#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yuy s SER 2 N 0.00 -0.38 0.13 1.61 0.01 -1.26 -5.09 113.70 108.72 2yuy s SER 2 Ca 0.00 -0.02 0.00 0.00 1.31 0.00 0.00 55.95 57.24 2yuy s SER 2 Cb 0.00 0.41 0.00 0.00 0.21 0.00 0.00 66.02 66.64 2yuy s SER 2 CO 0.00 -0.67 0.00 -0.24 0.41 0.00 0.00 173.24 172.74 2yuy n SER 3 N -0.27 0.21 0.00 2.44 2.88 -1.26 -5.17 113.62 112.45 2yuy n SER 3 Ca -0.09 0.21 0.00 0.00 -1.33 0.00 0.00 58.87 57.65 2yuy n SER 3 Cb 0.62 0.06 0.00 0.00 -0.75 0.00 0.00 64.21 64.14 2yuy n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2yuy n GLY 4 N 2.25 0.58 3.59 0.46 0.00 -1.26 -5.11 105.19 105.70 2yuy n GLY 4 Ca 0.00 -2.05 -0.09 0.00 0.00 0.00 0.00 46.02 43.88 2yuy n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yuy s SER 5 N -4.00 -0.32 0.53 1.61 0.01 -1.26 -5.15 113.70 105.12 2yuy s SER 5 Ca 0.00 0.36 0.00 0.00 1.31 0.00 0.00 55.95 57.62 2yuy s SER 5 Cb 0.00 0.27 0.00 0.00 0.21 0.00 0.00 66.02 66.50 2yuy s SER 5 CO 0.00 -0.29 0.00 -1.20 0.41 0.00 0.00 173.24 172.16 2yuy n SER 6 N 0.72 -8.57 0.00 2.44 7.64 -1.26 -5.08 113.62 109.51 2yuy n SER 6 Ca -0.09 1.16 0.00 0.00 1.01 0.00 0.00 58.87 60.96 2yuy n SER 6 Cb 0.58 -4.83 0.00 0.00 -1.01 0.00 0.00 64.21 58.95 2yuy n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2yuy n GLY 7 N -4.35 1.13 0.19 0.23 0.00 -1.26 -5.11 105.19 96.02 2yuy n GLY 7 Ca -0.05 0.12 0.00 0.00 0.00 0.00 0.00 46.02 46.08 2yuy n GLY 7 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2yuy n GLY 8 N 0.00 0.18 3.81 -0.02 0.00 -1.26 -5.09 105.19 102.81 2yuy n GLY 8 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 2yuy n GLY 8 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2yuy s PRO 9 N -0.20 2.36 0.20 1.61 0.04 -1.26 -4.96 135.00 132.78 2yuy s PRO 9 Ca 0.00 0.74 -0.13 0.00 0.04 0.00 0.00 61.00 61.65 2yuy s PRO 9 Cb 0.00 -1.94 -0.07 0.00 0.04 0.00 0.00 34.50 32.53 2yuy s PRO 9 CO 0.00 -1.45 0.58 0.21 0.04 0.00 0.00 177.00 176.38 2yuy s LYS 10 N -5.12 3.94 -0.02 4.56 2.47 -0.49 -5.00 119.74 120.08 2yuy s LYS 10 Ca 0.60 0.46 0.01 0.00 -1.56 0.00 0.00 55.97 55.48 2yuy s LYS 10 Cb -0.14 -2.78 0.01 0.00 -1.46 0.00 0.00 37.83 33.46 2yuy s LYS 10 CO 0.54 0.38 -0.04 0.99 0.16 0.00 0.00 175.35 177.38 2yuy s THR 11 N -1.64 0.45 0.01 3.43 2.01 -1.26 -2.71 115.64 115.92 2yuy s THR 11 Ca 0.43 -0.15 0.00 0.00 0.31 0.00 0.00 61.69 62.28 2yuy s THR 11 Cb -0.13 -0.44 -0.01 0.00 0.01 0.00 0.00 72.50 71.93 2yuy s THR 11 CO 0.20 0.17 -0.02 0.68 -0.69 0.00 0.00 174.62 174.96 2yuy