#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yu9 n THR 3 N 0.00 -9.75 -4.44 12.58 -1.04 -1.26 -4.87 114.28 105.50 2yu9 n THR 3 Ca 0.00 2.19 -0.30 0.00 -2.04 0.00 0.00 64.05 63.90 2yu9 n THR 3 Cb 0.00 -5.14 -0.12 0.00 -1.82 0.00 0.00 70.33 63.26 2yu9 n THR 3 CO 0.00 0.00 0.00 0.72 -0.64 0.00 0.00 175.07 175.15 2yu9 s PHE 4 N -0.46 2.53 0.44 -1.42 -0.12 -1.26 -4.94 117.98 112.75 2yu9 s PHE 4 Ca -0.10 -0.27 0.03 0.00 -0.05 0.00 0.00 56.93 56.54 2yu9 s PHE 4 Cb 0.01 -1.39 0.03 0.00 -0.63 0.00 0.00 43.02 41.04 2yu9 s PHE 4 CO 0.28 0.33 0.21 0.54 -0.05 0.00 0.00 175.22 176.53 2yu9 n ARG 5 N 1.09 0.88 -4.46 1.99 1.74 -1.26 -5.07 116.66 111.58 2yu9 n ARG 5 Ca -0.16 -2.91 -0.23 0.00 -0.77 0.00 0.00 57.85 53.79 2yu9 n ARG 5 Cb 0.52 0.49 -0.10 0.00 -1.02 0.00 0.00 32.46 32.35 2yu9 n ARG 5 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 2yu9 s PHE 6 N -2.34 2.09 0.71 -1.55 0.40 -1.26 -2.94 117.98 113.09 2yu9 s PHE 6 Ca 0.16 -0.61 -0.14 0.00 -0.60 0.00 0.00 56.93 55.74 2yu9 s PHE 6 Cb -0.01 -1.16 0.03 0.00 0.51 0.00 0.00 43.02 42.38 2yu9 s PHE 6 CO 0.10 0.40 1.14 0.00 0.70 0.00 0.00 175.22 177.56 2yu9 h ARG 8 N -0.32 0.29 0.05 0.00 2.43 -1.99 -3.37 114.38 111.47 2yu9 h ARG 8 Ca -0.46 -0.50 -0.37 0.00 -0.81 0.00 0.00 59.98 57.84 2yu9 h ARG 8 Cb 1.26 0.18 -0.05 0.00 -0.42 0.00 0.00 29.97 30.95 2yu9 h ARG 8 CO 0.51 1.24 -2.15 -0.25 -1.51 0.00 0.00 179.97 177.81 2yu9 n ASP 9 N -3.59 2.02 -0.24 -3.80 8.00 -1.26 -4.59 116.55 113.10 2yu9 n ASP 9 Ca -0.30 0.13 0.08 0.00 0.71 0.00 0.00 54.79 55.41 2yu9 n ASP 9 Cb 1.03 -0.71 -0.04 0.00 -0.02 0.00 0.00 41.12 41.39 2yu9 n ASP 9 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2yu9 n ASN 11 N -0.60 -7.06 -3.49 0.00 5.15 -1.26 -5.05 115.26 102.95 2yu9 n ASN 11 Ca 0.05 0.74 -0.12 0.00 -0.60 0.00 0.00 54.58 54.65 2yu9 n ASN 11 Cb 0.32 -2.89 -0.03 0.00 -0.53 0.00 0.00 39.78 36.64 2yu9 n ASN 11 CO 0.00 0.00 0.00 0.21 1.40 0.00 0.00 177.26 178.87 2yu9 s ASN 12 N -1.24 -0.52 0.37 1.20 3.84 -1.26 -4.93 114.94 112.39 2yu9 s ASN 12 Ca 0.01 0.24 -0.28 0.00 0.21 0.00 0.00 52.86 53.04 2yu9 s ASN 12 Cb -0.00 0.49 -0.11 0.00 -0.55 0.00 0.00 41.25 41.08 2yu9 s ASN 12 CO 0.29 -0.71 1.44 -0.32 -2.79 0.00 0.00 177.10 175.01 2yu9 s MET 13 N -2.58 4.17 0.03 0.43 -2.45 -1.26 -1.27 119.30 116.38 2yu9 s MET 13 Ca -0.02 2.47 -0.17 0.00 -1.25 0.00 0.00 55.69 56.73 2yu9 s MET 13 Cb -0.01 -2.99 -0.06 0.00 1.25 0.00 0.00 34.83 33.02 2yu9 s MET 13 CO -0.04 -0.44 0.48 -0.51 1.05 0.00 0.00 175.02 175.56 2yu9 s LEU 14 N -2.02 4.50 -0.07 4.11 1.43 -1.15 -4.72 118.68 120.75 2yu9 s LEU 14 Ca 0.52 1.10 0.03 0.00 -1.03 0.00 0.00 54.13 54.74 2yu9 s LEU 14 Cb -0.45 -2.73 -0.02 0.00 0.03 0.00 0.00 46.19 43.02 2yu9 s LEU 14 CO 0.60 0.30 -0.16 -0.31 0.23 0.00 0.00 176.35 177.02 2yu9 s TYR 15 N -1.10 2.69 0.59 0.29 1.51 0.03 -4.86 117.35 116.50 2yu9 s TYR 15 Ca 0.26 -0.38 -0.11 0.00 -1.01 0.00 0.00 57.07 55.84 2yu9 s TYR 15 Cb -0.18 -1.68 -0.04 0.00 -0.11 0.00 0.00 41.96 39.95 2yu9 s TYR 15 CO 0.16 0.01 0.99 -1.25 -1.11 0.00 0.00 175.55 174.36 2yu9 s PRO 16 N -0.35 3.63 0.08 -1.71 0.04 -1.26 -0.70 135.00 134.73 2yu9 s PRO 16 Ca 0.03 0.71 -0.26 0.00 0.04 0.00 0.00 61.00 61.52 2yu9 s PRO 16 Cb -0.12 -2.12 0.07 0.00 0.04 0.00 0.00 34.50 32.37 2yu9 s PRO 16 CO 0.02 -0.49 0.65 0.50 0.04 0.00 0.00 177.00 177.73 2yu9 s ARG 17 N -4.99 1.17 -0.14 4.56 3.00 0.20 -4.90 118.95 117.84 2yu9 s ARG 17 Ca 0.55 -0.23 -0.07 0.00 -1.00 0.00 0.00 55.73 54.98 2yu9 s ARG 17 Cb -0.11 0.54 -0.04 0.00 0.00 0.00 0.00 34.95 35.34 2yu9 s ARG 17 CO 0.50 -0.47 0.12 -2.00 0.00 0.00 0.00 175.30 173.45 2yu9 s GLU 18 N -2.88 3.63 0.30 5.12 2.12 -1.26 -0.73 118.70 125.01 2yu9 s GLU 18 Ca -0.02 -0.20 0.11 0.00 0.36 0.00 0.00 54.97 