.00 -0.15 -0.08 0.00 0.00 0.00 0.00 46.02 45.78 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 -2.17 -0.38 0.33 1.61 0.01 -1.25 -5.02 114.94 108.06 2yux s ASN 85 Ca 0.00 -0.11 0.09 0.00 -0.71 0.00 0.00 52.86 52.13 2yux s ASN 85 Cb 0.00 0.49 -0.05 0.00 0.41 0.00 0.00 41.25 42.09 2yux s ASN 85 CO 0.00 -0.82 0.00 -1.83 -1.51 0.00 0.00 177.10 172.94 2yux s GLU 86 N -3.38 2.08 0.21 -0.60 1.03 -1.26 -0.22 118.70 116.57 2yux s GLU 86 Ca 0.06 -1.71 -0.09 0.00 0.03 0.00 0.00 54.97 53.25 2yux s GLU 86 Cb -0.01 -1.95 -0.01 0.00 -0.80 0.00 0.00 34.13 31.36 2yux s GLU 86 CO -0.07 0.17 0.35 0.71 -1.33 0.00 0.00 175.26 175.09 2yux s TYR 87 N -2.50 0.51 0.30 4.83 1.51 0.14 -2.71 117.35 119.43 2yux s TYR 87 Ca 0.34 -0.84 0.03 0.00 -1.01 0.00 0.00 57.07 55.59 2yux s TYR 87 Cb -0.01 -0.03 0.03 0.00 -0.11 0.00 0.00 41.96 41.84 2yux s TYR 87 CO 0.19 -0.83 0.25 0.66 -1.11 0.00 0.00 175.55 174.71 2yux n TYR 88 N -0.30 -1.21 -3.53 2.71 4.01 -0.16 -0.74 117.16 117.94 2yux n TYR 88 Ca -0.03 -1.24 -0.16 0.00 -0.16 0.00 0.00 57.90 56.30 2yux n TYR 88 Cb 0.63 -0.25 -0.06 0.00 -0.31 0.00 0.00 39.34 39.35 2yux n TYR 88 CO 0.00 0.00 0.00 -0.06 -0.46 0.00 0.00 176.86 176.34 2yux s PHE 89 N -1.40 -0.60 0.14 -0.72 0.08 -1.26 -3.44 117.98 110.78 2yux s PHE 89 Ca 0.19 1.01 0.05 0.00 0.12 0.00 0.00 56.93 58.30 2yux s PHE 89 Cb -0.01 0.42 -0.04 0.00 -0.57 0.00 0.00 43.02 42.82 2yux s PHE 89 CO 0.12 -0.57 -0.11 1.03 -0.10 0.00 0.00 175.22 175.59 2yux s ARG 90 N -1.26 1.05 -0.27 0.44 0.52 -0.47 -3.42 118.95 115.53 2yux s ARG 90 Ca -0.09 -1.38 -0.02 0.00 -0.52 0.00 0.00 55.73 53.72 2yux s ARG 90 Cb -0.00 -0.70 0.12 0.00 0.52 0.00 0.00 34.95 34.88 2yux s ARG 90 CO 0.08 0.10 0.24 0.08 0.02 0.00 0.00 175.30 175.82 2yux s VAL 91 N -2.96 -0.32 0.26 3.52 1.01 -1.26 -2.78 120.40 117.89 2yux s VAL 91 Ca 0.14 -0.45 -0.04 0.00 0.00 0.00 0.00 61.98 61.63 2yux s VAL 91 Cb 0.00 -0.91 0.06 0.00 0.00 0.00 0.00 36.38 35.53 2yux s VAL 91 CO 0.01 -0.46 0.36 0.49 0.00 0.00 0.00 175.10 175.51 2yux n PHE 92 N 5.30 -3.97 -3.65 5.22 3.72 -0.37 -3.98 117.46 119.72 2yux n PHE 92 Ca -0.04 -0.32 -0.29 0.00 -0.05 0.00 0.00 57.45 56.75 2yux n PHE 92 Cb 0.46 -0.27 -0.13 0.00 -0.94 0.00 0.00 39.48 38.60 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 -2.31 3.55 0.48 4.37 0.01 -1.26 -4.13 113.70 114.41 