s VAL 12 N 0.45 0.11 0.07 3.82 -7.23 -0.77 -4.97 120.40 111.87 2yuy s VAL 12 Ca -0.05 -0.38 0.09 0.00 -1.81 0.00 0.00 61.98 59.82 2yuy s VAL 12 Cb -0.09 -0.16 -0.03 0.00 0.56 0.00 0.00 36.38 36.65 2yuy s VAL 12 CO -0.00 -0.17 -0.22 -0.89 -0.31 0.00 0.00 175.10 173.51 2yuy s THR 13 N -0.57 2.54 0.20 5.32 2.01 -1.26 0.78 115.64 124.66 2yuy s THR 13 Ca -0.06 -1.37 0.06 0.00 0.31 0.00 0.00 61.69 60.63 2yuy s THR 13 Cb -0.04 -2.07 -0.05 0.00 0.01 0.00 0.00 72.50 70.35 2yuy s THR 13 CO -0.00 0.27 -0.11 -0.76 -0.69 0.00 0.00 174.62 173.33 2yuy s LEU 14 N -1.58 2.51 -0.09 4.42 1.02 1.00 -4.60 118.68 121.36 2yuy s LEU 14 Ca 0.14 -1.05 0.03 0.00 0.02 0.00 0.00 54.13 53.27 2yuy s LEU 14 Cb -0.10 -0.54 0.01 0.00 0.02 0.00 0.00 46.19 45.58 2yuy s LEU 14 CO 0.05 -0.26 -0.19 -0.54 0.02 0.00 0.00 176.35 175.43 2yuy s LYS 15 N -3.70 2.48 -0.40 1.70 1.02 -1.26 -0.52 119.74 119.06 2yuy s LYS 15 Ca 0.22 -0.68 -0.38 0.00 0.02 0.00 0.00 55.97 55.15 2yuy s LYS 15 Cb 0.01 -1.95 -0.14 0.00 -0.52 0.00 0.00 37.83 35.23 2yuy s LYS 15 CO 0.05 0.08 2.16 -2.13 -0.92 0.00 0.00 175.35 174.59 2yuy n ARG 16 N 3.75 0.71 -3.68 1.68 0.63 -0.42 -4.82 116.66 114.51 2yuy n ARG 16 Ca -0.20 0.19 -0.13 0.00 -0.92 0.00 0.00 57.85 56.79 2yuy n ARG 16 Cb 0.52 -2.12 -0.08 0.00 0.45 0.00 0.00 32.46 31.23 2yuy n ARG 16 CO 0.00 0.00 0.00 -0.08 -2.51 0.00 0.00 177.63 175.04 2yuy s THR 17 N 6.73 -0.00 -0.42 5.15 -1.32 -0.09 -4.97 115.64 120.71 2yuy s THR 17 Ca 1.13 0.01 -0.23 0.00 -1.21 0.00 0.00 61.69 61.38 2yuy s THR 17 Cb -1.09 -0.81 0.03 0.00 -1.51 0.00 0.00 72.50 69.13 2yuy s THR 17 CO 0.55 0.00 0.59 -0.24 -2.21 0.00 0.00 174.62 173.31 2yuy n SER 18 N 3.00 -7.08 -3.11 8.08 2.88 -1.26 -3.32 113.62 112.81 2yuy n SER 18 Ca -0.15 0.33 -0.00 0.00 -1.33 0.00 0.00 58.87 57.72 2yuy n SER 18 Cb 0.56 -4.01 -0.00 0.00 -0.75 0.00 0.00 64.21 60.01 2yuy n SER 18 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2yuy n GLN 19 N -0.18 -0.83 0.00 -1.46 6.02 -1.26 -3.79 117.38 115.87 2yuy n GLN 19 Ca 0.04 1.10 0.00 0.00 -0.01 0.00 0.00 57.00 58.13 2yuy n GLN 19 Cb 0.52 -1.45 0.00 0.00 1.02 0.00 0.00 30.24 30.33 2yuy n GLN 19 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2yuy n GLY 20 N 1.46 1.52 3.35 1.08 0.00 -1.26 -4.79 105.19 106.55 2yuy n GLY 20 Ca -0.01 0.17 -0.10 0.00 0.00 0.00 0.00 46.02 46.08 2yuy n GLY 20 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2yuy n PHE 21 N 0.00 -2.03 -0.16 1.61 3.01 -1.21 -0.92 117.46 117.76 2yuy n PHE 21 Ca 0.00 -1.82 0.00 0.00 1.01 0.00 