55.22 2yu9 s GLU 18 Cb -0.01 -3.21 0.47 0.00 0.26 0.00 0.00 34.13 31.64 2yu9 s GLU 18 CO -0.06 0.61 1.68 0.22 -0.54 0.00 0.00 175.26 177.17 2yu9 h ASP 19 N 5.58 0.00 0.00 -1.70 1.82 -1.79 -3.48 116.42 116.86 2yu9 h ASP 19 Ca -0.49 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.15 2yu9 h ASP 19 Cb 1.20 0.00 0.00 0.00 0.68 0.00 0.00 39.33 41.21 2yu9 h ASP 19 CO 0.63 0.54 0.00 0.29 -1.61 0.00 0.00 179.24 179.10 2yu9 n LYS 20 N -3.88 0.00 -0.04 0.28 5.02 -1.26 -4.44 118.16 113.83 2yu9 n LYS 20 Ca -0.01 0.00 -0.12 0.00 -2.02 0.00 0.00 58.31 56.15 2yu9 n LYS 20 Cb 0.55 0.00 -0.11 0.00 -0.02 0.00 0.00 35.03 35.45 2yu9 n LYS 20 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 2yu9 h GLU 21 N 0.00 -0.02 -0.01 1.97 5.08 -1.96 -3.35 114.58 116.28 2yu9 h GLU 21 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2yu9 h GLU 21 Cb 0.00 0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.26 2yu9 h GLU 21 CO 0.00 0.73 -0.17 0.09 -1.00 0.00 0.00 179.01 178.67 2yu9 n ASN 22 N -4.71 1.23 -1.59 1.42 3.02 -1.26 -4.95 115.26 108.42 2yu9 n ASN 22 Ca -0.09 -1.12 -0.16 0.00 -0.03 0.00 0.00 54.58 53.18 2yu9 n ASN 22 Cb 0.37 0.09 -0.03 0.00 -0.61 0.00 0.00 39.78 39.60 2yu9 n ASN 22 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 2yu9 n ASN 23 N -0.33 -4.83 -4.98 6.41 3.02 -1.26 -5.01 115.26 108.28 2yu9 n ASN 23 Ca 0.15 0.15 -0.20 0.00 -0.03 0.00 0.00 54.58 54.64 2yu9 n ASN 23 Cb 0.36 -3.87 0.02 0.00 -0.61 0.00 0.00 39.78 35.67 2yu9 n ASN 23 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 2yu9 s ARG 24 N -4.23 2.83 -0.14 3.52 0.52 -1.26 -4.94 118.95 115.25 2yu9 s ARG 24 Ca 0.00 -0.82 -0.02 0.00 -0.52 0.00 0.00 55.73 54.37 2yu9 s ARG 24 Cb 0.00 -2.61 -0.02 0.00 0.52 0.00 0.00 34.95 32.84 2yu9 s ARG 24 CO 0.00 -0.39 -0.08 -1.17 0.02 0.00 0.00 175.30 173.68 2yu9 s LEU 25 N -4.53 3.00 -0.20 2.53 2.96 -1.26 -2.10 118.68 119.07 2yu9 s LEU 25 Ca 0.52 -0.22 -0.01 0.00 -0.22 0.00 0.00 54.13 54.20 2yu9 s LEU 25 Cb -0.10 -1.70 0.06 0.00 0.50 0.00 0.00 46.19 44.95 2yu9 s LEU 25 CO 0.36 0.17 -0.00 -0.76 -1.32 0.00 0.00 176.35 174.80 2yu9 s LEU 26 N 0.32 1.64 0.52 -0.68 1.43 0.09 -2.63 118.68 119.37 2yu9 s LEU 26 Ca -0.07 -0.90 -0.19 0.00 -1.03 0.00 0.00 54.13 51.94 2yu9 s LEU 26 Cb -0.15 -0.80 -0.07 0.00 0.03 0.00 0.00 46.19 45.20 2yu9 s LEU 26 CO 0.04 -0.27 1.07 -0.36 0.23 0.00 0.00 176.35 177.06 2yu9 s PHE 27 N 1.70 2.90 0.29 0.29 0.40 -0.89 -0.63 117.98 122.04 2yu9 s PHE 27 Ca -0.02 1.56 -0.16 0.00 -0.60 0.00 0.00 56.93 57.71 2yu9 s PHE 27 Cb -0.17 -3.12 0.02 0.00 0.51 0.00 0.00 43.02 40.25 2yu9 s PHE 27 CO -0.07 -1.07 0.63 -1.83 0.70 0.00 0.00 175.22 173.57 2yu9 s GLU 28 N -3.36 1.78 -0.11 0.44 4.04 0.12 -1.60 118.70 120.01 2yu9 s GLU 28 Ca 0.68 -1.20 0.01 0.00 0.04 0.00 0.00 54.97 54.50 2yu9 s GLU 28 Cb -0.18 0.55 0.02 0.00 0.02 0.00 0.00 34.13 34.54 2yu9 s GLU 28 CO 0.24 -0.79 -0.15 0.00 -1.84 0.00 0.00 175.26 172.72 2yu9 n ARG 30 N 4.29 2.76 0.00 0.00 1.85 -1.26 -3.57 116.66 120.72 2yu9 n ARG 30 Ca -0.19 -3.41 0.00 0.00 -1.00 0.00 0.00 57.85 53.26 2yu9 n ARG 30 Cb 0.51 -2.28 0.00 0.00 -1.05 0.00 0.00 32.46 29.64 2yu9 n ARG 30 CO 0.00 0.00 0.00 2.41 -0.01 0.00 0.00 177.63 180.03 2yu9 n THR 31 N -0.80 0.00 0.00 8.89 -1.04 -1.26 -5.01 114.28 115.06 2yu9 n THR 31 Ca 0.59 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.60 2yu9 n THR 31 Cb 0.56 -0.23 0.00 0.00 -1.82 0.00 0.00 70.33 68.84 2yu9 n THR 31 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2yu9 n SER 33 N -2.31 0.00 -3.11 0.00 2.88 -1.23 -5.11 113.62 104.73 2yu9 n SER 33 Ca 0.00 0.00 -0.29 0.00 -1.33 0.00 0.00 58.87 57.25 2yu9 n SER 33 Cb 0.00 0.00 0.01 0.00 -0.75 0.00 0.00 64.21 63.47 2yu9 n SER 33 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2yu9 