2yux s SER 93 Ca 0.20 -2.35 -0.24 0.00 1.31 0.00 0.00 55.95 54.87 2yux s SER 93 Cb -0.01 -0.85 -0.07 0.00 0.21 0.00 0.00 66.02 65.30 2yux s SER 93 CO 0.14 -0.30 1.42 -1.61 0.41 0.00 0.00 173.24 173.29 2yux s GLU 94 N 0.74 3.52 -0.22 12.44 0.41 -0.75 -3.78 118.70 131.07 2yux s GLU 94 Ca 0.16 2.38 -0.29 0.00 -0.41 0.00 0.00 54.97 56.82 2yux s GLU 94 Cb -0.23 -2.54 0.15 0.00 -1.78 0.00 0.00 34.13 29.73 2yux s GLU 94 CO -0.04 -0.94 1.15 0.54 -0.49 0.00 0.00 175.26 175.49 2yux s ASN 95 N -0.61 -0.24 0.44 -0.19 2.20 -1.26 -3.11 114.94 112.16 2yux s ASN 95 Ca 0.64 0.29 0.32 0.00 -0.94 0.00 0.00 52.86 53.17 2yux s ASN 95 Cb -0.43 0.23 1.49 0.00 -2.00 0.00 0.00 41.25 40.55 2yux s ASN 95 CO 0.54 -0.20 1.57 1.15 -2.94 0.00 0.00 177.10 177.22 2yux n MET 96 N 0.80 -0.04 0.00 3.55 0.00 -1.26 -1.05 117.12 119.12 2yux n MET 96 Ca -0.07 1.27 0.00 0.00 0.00 0.00 0.00 57.70 58.90 2yux n MET 96 Cb 0.58 -2.49 0.00 0.00 0.00 0.00 0.00 33.22 31.31 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 -0.03 2.53 3.08 0.00 0.00 -0.22 -5.15 105.19 105.40 2yux n GLY 98 Ca 0.00 -0.24 -0.36 0.00 0.00 0.00 0.00 46.02 45.42 2yux n GLY 98 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2yux n LEU 99 N 0.00 -4.03 -4.72 0.99 4.32 -1.26 -4.61 117.00 107.69 2yux n LEU 99 Ca 0.00 0.12 -0.41 0.00 -0.02 0.00 0.00 56.01 55.70 2yux n LEU 99 Cb 0.00 -0.76 -0.04 0.00 -1.62 0.00 0.00 43.42 41.00 2yux n LEU 99 CO 0.00 -4.43 0.61 -0.94 -1.22 0.00 0.00 177.39 171.40 2yux s SER 100 N -1.22 7.34 0.29 -1.43 1.04 -1.25 -4.90 113.70 113.57 2yux s SER 100 Ca 0.43 1.61 0.03 0.00 0.48 0.00 0.00 55.95 58.50 2yux s SER 100 Cb -0.10 -2.54 0.70 0.00 0.10 0.00 0.00 66.02 64.18 2yux s SER 100 CO 0.74 -0.13 1.73 -0.33 0.98 0.00 0.00 173.24 176.23 2yux h GLU 101 N 6.21 0.50 -6.56 4.02 5.08 -1.97 -3.41 114.58 118.45 2yux h GLU 101 Ca -0.42 -0.03 -0.65 0.00 -1.00 0.00 0.00 59.36 57.26 2yux h GLU 101 Cb 1.21 -0.11 -0.17 0.00 0.50 0.00 0.00 28.75 30.18 2yux h GLU 101 CO 0.73 0.33 -0.78 0.16 -1.00 0.00 0.00 179.01 178.45 2yux s ASP 102 N -5.27 3.82 0.03 1.42 1.47 -1.26 -5.14 116.67 111.74 2yux s ASP 102 Ca -0.12 -0.71 0.04 0.00 1.18 0.00 0.00 52.55 52.95 2yux s ASP 102 Cb 0.24 -0.48 -0.02 0.00 -0.34 0.00 0.00 42.92 42.33 2yux s ASP 102 CO 0.78 0.12 -0.12 0.00 0.68 0.00 0.00 175.17 176.63 2yux s ALA 103 