0.00 57.45 56.64 2yuy n PHE 21 Cb 0.00 0.76 0.00 0.00 -0.01 0.00 0.00 39.48 40.23 2yuy n PHE 21 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2yuy n GLY 22 N -0.50 0.12 0.53 1.37 0.00 -1.26 -4.94 105.19 100.50 2yuy n GLY 22 Ca -0.06 -1.62 0.06 0.00 0.00 0.00 0.00 46.02 44.41 2yuy n GLY 22 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 2yuy n PHE 23 N 0.00 -1.18 -3.56 1.61 1.16 -1.26 -4.90 117.46 109.34 2yuy n PHE 23 Ca 0.00 0.59 -0.11 0.00 -1.87 0.00 0.00 57.45 56.07 2yuy n PHE 23 Cb 0.00 -1.07 -0.03 0.00 -1.61 0.00 0.00 39.48 36.77 2yuy n PHE 23 CO 0.00 0.00 0.00 -0.08 -1.87 0.00 0.00 176.76 174.81 2yuy s THR 24 N -1.68 0.01 0.41 1.97 -1.32 -1.11 -4.87 115.64 109.05 2yuy s THR 24 Ca 0.00 -0.33 0.07 0.00 -1.21 0.00 0.00 61.69 60.23 2yuy s THR 24 Cb 0.00 -1.26 -0.05 0.00 -1.51 0.00 0.00 72.50 69.69 2yuy s THR 24 CO 0.00 -0.05 0.22 -0.76 -2.21 0.00 0.00 174.62 171.81 2yuy s LEU 25 N -2.80 3.18 -0.06 9.08 2.01 -1.26 -0.01 118.68 128.82 2yuy s LEU 25 Ca 0.04 -0.99 -0.23 0.00 0.01 0.00 0.00 54.13 52.96 2yuy s LEU 25 Cb -0.01 -1.58 0.05 0.00 0.01 0.00 0.00 46.19 44.65 2yuy s LEU 25 CO -0.08 -0.55 0.51 -0.13 1.01 0.00 0.00 176.35 177.12 2yuy s ARG 26 N -3.94 0.84 -0.30 1.70 1.81 -0.90 -4.56 118.95 113.60 2yuy s ARG 26 Ca 0.42 0.15 -0.14 0.00 -1.72 0.00 0.00 55.73 54.44 2yuy s ARG 26 Cb 0.02 0.39 0.18 0.00 -0.45 0.00 0.00 34.95 35.09 2yuy s ARG 26 CO 0.24 -0.24 1.09 -3.38 -0.68 0.00 0.00 175.30 172.33 2yuy s HIS 27 N -1.04 -0.40 -0.15 -0.53 -3.43 -1.26 -3.73 115.29 104.75 2yuy s HIS 27 Ca -0.11 0.35 -0.01 0.00 -0.80 0.00 0.00 55.06 54.50 2yuy s HIS 27 Cb -0.03 0.11 -0.23 0.00 -1.43 0.00 0.00 32.58 31.00 2yuy s HIS 27 CO 0.06 -0.22 0.22 0.34 -2.00 0.00 0.00 174.74 173.15 2yuy n PHE 28 N 5.35 0.83 -1.34 0.38 -0.00 -1.26 -4.92 117.46 116.50 2yuy n PHE 28 Ca -0.02 0.19 -0.58 0.00 -0.00 0.00 0.00 57.45 57.04 2yuy n PHE 28 Cb 0.55 -1.11 -0.10 0.00 -0.00 0.00 0.00 39.48 38.82 2yuy n PHE 28 CO 0.00 0.00 0.00 -0.89 -0.00 0.00 0.00 176.76 175.87 2yuy n ILE 29 N -3.34 0.00 -3.58 -2.13 5.41 -1.26 -4.87 119.36 109.60 2yuy n ILE 29 Ca -0.34 0.00 -0.35 0.00 1.00 0.00 0.00 62.75 63.06 2yuy n ILE 29 Cb 1.04 -0.46 -0.06 0.00 -0.71 0.00 0.00 39.64 39.46 2yuy n ILE 29 CO 0.00 0.00 0.00 -0.69 0.00 0.00 0.00 176.55 175.86 2yuy s VAL 30 N 4.31 5.10 -0.30 1.39 1.01 -1.26 -4.99 120.40 125.66 2yuy s VAL 30 Ca 1.04 0.51 0.03 0.00 0.00 0.00 0.00 61.98 63.55 2yuy s VAL 30 Cb -1.37 -3.65 0.32 0.00 0.00 0.00 0.00 36.38 31.68 2yuy s VAL 30 CO 0.67 0.36 1.43 