n TYR 34 N 0.00 -2.10 -3.70 0.66 9.36 -1.26 -4.63 117.16 115.49 2yu9 n TYR 34 Ca 0.00 0.34 -0.14 0.00 3.32 0.00 0.00 57.90 61.42 2yu9 n TYR 34 Cb 0.00 -1.24 -0.08 0.00 -0.63 0.00 0.00 39.34 37.39 2yu9 n TYR 34 CO 0.00 0.00 0.00 0.08 0.22 0.00 0.00 176.86 177.16 2yu9 s VAL 35 N -1.46 0.03 0.26 2.97 1.01 -1.26 -2.56 120.40 119.39 2yu9 s VAL 35 Ca 0.42 -0.26 -0.14 0.00 0.00 0.00 0.00 61.98 61.99 2yu9 s VAL 35 Cb -0.37 -0.69 0.00 0.00 0.00 0.00 0.00 36.38 35.33 2yu9 s VAL 35 CO 0.48 -0.15 0.54 -1.83 0.00 0.00 0.00 175.10 174.14 2yu9 s GLU 36 N -0.92 1.64 0.60 2.72 -1.05 -0.63 -5.01 118.70 116.05 2yu9 s GLU 36 Ca -0.10 -1.23 -0.07 0.00 -0.15 0.00 0.00 54.97 53.42 2yu9 s GLU 36 Cb -0.04 0.50 0.00 0.00 -0.44 0.00 0.00 34.13 34.16 2yu9 s GLU 36 CO 0.04 -0.70 0.93 -1.83 0.95 0.00 0.00 175.26 174.65 2yu9 s GLU 37 N -3.89 2.98 0.11 -4.83 -1.05 -1.26 -2.09 118.70 108.66 2yu9 s GLU 37 Ca 0.20 0.11 -0.04 0.00 -0.15 0.00 0.00 54.97 55.10 2yu9 s GLU 37 Cb -0.02 -2.23 -0.05 0.00 -0.44 0.00 0.00 34.13 31.39 2yu9 s GLU 37 CO 0.09 -0.71 0.32 0.00 0.95 0.00 0.00 175.26 175.91 2yu9 s ALA 38 N -3.04 3.86 0.00 -0.84 0.00 -1.08 -4.76 121.76 115.90 2yu9 s ALA 38 Ca 0.54 -0.63 0.00 0.00 0.00 0.00 0.00 51.96 51.87 2yu9 s ALA 38 Cb -0.11 -2.04 0.00 0.00 0.00 0.00 0.00 23.12 20.97 2yu9 s ALA 38 CO 0.46 0.71 0.00 0.41 0.00 0.00 0.00 175.76 177.35 2yu9 n GLY 39 N 0.26 1.76 3.66 0.00 0.00 -1.26 -4.87 105.19 104.74 2yu9 n GLY 39 Ca -0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.55 2yu9 n GLY 39 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yu9 s SER 40 N -1.04 6.75 0.00 1.61 0.01 -1.26 -4.86 113.70 114.91 2yu9 s SER 40 Ca 0.00 2.09 0.00 0.00 1.31 0.00 0.00 55.95 59.35 2yu9 s SER 40 Cb 0.00 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.69 2yu9 s SER 40 CO 0.00 -0.87 0.34 -2.65 0.41 0.00 0.00 173.24 170.47 2yu9 n PRO 41 N 6.82 0.00 -2.49 12.44 -0.02 -1.26 -4.58 135.00 145.91 2yu9 n PRO 41 Ca 0.16 0.00 -0.43 0.00 -2.02 0.00 0.00 63.50 61.21 2yu9 n PRO 41 Cb 0.43 -1.43 -0.02 0.00 -0.02 0.00 0.00 33.50 32.46 2yu9 n PRO 41 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 2yu9 s LEU 42 N -1.65 4.18 -0.07 2.45 2.96 -1.26 -4.92 118.68 120.37 2yu9 s LEU 42 Ca 0.00 1.64 0.11 0.00 -0.22 0.00 0.00 54.13 55.66 2yu9 s LEU 42 Cb 0.00 -3.54 -0.17 0.00 0.50 0.00 0.00 46.19 42.98 2yu9 s LEU 42 CO 0.00 -0.71 0.15 0.52 -1.32 0.00 0.00 176.35 174.99 2yu9 n VAL 43 N 5.24 0.42 -3.27 1.68 0.31 -1.26 -4.93 118.33 116.51 2yu9 n VAL 43 Ca 0.13 -0.40 -0.02 0.00 -0.01 0.00 0.00 64.34 64.04 2yu9 n VAL 43 Cb 0.45 -0.26 -0.04 0.00 -0.91 0.00 0.00 33.84 33.08 2yu9 n VAL 43 CO 0.00 0.00 0.00 -0.47 -1.32 0.00 0.00 176.83 175.04 2yu9 s TYR 44 N -2.57 -1.24 -0.07 3.52 6.04 -1.26 -5.06 117.35 116.71 2yu9 s TYR 44 Ca -0.05 1.37 0.02 0.00 0.04 0.00 0.00 57.07 58.45 2yu9 s TYR 44 Cb 0.06 0.34 -0.03 0.00 -1.04 0.00 0.00 41.96 41.29 2yu9 s TYR 44 CO 0.50 -0.79 -0.10 0.50 -1.54 0.00 0.00 175.55 174.12 2yu9 s ARG 45 N 2.72 2.76 -0.15 4.97 3.52 -1.26 -5.06 118.95 126.46 2yu9 s ARG 45 Ca 0.16 -0.62 -0.13 0.00 -0.13 0.00 0.00 55.73 55.00 2yu9 s ARG 45 Cb -0.15 -2.53 -0.06 0.00 -1.56 0.00 0.00 34.95 30.65 2yu9 s ARG 45 CO -0.18 0.58 -0.28 1.58 -0.81 0.00 0.00 175.30 176.18 2yu9 n HIS 46 N 2.46 0.00 -1.82 5.12 -0.00 -1.26 -4.99 115.22 114.72 2yu9 n HIS 46 Ca -0.18 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.54 2yu9 n HIS 46 Cb 0.53 -0.52 0.00 0.00 -0.00 0.00 0.00 29.99 30.00 2yu9 n HIS 46 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 176.34 176.73 2yu9 n GLU 47 N -4.19 -4.90 -0.01 1.57 -0.58 -1.26 -5.01 120.64 106.27 2yu9 n GLU 47 Ca -0.21 3.52 -0.01 0.00 -0.42 0.00 0.00 57.16 60.04 2yu9 n GLU 47 Cb 0.53 -3.77 -0.01 0.00 -0.57 0.00 0.00 31.44 27.62 2yu9 n GLU 47 CO 0.00 0.00 0.00 1.28 -0.48 0.00 0.00 177.13 177.93 2yu9 n LEU 48 N 1.31 1.54 -4.48 -4.62 4.77 -1.26 -4.94 117.00 109.32 2yu9 n LEU 48 Ca 0.00 -0.01 -0.35 0.00 -0.03 0.00 0.00 56.01 55.62 2yu9 n LEU 48 Cb 0.00 -0.02 -0.12 0.00 -2.33 0.00 0.00 43.42 40.95 2yu9 n LEU 48 CO 0.00 0.30 -0.31 -0.63 -1.33 0.00 0.00 177.39 175.42 2yu9 s ILE 49 N -2.05 4.15 0.21 -0.08 1.01 -1.26 -5.12 121.20 118.07 2yu9 s ILE 49 Ca -0.02 -0.24 0.07 0.00 0.00 0.00 0.00 60.65 60.46 2yu9 s ILE 49 Cb 0.01 -2.89 -0.05 0.00 0.01 0.00 0.00 42.46 39.54 2yu9 s ILE 49 CO 0.06 0.42 -0.12 0.42 0.00 0.00 0.00 174.94 175.72 2yu9 s THR 50 N 0.99 1.62 0.00 2.92 -4.23 -1.26 -5.10 115.64 110.58 2yu9 s THR 50 Ca 0.02 -2.17 0.00 0.00 -1.18 0.00 0.00 61.69 58.36 2yu9 s THR 50 Cb -0.14 -2.09 0.00 0.00 1.34 0.00 0.00 72.50 71.60 2yu9 s THR 50 CO 0.02 -0.56 0.00 0.59 -0.54 0.00 0.00 174.62 174.13 2yu9 n ASN 51 N -0.39 0.00 -4.53 3.99 3.02 -1.26 -5.05 115.26 111.04 2yu9 n ASN 51 Ca -0.08 0.00 -0.41 0.00 -0.03 0.00 0.00 54.58 54.06 2yu9 n ASN 51 Cb 0.61 -0.16 0.01 0.00 -0.61 0.00 0.00 39.78 39.64 2yu9 n ASN 51 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2yu9 n ILE 52 N -1.86 2.25 0.00 2.41 3.06 -1.26 -3.04 119.36 120.92 2yu9 n ILE 52 Ca 0.00 -0.50 0.00 0.00 -2.50 0.00 0.00 62.75 59.75 2yu9 n ILE 52 Cb 0.00 -0.86 0.00 0.00 0.54 0.00 0.00 39.64 39.32 2yu9 n ILE 52 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 2yu9 n GLY 53 N 1.49 2.24 0.00 4.50 0.00 -1.26 -4.97 105.19 107.19 2yu9 n GLY 53 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 2yu9 n GLY 53 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2yu9 n GLU 54 N -0.49 0.00 -1.97 1.61 1.02 -1.17 -2.62 120.64 117.02 2yu9 n GLU 54 Ca 0.00 0.37 -0.27 0.00 -0.02 0.00 0.00 57.16 57.24 2yu9 n GLU 54 Cb 0.00 -1.12 -0.05 0.00 -0.02 0.00 0.00 31.44 30.25 2yu9 n GLU 54 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 2yu9 s THR 55 N -1.62 3.36 -0.22 2.62 2.01 -1.26 -3.34 115.64 117.19 2yu9 s THR 55 Ca 0.00 -0.21 0.02 0.00 0.31 0.00 0.00 61.69 61.81 2yu9 s THR 55 Cb 0.00 -3.84 0.04 0.00 0.01 0.00 0.00 72.50 68.71 2yu9 s THR 55 CO 0.00 -0.80 -0.14 0.00 -0.69 0.00 0.00 174.62 173.00 2yu9 s ALA 56 N 10.54 2.35 -0.09 7.40 0.00 -1.26 -4.68 121.76 136.03 2yu9 s ALA 56 Ca 0.73 -1.46 0.00 0.00 0.00 0.00 0.00 51.96 51.23 2yu9 s ALA 56 Cb -0.09 -1.39 0.00 0.00 0.00 0.00 0.00 23.12 21.65 2yu9 s ALA 56 CO 0.05 -0.84 0.00 0.41 0.00 0.00 0.00 175.76 175.38 2yu9 n GLY 57 N 4.55 0.47 3.55 0.00 0.00 -1.26 -4.94 105.19 107.57 2yu9 n GLY 57 Ca -0.16 -0.69 -0.18 0.00 0.00 0.00 0.00 46.02 44.99 2yu9 n GLY 57 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2yu9 n VAL 58 N -2.96 -0.01 -3.60 1.61 0.31 -1.26 -4.89 118.33 107.53 2yu9 n VAL 58 Ca -0.01 -0.54 -0.24 0.00 -0.01 0.00 0.00 64.34 63.54 2yu9 n VAL 58 Cb 0.04 -1.91 0.02 0.00 -0.91 0.00 0.00 33.84 31.08 2yu9 n VAL 58 CO 0.00 0.00 0.00 0.68 -1.32 0.00 0.00 176.83 176.19 2yu9 s VAL 59 N 13.03 1.80 -1.54 2.52 -7.23 -1.26 -5.01 120.40 122.70 2yu9 s VAL 59 Ca 0.98 -1.33 0.24 0.00 -1.81 0.00 0.00 61.98 60.07 2yu9 s VAL 59 Cb -0.23 -2.12 0.48 0.00 0.56 0.00 0.00 36.38 35.07 2yu9 s VAL 59 CO 0.16 0.00 1.81 1.67 -0.31 0.00 0.00 175.10 178.43 2yu9 n GLN 60 N -1.94 0.43 0.00 4.82 -0.06 -1.26 -2.84 117.38 116.53 2yu9 n GLN 60 Ca 0.04 0.05 0.10 0.00 -2.00 0.00 0.00 57.00 55.19 2yu9 n GLN 60 Cb 0.63 -1.50 -0.07 0.00 -4.06 0.00 0.00 30.24 25.25 2yu9 n GLN 60 CO 0.00 0.00 0.00 -0.25 -0.20 0.00 0.00 177.06 176.61 2yu9 n ASP 61 N -1.23 1.30 0.32 1.69 9.92 -1.26 -4.59 116.55 122.70 2yu9 n ASP 61 Ca 0.13 -1.13 0.14 0.00 -0.53 0.00 0.00 54.79 53.40 2yu9 n ASP 61 Cb 0.17 0.81 0.75 0.00 -0.64 0.00 0.00 41.12 