N -1.61 1.03 -0.71 2.11 0.00 -1.26 -4.52 121.76 116.79 2yux s ALA 103 Ca 0.22 -0.74 -0.26 0.00 0.00 0.00 0.00 51.96 51.18 2yux s ALA 103 Cb -0.09 -0.16 -0.02 0.00 0.00 0.00 0.00 23.12 22.86 2yux s ALA 103 CO 0.12 0.19 1.77 0.99 0.00 0.00 0.00 175.76 178.83 2yux s THR 104 N -0.79 3.45 0.21 0.00 2.01 -1.26 -4.76 115.64 114.50 2yux s THR 104 Ca 0.01 0.07 -0.27 0.00 0.31 0.00 0.00 61.69 61.81 2yux s THR 104 Cb -0.07 -4.15 -0.08 0.00 0.01 0.00 0.00 72.50 68.20 2yux s THR 104 CO 0.01 -1.11 0.84 -0.32 -0.69 0.00 0.00 174.62 173.35 2yux s MET 105 N 6.74 4.65 -0.50 4.92 0.00 -1.26 -4.30 119.30 129.55 2yux s MET 105 Ca 0.62 1.26 -0.47 0.00 0.00 0.00 0.00 55.69 57.11 2yux s MET 105 Cb -0.10 -3.21 -0.20 0.00 0.00 0.00 0.00 34.83 31.32 2yux s MET 105 CO 0.14 0.52 1.61 0.25 0.00 0.00 0.00 175.02 177.54 2yux n THR 106 N 1.43 0.00 -0.68 10.11 -2.24 -1.22 -4.66 114.28 117.02 2yux n THR 106 Ca -0.04 0.00 0.52 0.00 -2.27 0.00 0.00 64.05 62.26 2yux n THR 106 Cb 0.48 -0.50 0.80 0.00 -2.10 0.00 0.00 70.33 69.01 2yux n THR 106 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2yux n LYS 107 N 4.09 -0.00 -3.02 -0.78 4.76 -1.26 -4.43 118.16 117.52 2yux n LYS 107 Ca 0.32 1.09 -0.11 0.00 -2.87 0.00 0.00 58.31 56.73 2yux n LYS 107 Cb -0.06 -2.47 -0.03 0.00 -1.84 0.00 0.00 35.03 30.63 2yux n LYS 107 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 2yux n GLU 108 N -3.97 0.86 -3.90 1.97 1.02 -1.26 -5.17 120.64 110.19 2yux n GLU 108 Ca 0.44 -1.46 -0.21 0.00 -0.02 0.00 0.00 57.16 55.90 2yux n GLU 108 Cb 1.95 0.75 -0.04 0.00 -0.02 0.00 0.00 31.44 34.08 2yux n GLU 108 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2yux s SER 109 N -2.06 5.35 -0.21 1.62 0.15 -1.26 -4.87 113.70 112.41 2yux s SER 109 Ca 0.08 -0.43 -0.06 0.00 0.70 0.00 0.00 55.95 56.23 2yux s SER 109 Cb 0.00 -1.09 -0.03 0.00 -1.71 0.00 0.00 66.02 63.20 2yux s SER 109 CO 0.05 -0.27 0.04 0.00 1.20 0.00 0.00 173.24 174.27 2yux s ALA 110 N -2.26 3.16 -0.15 5.45 0.00 0.08 -4.90 121.76 123.14 2yux s ALA 110 Ca 0.39 -0.99 -0.19 0.00 0.00 0.00 0.00 51.96 51.17 2yux s ALA 110 Cb -0.06 -1.92 -0.04 0.00 0.00 0.00 0.00 23.12 21.10 2yux s ALA 110 CO 0.26 -0.20 0.52 0.08 0.00 0.00 0.00 175.76 176.42 2yux s VAL 111 N 1.08 5.14 0.35 0.00 1.01 -1.26 -0.69 120.40 126.03 2yux s VAL 111 Ca 0.03 1.00 -0.19 0.00 0.00 