0.00 0.00 0.00 0.00 175.10 177.55 2yuy n TYR 31 N 1.12 -0.04 -1.91 5.22 0.18 -1.26 -5.10 117.16 115.37 2yuy n TYR 31 Ca -0.10 -0.52 -0.32 0.00 1.88 0.00 0.00 57.90 58.84 2yuy n TYR 31 Cb 0.52 1.09 0.02 0.00 -0.38 0.00 0.00 39.34 40.59 2yuy n TYR 31 CO 0.00 0.00 0.00 -1.25 -2.08 0.00 0.00 176.86 173.53 2yuy s PRO 32 N 0.00 3.24 0.00 -3.48 0.04 -1.26 -4.93 135.00 128.62 2yuy s PRO 32 Ca 0.21 1.10 0.23 0.00 0.04 0.00 0.00 61.00 62.58 2yuy s PRO 32 Cb 0.28 -2.03 1.29 0.00 0.04 0.00 0.00 34.50 34.09 2yuy s PRO 32 CO -0.20 -0.87 1.77 -0.35 0.04 0.00 0.00 177.00 177.40 2yuy n PRO 33 N -2.36 0.54 -1.46 0.56 -0.04 -1.26 -4.99 135.00 125.99 2yuy n PRO 33 Ca 0.08 0.03 0.00 0.00 -0.04 0.00 0.00 63.50 63.58 2yuy n PRO 33 Cb 0.53 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.49 2yuy n PRO 33 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 2yuy n GLU 34 N -1.14 -3.92 -1.73 0.54 1.02 -1.26 -4.65 120.64 109.50 2yuy n GLU 34 Ca 0.14 3.01 -0.15 0.00 -0.02 0.00 0.00 57.16 60.14 2yuy n GLU 34 Cb 0.13 -3.66 -0.05 0.00 -0.02 0.00 0.00 31.44 27.84 2yuy n GLU 34 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 2yuy n SER 35 N -2.10 -4.13 -4.15 1.62 2.88 -1.26 -4.90 113.62 101.58 2yuy n SER 35 Ca 0.00 0.30 -0.16 0.00 -1.33 0.00 0.00 58.87 57.68 2yuy n SER 35 Cb 0.33 -3.69 -0.10 0.00 -0.75 0.00 0.00 64.21 60.00 2yuy n SER 35 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2yuy s ALA 36 N -2.41 1.60 0.22 -1.46 0.00 -1.26 -5.07 121.76 113.38 2yuy s ALA 36 Ca 0.00 -1.79 0.00 0.00 0.00 0.00 0.00 51.96 50.17 2yuy s ALA 36 Cb 0.00 1.21 0.00 0.00 0.00 0.00 0.00 23.12 24.33 2yuy s ALA 36 CO 0.00 -0.52 0.00 -0.89 0.00 0.00 0.00 175.76 174.35 2yuy n ILE 37 N -0.44-12.40 -2.65 0.00 5.41 -1.26 -4.93 119.36 103.09 2yuy n ILE 37 Ca 0.01 3.24 -0.03 0.00 1.00 0.00 0.00 62.75 66.96 2yuy n ILE 37 Cb 0.66 -5.21 -0.00 0.00 -0.71 0.00 0.00 39.64 34.38 2yuy n ILE 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2yuy n GLN 38 N 1.69 0.26 -3.49 0.38 -0.00 -1.26 -5.11 117.38 109.86 2yuy n GLN 38 Ca 0.00 -0.73 -0.04 0.00 -0.00 0.00 0.00 57.00 56.23 2yuy n GLN 38 Cb 0.00 0.00 0.02 0.00 -0.00 0.00 0.00 30.24 30.26 2yuy n GLN 38 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.06 179.03 2yuy n PHE 39 N -0.50 -1.53 0.00 2.61 -1.74 -1.26 -5.16 117.46 109.88 2yuy n PHE 39 Ca -0.23 -1.25 0.00 0.00 -0.56 0.00 0.00 57.45 55.41 2yuy n PHE 39 Cb 0.65 0.61 0.00 0.00 1.52 0.00 0.00 39.48 42.27 2yuy n PHE 39 CO 0.00 0.00 0.00 0.45 -0.56 0.00 0.00 176.76 176.65 