42.21 2yu9 n ASP 61 CO 0.00 0.00 0.00 -0.29 0.13 0.00 0.00 177.20 177.04 2yu9 h ILE 62 N 0.76 0.01 0.12 0.53 2.10 -1.88 -1.44 117.51 117.72 2yu9 h ILE 62 Ca 0.00 0.00 -0.01 0.00 1.08 0.00 0.00 64.86 65.93 2yu9 h ILE 62 Cb 0.58 0.61 0.00 0.00 -1.09 0.00 0.00 36.82 36.92 2yu9 h ILE 62 CO 0.00 0.00 -0.06 1.23 -1.08 0.00 0.00 178.15 178.24 2yu9 h GLY 63 N 0.00 -0.16 2.00 8.18 0.00 -1.86 -3.31 103.07 107.92 2yu9 h GLY 63 Ca 0.01 0.06 0.00 0.00 0.00 0.00 0.00 47.33 47.40 2yu9 h GLY 63 CO -0.00 -0.06 0.00 -1.14 0.00 0.00 0.00 176.54 175.34 2yu9 n SER 64 N -4.87 0.20 -4.56 0.19 3.41 -0.54 -4.59 113.62 102.87 2yu9 n SER 64 Ca -0.08 0.59 -0.38 0.00 -0.26 0.00 0.00 58.87 58.75 2yu9 n SER 64 Cb 0.28 -0.62 -0.03 0.00 -0.26 0.00 0.00 64.21 63.58 2yu9 n SER 64 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2yu9 s ASP 65 N -3.37 4.97 0.08 4.04 2.15 -1.23 -4.84 116.67 118.47 2yu9 s ASP 65 Ca -0.01 0.80 0.17 0.00 0.43 0.00 0.00 52.55 53.94 2yu9 s ASP 65 Cb 0.02 -2.52 0.73 0.00 -0.30 0.00 0.00 42.92 40.86 2yu9 s ASP 65 CO 0.08 -2.52 1.54 -2.65 -0.17 0.00 0.00 175.17 171.45 2yu9 n PRO 66 N 9.03 0.06 0.03 4.34 -0.02 -1.26 -2.58 135.00 144.61 2yu9 n PRO 66 Ca 0.28 0.30 0.13 0.00 -2.02 0.00 0.00 63.50 62.20 2yu9 n PRO 66 Cb 0.53 -1.62 0.51 0.00 -0.02 0.00 0.00 33.50 32.90 2yu9 n PRO 66 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 2yu9 n THR 67 N -1.73 0.17 -3.96 3.45 -2.24 -1.26 -4.82 114.28 103.89 2yu9 n THR 67 Ca 0.03 -0.09 -0.35 0.00 -2.27 0.00 0.00 64.05 61.37 2yu9 n THR 67 Cb 0.19 -0.44 -0.11 0.00 -2.10 0.00 0.00 70.33 67.87 2yu9 n THR 67 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2yu9 s LEU 68 N -3.45 3.67 1.17 3.22 1.43 -1.06 -5.10 118.68 118.55 2yu9 s LEU 68 Ca 0.13 -0.03 -0.13 0.00 -1.03 0.00 0.00 54.13 53.07 2yu9 s LEU 68 Cb 0.17 -1.94 0.29 0.00 0.03 0.00 0.00 46.19 44.73 2yu9 s LEU 68 CO 0.57 0.10 1.03 -2.16 0.23 0.00 0.00 176.35 176.12 2yu9 s PRO 69 N 0.80 -1.00 -0.11 1.29 0.04 -1.26 -4.89 135.00 129.87 2yu9 s PRO 69 Ca 0.03 0.76 -0.03 0.00 0.04 0.00 0.00 61.00 61.80 2yu9 s PRO 69 Cb -0.14 -1.55 0.04 0.00 0.04 0.00 0.00 34.50 32.90 2yu9 s PRO 69 CO 0.02 -3.75 0.06 0.50 0.04 0.00 0.00 177.00 173.87 2yu9 s ARG 70 N -4.50 0.10 0.02 4.56 3.52 -1.26 -3.62 118.95 117.77 2yu9 s ARG 70 Ca 0.68 0.11 0.00 0.00 -0.13 0.00 0.00 55.73 56.39 2yu9 s ARG 70 Cb -0.24 -1.21 0.00 0.00 -1.56 0.00 0.00 34.95 31.94 2yu9 s ARG 70 CO 0.64 -0.49 0.03 -1.13 -0.81 0.00 0.00 175.30 173.54 2yu9 n SER 71 N 5.26 0.49 -1.74 -2.12 3.41 -1.22 -5.05 113.62 112.65 2yu9 n SER 71 Ca -0.05 -1.07 -0.04 0.00 -0.26 0.00 0.00 58.87 57.45 2yu9 n SER 71 Cb 0.49 -0.01 0.08 0.00 -0.26 0.00 0.00 64.21 64.51 2yu9 n SER 71 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 2yu9 n ASP 72 N -2.57 2.40 -4.15 4.04 5.68 -1.26 -4.57 116.55 116.12 2yu9 n ASP 72 Ca 0.00 -2.97 -0.30 0.00 -0.50 0.00 0.00 54.79 51.02 2yu9 n ASP 72 Cb 0.02 -0.41 0.18 0.00 -1.14 0.00 0.00 41.12 39.77 2yu9 n ASP 72 CO 0.00 0.00 0.00 -0.13 -1.33 0.00 0.00 177.20 175.74 2yu9 s ARG 73 N -2.74 0.68 0.35 0.11 1.81 -1.26 -5.01 118.95 112.88 2yu9 s ARG 73 Ca 0.38 -0.43 -0.02 0.00 -1.72 0.00 0.00 55.73 53.93 2yu9 s ARG 73 Cb 0.37 -1.86 0.07 0.00 -0.45 0.00 0.00 34.95 33.09 2yu9 s ARG 73 CO -0.06 -2.38 0.47 0.39 -0.68 0.00 0.00 175.30 173.05 2yu9 n GLU 74 N -3.74 0.02 -4.46 3.54 1.02 -1.26 -4.28 120.64 111.47 2yu9 n GLU 74 Ca 0.15 -1.07 -0.25 0.00 -0.02 0.00 0.00 57.16 55.97 2yu9 n GLU 74 Cb 0.59 -0.39 -0.17 0.00 -0.02 0.00 0.00 31.44 31.46 2yu9 n GLU 74 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2yu9 n PRO 76 N 4.03 0.01 0.00 0.00 -0.02 -1.26 -3.59 135.00 134.17 2yu9 n PRO 76 Ca -0.21 0.90 0.00 0.00 -2.02 0.00 0.00 63.50 62.17 2yu9 n PRO 76 Cb 0.51 -2.18 0.00 