0.00 0.00 61.98 62.83 2yux s VAL 111 Cb -0.14 -3.85 -0.10 0.00 0.00 0.00 0.00 36.38 32.29 2yux s VAL 111 CO 0.03 0.25 0.82 -0.63 0.00 0.00 0.00 175.10 175.57 2yux s ILE 112 N 1.07 4.53 -0.27 2.22 -1.09 0.70 -4.87 121.20 123.49 2yux s ILE 112 Ca 0.26 1.25 -0.32 0.00 -2.23 0.00 0.00 60.65 59.61 2yux s ILE 112 Cb -0.15 -3.67 0.17 0.00 -1.58 0.00 0.00 42.46 37.23 2yux s ILE 112 CO 0.11 -0.15 1.32 0.00 -1.23 0.00 0.00 174.94 174.98 2yux s ALA 113 N -1.96 -2.12 -0.26 9.38 0.00 -1.25 -3.37 121.76 122.18 2yux s ALA 113 Ca 0.55 1.84 -0.02 0.00 0.00 0.00 0.00 51.96 54.33 2yux s ALA 113 Cb -0.11 -1.07 0.09 0.00 0.00 0.00 0.00 23.12 22.03 2yux s ALA 113 CO 0.17 -0.35 2.37 -2.13 0.00 0.00 0.00 175.76 175.82 2yux n ARG 114 N 0.35 1.83 -3.69 0.00 0.63 -1.26 -0.16 116.66 114.36 2yux n ARG 114 Ca 0.00 -1.42 -0.14 0.00 -0.92 0.00 0.00 57.85 55.37 2yux n ARG 114 Cb 0.58 -1.68 -0.08 0.00 0.45 0.00 0.00 32.46 31.73 2yux n ARG 114 CO 0.00 0.00 0.00 0.34 -2.51 0.00 0.00 177.63 175.46 2yux s ASP 115 N 0.73 -0.39 0.00 6.15 2.15 -1.26 -4.78 116.67 119.26 2yux s ASP 115 Ca 0.36 0.49 0.00 0.00 0.43 0.00 0.00 52.55 53.84 2yux s ASP 115 Cb 0.24 0.56 0.00 0.00 -0.30 0.00 0.00 42.92 43.42 2yux s ASP 115 CO -0.05 -0.41 0.00 0.61 -0.17 0.00 0.00 175.17 175.15 2yux n GLY 116 N 1.63 3.55 0.57 2.66 0.00 -1.26 -4.63 105.19 107.70 2yux n GLY 116 Ca -0.19 -0.37 0.04 0.00 0.00 0.00 0.00 46.02 45.50 2yux n GLY 116 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2yux n LYS 117 N 0.00 -1.39 0.00 1.61 0.00 -1.26 -5.03 118.16 112.08 2yux n LYS 117 Ca 0.00 1.11 0.00 0.00 0.00 0.00 0.00 58.31 59.42 2yux n LYS 117 Cb 0.00 -1.50 0.00 0.00 0.00 0.00 0.00 35.03 33.53 2yux n LYS 117 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.40 176.51 2yux n ILE 118 N -2.50 0.00 -1.47 3.15 5.41 -1.26 -5.05 119.36 117.64 2yux n ILE 118 Ca -0.02 0.00 0.03 0.00 1.00 0.00 0.00 62.75 63.76 2yux n ILE 118 Cb 0.23 0.00 0.04 0.00 -0.71 0.00 0.00 39.64 39.20 2yux n ILE 118 CO 0.00 0.00 0.00 -1.22 0.00 0.00 0.00 176.55 175.33 2yux n TYR 119 N 0.00 0.00 -1.47 1.39 4.02 -1.26 -5.30 117.16 114.54 2yux n TYR 119 Ca 0.00 -0.32 0.00 0.00 -0.01 0.00 0.00 57.90 57.57 2yux n TYR 119 Cb 0.00 -0.07 0.00 0.00 -0.02 0.00 0.00 39.34 39.25 2yux n TYR 119 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 176.86 177.48