2yuy n SER 40 N -1.28 0.00 -3.69 5.98 2.88 -1.26 -5.19 113.62 111.07 2yuy n SER 40 Ca -0.04 0.00 -0.03 0.00 -1.33 0.00 0.00 58.87 57.47 2yuy n SER 40 Cb 0.50 0.00 -0.01 0.00 -0.75 0.00 0.00 64.21 63.95 2yuy n SER 40 CO 0.00 0.00 0.00 -0.31 -1.23 0.00 0.00 175.04 173.50 2yuy s TYR 41 N 0.00 -0.14 -0.25 0.66 2.02 -1.26 -5.13 117.35 113.26 2yuy s TYR 41 Ca 0.00 -0.10 -0.29 0.00 -0.37 0.00 0.00 57.07 56.31 2yuy s TYR 41 Cb 0.00 0.60 0.01 0.00 -0.40 0.00 0.00 41.96 42.17 2yuy s TYR 41 CO 0.00 -0.66 1.10 0.21 -1.57 0.00 0.00 175.55 174.63 2yuy s LYS 42 N -3.06 4.18 -0.16 -0.62 2.36 -1.26 -5.01 119.74 116.17 2yuy s LYS 42 Ca 0.12 1.31 -0.03 0.00 -2.55 0.00 0.00 55.97 54.82 2yuy s LYS 42 Cb -0.00 -3.70 -0.02 0.00 -1.05 0.00 0.00 37.83 33.05 2yuy s LYS 42 CO -0.01 -0.75 -0.05 0.16 1.55 0.00 0.00 175.35 176.25 2yuy s ASP 43 N 1.55 4.62 0.95 1.43 1.47 -1.26 -5.11 116.67 120.32 2yuy s ASP 43 Ca 0.47 -0.19 0.00 0.00 1.18 0.00 0.00 52.55 54.01 2yuy s ASP 43 Cb -0.15 -1.75 0.00 0.00 -0.34 0.00 0.00 42.92 40.68 2yuy s ASP 43 CO 0.11 0.15 0.00 -0.62 0.68 0.00 0.00 175.17 175.49 2yuy n GLU 44 N 3.66 -1.50 -3.83 2.11 1.02 -1.26 -4.98 120.64 115.85 2yuy n GLU 44 Ca -0.18 0.00 -0.35 0.00 -0.02 0.00 0.00 57.16 56.62 2yuy n GLU 44 Cb 0.52 0.00 -0.12 0.00 -0.02 0.00 0.00 31.44 31.82 2yuy n GLU 44 CO 0.00 0.00 0.00 -1.83 1.18 0.00 0.00 177.13 176.48 2yuy s GLU 45 N -2.85 1.98 -0.14 3.49 4.04 -1.26 -5.04 118.70 118.92 2yuy s GLU 45 Ca 0.00 -2.02 -0.30 0.00 0.04 0.00 0.00 54.97 52.69 2yuy s GLU 45 Cb 0.00 -3.51 0.13 0.00 0.02 0.00 0.00 34.13 30.77 2yuy s GLU 45 CO 0.00 -1.07 1.01 0.54 -1.84 0.00 0.00 175.26 173.90 2yuy s ASN 46 N 1.27 -0.34 0.00 0.83 6.03 -1.26 -5.15 114.94 116.32 2yuy s ASN 46 Ca 0.11 0.29 0.00 0.00 -1.03 0.00 0.00 52.86 52.23 2yuy s ASN 46 Cb -0.22 0.29 0.00 0.00 -3.03 0.00 0.00 41.25 38.30 2yuy s ASN 46 CO -0.05 -0.37 0.00 0.61 -2.03 0.00 0.00 177.10 175.27 2yuy n GLY 47 N 0.50 -2.28 3.25 0.45 0.00 -1.26 -5.10 105.19 100.74 2yuy n GLY 47 Ca -0.09 -1.21 0.03 0.00 0.00 0.00 0.00 46.02 44.75 2yuy n GLY 47 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2yuy s ASN 48 N -1.65 -0.33 0.19 1.61 2.47 -1.26 -5.07 114.94 110.89 2yuy s ASN 48 Ca 0.00 0.37 0.00 0.00 0.42 0.00 0.00 52.86 53.65 2yuy s ASN 48 Cb 0.00 1.35 0.00 0.00 -1.45 0.00 0.00 41.25 41.15 2yuy s ASN 48 CO 0.00 -0.06 0.00 0.54 -3.72 0.00 0.00 177.10 173.86 2yuy n ARG 49 N 4.97 0.00 -3.40 0.43 1.74 -1.26 -5.18 116.66 113.96 2yuy n ARG 49 Ca -0.08 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.00 