0.00 -0.02 0.00 0.00 33.50 31.81 2yu9 n PRO 76 CO 0.00 0.00 0.00 0.36 1.98 0.00 0.00 175.50 177.84 2yu9 n LYS 77 N -3.18 0.00 -2.34 -0.52 2.85 -1.26 -5.00 118.16 108.71 2yu9 n LYS 77 Ca 0.26 0.00 -0.43 0.00 -1.05 0.00 0.00 58.31 57.09 2yu9 n LYS 77 Cb 1.45 -0.02 -0.02 0.00 -0.65 0.00 0.00 35.03 35.79 2yu9 n LYS 77 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2yu9 n HIS 79 N 8.73 0.00 -3.44 0.00 8.25 -1.26 -3.96 115.22 123.54 2yu9 n HIS 79 Ca 0.17 -0.68 -0.32 0.00 -0.26 0.00 0.00 57.72 56.62 2yu9 n HIS 79 Cb 0.48 -0.89 -0.05 0.00 1.12 0.00 0.00 29.99 30.65 2yu9 n HIS 79 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2yu9 s SER 80 N 2.45 6.60 -0.10 0.41 0.15 -1.26 -4.84 113.70 117.11 2yu9 s SER 80 Ca 0.28 0.87 0.16 0.00 0.70 0.00 0.00 55.95 57.96 2yu9 s SER 80 Cb 0.13 -2.21 0.55 0.00 -1.71 0.00 0.00 66.02 62.79 2yu9 s SER 80 CO 0.00 -0.06 1.47 0.54 1.20 0.00 0.00 173.24 176.39 2yu9 n ARG 81 N -0.13 3.29 -2.80 5.44 1.74 -1.26 -3.52 116.66 119.42 2yu9 n ARG 81 Ca 0.00 -2.64 -0.43 0.00 -0.77 0.00 0.00 57.85 54.01 2yu9 n ARG 81 Cb 0.52 -1.70 -0.04 0.00 -1.02 0.00 0.00 32.46 30.22 2yu9 n ARG 81 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 2yu9 s GLU 82 N -1.88 3.21 -0.07 5.56 0.41 -1.26 -4.66 118.70 120.01 2yu9 s GLU 82 Ca 0.41 -0.52 -0.13 0.00 -0.41 0.00 0.00 54.97 54.32 2yu9 s GLU 82 Cb 0.27 -4.15 0.03 0.00 -1.78 0.00 0.00 34.13 28.50 2yu9 s GLU 82 CO 0.18 -1.75 0.32 0.54 -0.49 0.00 0.00 175.26 174.06 2yu9 s ASN 83 N 3.38 -0.27 -0.03 -0.19 6.03 -1.26 -1.06 114.94 121.55 2yu9 s ASN 83 Ca 0.27 0.38 0.06 0.00 -1.03 0.00 0.00 52.86 52.54 2yu9 s ASN 83 Cb -0.14 0.50 -0.02 0.00 -3.03 0.00 0.00 41.25 38.56 2yu9 s ASN 83 CO 0.14 -0.28 -0.21 0.54 -2.03 0.00 0.00 177.10 175.26 2yu9 s VAL 84 N -0.59 2.46 0.10 3.54 0.11 -0.57 -3.41 120.40 122.04 2yu9 s VAL 84 Ca -0.07 -0.98 0.02 0.00 -2.93 0.00 0.00 61.98 58.03 2yu9 s VAL 84 Cb -0.04 -1.91 -0.04 0.00 -1.53 0.00 0.00 36.38 32.86 2yu9 s VAL 84 CO 0.02 0.57 -0.07 0.72 -3.33 0.00 0.00 175.10 173.01 2yu9 s PHE 85 N -0.67 0.94 -0.14 1.54 -0.12 -1.24 -0.67 117.98 117.61 2yu9 s PHE 85 Ca 0.11 -0.83 -0.29 0.00 -0.05 0.00 0.00 56.93 55.87 2yu9 s PHE 85 Cb -0.10 -0.53 0.08 0.00 -0.63 0.00 0.00 43.02 41.84 2yu9 s PHE 85 CO -0.00 -0.10 0.75 -0.59 -0.05 0.00 0.00 175.22 175.23 2yu9 s PHE 86 N -3.27 -0.66 0.61 3.49 -0.12 -1.07 -4.38 117.98 112.58 2yu9 s PHE 86 Ca 0.10 1.32 -0.16 0.00 -0.05 0.00 0.00 56.93 58.14 2yu9 s PHE 86 Cb 0.03 0.37 -0.03 0.00 -0.63 0.00 0.00 43.02 42.76 2yu9 s PHE 86 CO -0.03 -0.49 1.08 -0.65 -0.05 0.00 0.00 175.22 175.08 2yu9 s GLN 87 N -0.61 3.18 -0.28 1.99 -0.21 -1.26 -2.02 119.66 120.43 2yu9 s GLN 87 Ca -0.06 1.29 -0.32 0.00 0.02 0.00 0.00 55.36 56.29 2yu9 s GLN 87 Cb -0.02 -2.01 -0.14 0.00 1.00 0.00 0.00 33.01 31.84 2yu9 s GLN 87 CO 0.05 -0.93 1.06 0.45 -2.12 0.00 0.00 175.29 173.80 2yu9 n SER 88 N -2.06 0.69 0.19 5.90 2.88 -1.25 -4.83 113.62 115.13 2yu9 n SER 88 Ca 0.09 0.84 0.14 0.00 -1.33 0.00 0.00 58.87 58.61 2yu9 n SER 88 Cb 0.52 -0.63 0.52 0.00 -0.75 0.00 0.00 64.21 63.88 2yu9 n SER 88 CO 0.00 0.00 0.00 1.56 -1.23 0.00 0.00 175.04 175.37 2yu9 h GLN 89 N 3.26 0.00 -5.35 -1.46 1.08 -1.74 -3.39 115.11 107.51 2yu9 h GLN 89 Ca -0.32 0.00 -0.41 0.00 -1.45 0.00 0.00 58.65 56.47 2yu9 h GLN 89 Cb 0.98 0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 28.38 2yu9 h GLN 89 CO 0.65 0.00 1.37 0.94 -0.95 0.00 0.00 178.83 180.83 2yu9 n GLN 90 N -2.63 1.75 -1.02 1.46 7.27 -1.08 -4.85 117.38 118.29 2yu9 n GLN 90 Ca 0.02 -2.46 -0.23 0.00 0.07 0.00 0.00 57.00 54.40 2yu9 n GLN 90 Cb 0.31 -3.60 -0.08 0.00 2.41 0.00 0.00 30.24 29.28 2yu9 n GLN 90 CO 0.00 0.00 0.00 0.54 0.07 0.00 0.00 177.06 177.67 2yu9 n ARG 91 N 8.09 2.55 -4.07 3.69 5.12 -1.26 -4.88 116.66 125.90 2yu9 n ARG 91 Ca 0.46 -1.47 -0.31 0.00 -1.93 0.00 0.00 57.85 54.60 2yu9 n ARG 91 Cb 0.46 -2.35 -0.07 0.00 -1.16 0.00 0.00 32.46 29.34 2yu9 n ARG 91 CO 0.00 0.00 0.00 0.50 -1.93 0.00 0.00 177.63 176.20 2yu9 s ARG 92 N 1.95 2.91 0.48 5.56 3.00 -1.26 -5.03 118.95 126.55 2yu9 s ARG 92 Ca 0.60 -0.65 0.30 0.00 -1.00 0.00 0.00 55.73 54.98 2yu9 s ARG 92 Cb 0.21 -2.75 1.39 0.00 0.00 0.00 0.00 34.95 33.81 2yu9 s ARG 92 CO -0.03 0.58 1.75 0.87 0.00 0.00 0.00 175.30 178.47 2yu9 h LYS 93 N 3.46 0.14 -2.63 5.12 1.57 -2.05 -3.30 116.57 118.89 2yu9 h LYS 93 Ca -0.47 -0.01 -0.61 0.00 -1.87 0.00 0.00 60.65 57.69 2yu9 h LYS 93 Cb 1.17 -0.03 -0.41 0.00 0.08 0.00 0.00 32.23 33.03 2yu9 h LYS 93 CO 0.65 0.10 -0.65 -0.40 -0.57 0.00 0.00 179.45 178.58 2yu9 n ASP 94 N -4.39 2.81 -4.23 0.86 3.85 -1.26 -5.07 116.55 109.12 2yu9 n ASP 94 Ca 0.28 -3.19 -0.13 0.00 -0.71 0.00 0.00 54.79 51.04 2yu9 n ASP 94 Cb 1.20 -0.70 -0.10 0.00 -1.35 0.00 0.00 41.12 40.17 2yu9 n ASP 94 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.20 175.30 2yu9 s THR 95 N -1.69 0.27 0.45 2.12 2.01 -1.24 -5.15 115.64 112.40 2yu9 s THR 95 Ca 0.32 -1.98 -0.21 0.00 0.31 0.00 0.00 61.69 60.13 2yu9 s THR 95 Cb 0.05 -2.37 -0.10 0.00 0.01 0.00 0.00 72.50 70.09 2yu9 s THR 95 CO -0.11 -0.18 0.99 -0.94 -0.69 0.00 0.00 174.62 173.69 2yu9 s SER 96 N -3.18 6.70 0.00 3.53 1.04 -1.26 -4.95 113.70 115.58 2yu9 s SER 96 Ca 0.33 1.80 0.00 0.00 0.48 0.00 0.00 55.95 58.56 2yu9 s SER 96 Cb 0.07 -2.55 0.00 0.00 0.10 0.00 0.00 66.02 63.64 2yu9 s SER 96 CO 0.09 -0.53 0.82 0.23 0.98 0.00 0.00 173.24 174.83 2yu9 n MET 97 N -0.72 0.93 -2.30 4.02 2.81 -1.26 -4.62 117.12 115.99 2yu9 n MET 97 Ca 0.08 0.00 -0.42 0.00 -1.81 0.00 0.00 57.70 55.55 2yu9 n MET 97 Cb 0.53 -1.12 -0.03 0.00 -0.71 0.00 0.00 33.22 31.90 2yu9 n MET 97 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 2yu9 s VAL 98 N -1.75 3.83 0.55 2.03 1.01 -1.26 -4.91 120.40 119.90 2yu9 s VAL 98 Ca 0.00 1.23 -0.16 0.00 0.00 0.00 0.00 61.98 63.05 2yu9 s VAL 98 Cb 0.00 -3.79 -0.06 0.00 0.00 0.00 0.00 36.38 32.53 2yu9 s VAL 98 CO 0.00 0.02 1.02 -0.76 0.00 0.00 0.00 175.10 175.38 2yu9 s LEU 99 N 2.01 3.55 -0.07 3.92 1.43 -1.26 -3.91 118.68 124.35 2yu9 s LEU 99 Ca 0.61 1.66 0.03 0.00 -1.03 0.00 0.00 54.13 55.40 2yu9 s LEU 99 Cb -0.30 -4.52 0.01 0.00 0.03 0.00 0.00 46.19 41.41 2yu9 s LEU 99 CO 0.26 -0.83 -0.17 -0.36 0.23 0.00 0.00 176.35 175.48 2yu9 s PHE 100 N -2.60 1.81 -0.11 0.29 0.40 -0.86 -2.71 117.98 114.20 2yu9 s PHE 100 Ca 0.60 -0.65 -0.00 0.00 -0.60 0.00 0.00 56.93 56.28 2yu9 s PHE 100 Cb -0.12 -1.26 -0.02 0.00 0.51 0.00 0.00 43.02 42.13 2yu9 s PHE 100 CO 0.35 -0.28 -0.09 -0.06 0.70 0.00 0.00 175.22 175.84 2yu9 s PHE 101 N 0.41 2.90 -0.22 0.36 0.40 0.71 -2.58 117.98 119.95 2yu9 s PHE 101 Ca -0.13 -0.28 -0.01 0.00 -0.60 0.00 0.00 56.93 55.91 2yu9 s PHE 101 Cb -0.15 -1.81 0.02 0.00 0.51 0.00 0.00 43.02 41.59 2yu9 s PHE 101 CO 0.05 0.05 -0.10 0.08 0.70 0.00 0.00 175.22 176.00 2yu9 s VAL 102 N -0.13 2.71 0.36 -0.44 1.01 0.16 -1.84 120.40 122.22 2yu9 s VAL 102 Ca 0.01 -0.93 -0.28 0.00 0.00 0.00 0.00 61.98 60.78 2yu9 s VAL 102 Cb -0.13 -2.30 -0.11 0.00 0.00 0.00 0.00 36.38 33.85 2yu9 s VAL 102 CO 0.03 0.33 1.40 0.00 0.00 0.00 0.00 175.10 176.86 2yu9 n LEU 104 N 0.57 6.00 0.00 0.00 7.99 -0.22 -2.80 117.00 128.54 2yu9 n LEU 104 Ca 0.01 -3.17 0.00 0.00 -0.01 0.00 0.00 56.01 52.84 2yu9 n LEU 104 Cb 0.40 -0.77 0.00 0.00 -0.11 0.00 0.00 43.42 42.95 2yu9 n LEU 104 CO 0.61 0.89 -0.07 -1.20 -1.51 0.00 0.00 177.39 176.11 2yu9 n SER 105 N -0.63 0.71 0.00 -1.43 7.64 -1.26 -4.91 113.62 113.74 2yu9 n SER 105 Ca 0.46 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.34 2yu9 n SER 105 Cb 1.43 0.06 0.00 0.00 -1.01 0.00 0.00 64.21 64.68 2yu9 n SER 105 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2yu9 n SER 107 N -0.25 -3.47 -4.76 0.00 7.64 -1.12 -4.95 113.62 106.71 2yu9 n SER 107 Ca 0.00 -0.12 -0.40 0.00 1.01 0.00 0.00 58.87 59.36 2yu9 n SER 107 Cb 0.06 -2.92 -0.05 0.00 -1.01 0.00 0.00 64.21 60.29 2yu9 n SER 107 CO 0.00 0.00 0.00 -2.28 -3.01 0.00 0.00 175.04 169.75 2yu9 s HIS 108 N -2.74 3.64 -0.16 1.43 5.65 -1.26 -4.82 115.29 117.04 2yu9 s HIS 108 Ca 0.23 1.74 -0.04 0.00 0.25 0.00 0.00 55.06 57.25 2yu9 s HIS 108 Cb -0.12 -3.21 -0.03 0.00 -1.18 0.00 0.00 32.58 28.04 2yu9 s HIS 108 CO 0.29 -0.34 -0.04 0.42 -0.65 0.00 0.00 174.74 174.42 2yu9 s ILE 109 N -1.20 3.85 0.12 0.89 1.09 -1.26 -2.55 121.20 122.13 2yu9 s ILE 109 Ca 0.45 -0.37 -0.05 0.00 -1.10 0.00 0.00 60.65 59.57 2yu9 s ILE 109 Cb -0.30 -2.69 -0.02 0.00 -1.06 0.00 0.00 42.46 38.39 2yu9 s ILE 109 CO 0.38 0.49 0.15 0.72 -0.10 0.00 0.00 174.94 176.58 2yu9 s PHE 110 N 0.45 0.49 0.27 3.97 -0.12 -0.77 -5.01 117.98 117.26 2yu9 s PHE 110 Ca -0.04 -0.90 0.12 0.00 -0.05 0.00 0.00 56.93 56.06 2yu9 s PHE 110 Cb -0.14 -0.23 -0.05 0.00 -0.63 0.00 0.00 43.02 41.97 2yu9 s PHE 110 CO 0.03 -0.57 -0.19 0.99 -0.05 0.00 0.00 175.22 175.43 2yu9 s THR 111 N -3.96 2.55 -0.36 -4.49 2.01 -1.26 -0.21 115.64 109.92 2yu9 s THR 111 Ca 0.15 -2.31 0.04 0.00 0.31 0.00 0.00 61.69 59.88 2yu9 s THR 111 Cb 0.06 -2.33 0.53 0.00 0.01 0.00 0.00 72.50 70.77 2yu9 s THR 111 CO -0.03 -0.36 1.67 -1.54 -0.69 0.00 0.00 174.62 173.67 2yu9 n SER 112 N -0.52 3.75 -4.66 3.53 3.41 -1.10 -4.93 113.62 113.10 2yu9 n SER 112 Ca -0.06 -3.16 -0.37 0.00 -0.26 0.00 0.00 58.87 55.02 2yu9 n SER 112 Cb 0.59 -0.74 -0.09 0.00 -0.26 0.00 0.00 64.21 63.71 2yu9 n SER 112 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2yu9 s ASP 113 N -0.74 6.25 0.00 4.04 -1.08 -1.26 -4.86 116.67 119.01 2yu9 s ASP 113 Ca 0.44 0.27 0.07 0.00 -0.52 0.00 0.00 52.55 52.81 2yu9 s ASP 113 Cb 0.36 -2.16 0.10 0.00 -1.46 0.00 0.00 42.92 39.76 2yu9 s ASP 113 CO 0.09 -0.01 0.88 0.00 0.52 0.00 0.00 175.17 176.64 2yu9 n GLN 114 N 4.47 0.98 0.00 4.34 6.02 -1.26 -4.62 117.38 127.31 2yu9 n GLN 114 Ca -0.12 -1.24 0.00 0.00 -0.01 0.00 0.00 57.00 55.63 2yu9 n GLN 114 Cb 0.52 -1.15 0.00 0.00 1.02 0.00 0.00 30.24 30.63 2yu9 n GLN 114 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.06 177.22 2yu9 n LYS 115 N 0.32 1.83 -3.95 -1.09 4.81 -1.26 -5.06 118.16 113.77 2yu9 n LYS 115 Ca 0.05 0.00 -0.30 0.00 -0.87 0.00 0.00 58.31 57.19 2yu9 n LYS 115 Cb 0.24 -0.95 -0.04 0.00 0.02 0.00 0.00 35.03 34.30 2yu9 n LYS 115 CO 0.00 0.00 0.00 -0.80 1.17 0.00 0.00 177.40 177.77 2yu9 s ASN 116 N -2.23 6.20 0.76 3.14 0.01 -1.26 -5.12 114.94 116.44 2yu9 s ASN 116 Ca 0.00 0.21 -0.11 0.00 -0.71 0.00 0.00 52.86 52.24 2yu9 s ASN 116 Cb 0.00 -1.86 0.05 0.00 0.41 0.00 0.00 41.25 39.84 2yu9 s ASN 116 CO 0.00 0.16 1.09 -0.54 -1.51 0.00 0.00 177.10 176.30 2yu9 s LYS 117 N -2.55 2.37 -0.13 -0.60 1.02 -1.26 -4.94 119.74 113.66 2yu9 s LYS 117 Ca 0.34 0.71 -0.09 0.00 0.02 0.00 0.00 55.97 56.94 2yu9 s LYS 117 Cb -0.13 -1.95 0.04 0.00 -0.52 0.00 0.00 37.83 35.28 2yu9 s LYS 117 CO 0.27 -1.43 0.32 1.03 -0.92 0.00 0.00 175.35 174.61 2yu9 s ARG 118 N -5.14 0.33 0.00 1.68 1.81 -1.26 -4.98 118.95 111.39 2yu9 s ARG 118 Ca 0.60 0.53 0.20 0.00 -1.72 0.00 0.00 55.73 55.34 2yu9 s ARG 118 Cb -0.14 0.07 0.33 0.00 -0.45 0.00 0.00 34.95 34.76 2yu9 s ARG 118 CO 0.54 -0.10 1.13 2.41 -0.68 0.00 0.00 175.30 178.60 2yu9 n THR 119 N 3.51 0.00 -0.74 0.02 -1.04 -1.26 -5.14 114.28 109.63 2yu9 n THR 119 Ca -0.18 -0.77 0.00 0.00 -2.04 0.00 0.00 64.05 61.06 2yu9 n THR 119 Cb 0.56 0.88 0.00 0.00 -1.82 0.00 0.00 70.33 69.95 2yu9 n THR 119 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43