2yuy n ARG 49 Cb 0.54 -0.06 0.00 0.00 -1.02 0.00 0.00 32.46 31.92 2yuy n ARG 49 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2yuy n GLY 50 N 1.71 -0.75 3.67 -0.13 0.00 -1.26 -5.18 105.19 103.25 2yuy n GLY 50 Ca 0.00 -0.85 -0.09 0.00 0.00 0.00 0.00 46.02 45.08 2yuy n GLY 50 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2yuy s GLY 51 N 0.00 0.38 0.36 -0.02 0.00 -1.26 -5.18 107.32 101.60 2yuy s GLY 51 Ca 0.00 -0.73 0.08 0.00 0.00 0.00 0.00 44.72 44.07 2yuy s GLY 51 CO 0.00 -0.47 0.07 1.25 0.00 0.00 0.00 173.10 173.95 2yuy s LYS 52 N -3.88 2.16 0.33 2.90 2.20 -1.26 -5.05 119.74 117.13 2yuy s LYS 52 Ca 0.19 -1.75 0.00 0.00 -0.36 0.00 0.00 55.97 54.05 2yuy s LYS 52 Cb -0.02 -1.97 0.00 0.00 -1.51 0.00 0.00 37.83 34.32 2yuy s LYS 52 CO 0.09 0.07 0.00 1.04 -0.36 0.00 0.00 175.35 176.19 2yuy n GLN 53 N -1.05 -2.05 0.00 4.03 3.00 -1.26 -5.03 117.38 115.03 2yuy n GLN 53 Ca -0.03 1.55 0.00 0.00 -0.01 0.00 0.00 57.00 58.50 2yuy n GLN 53 Cb 0.63 -2.43 0.00 0.00 0.00 0.00 0.00 30.24 28.43 2yuy n GLN 53 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.06 179.95 2yuy n ARG 54 N -3.66 0.00 -1.32 -1.09 1.85 -1.26 -5.16 116.66 106.02 2yuy n ARG 54 Ca -0.03 0.00 0.16 0.00 -1.00 0.00 0.00 57.85 56.98 2yuy n ARG 54 Cb 0.44 0.00 -0.08 0.00 -1.05 0.00 0.00 32.46 31.76 2yuy n ARG 54 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 2yuy n ASN 55 N -1.05 -7.33 -2.90 2.89 3.02 -1.26 -4.92 115.26 103.71 2yuy n ASN 55 Ca 0.00 1.27 -0.13 0.00 -0.03 0.00 0.00 54.58 55.69 2yuy n ASN 55 Cb 0.00 -4.51 0.02 0.00 -0.61 0.00 0.00 39.78 34.69 2yuy n ASN 55 CO 0.00 0.00 0.00 -1.14 -2.62 0.00 0.00 177.26 173.50 2yuy n ARG 56 N -4.15 0.84 0.00 3.52 0.63 -1.26 -5.00 116.66 111.24 2yuy n ARG 56 Ca -0.08 -2.32 0.00 0.00 -0.92 0.00 0.00 57.85 54.53 2yuy n ARG 56 Cb 0.63 -1.34 0.00 0.00 0.45 0.00 0.00 32.46 32.20 2yuy n ARG 56 CO 0.00 0.00 0.00 -0.11 -2.51 0.00 0.00 177.63 175.01 2yuy n LEU 57 N 1.16 0.00 -4.79 6.15 -0.00 -1.26 -5.17 117.00 113.08 2yuy n LEU 57 Ca 0.13 0.00 -0.22 0.00 -0.00 0.00 0.00 56.01 55.92 2yuy n LEU 57 Cb 0.62 0.00 -0.05 0.00 -0.00 0.00 0.00 43.42 44.00 2yuy n LEU 57 CO 0.09 0.00 -0.20 -1.61 -0.00 0.00 0.00 177.39 175.67 2yuy s GLU 58 N 0.00 2.79 0.00 1.96 2.02 -1.26 -5.08 118.70 119.13 2yuy s GLU 58 Ca 0.00 -1.14 0.00 0.00 0.02 0.00 0.00 54.97 53.85 2yuy s GLU 58 Cb 0.00 -2.48 0.00 0.00 0.10 0.00 0.00 34.13 31.75 2yuy s GLU 58 CO 0.00 0.39 0.21 -0.35 0.02 0.00 0.00 175.26 175.53 2yuy n PRO 59 N -1.13 0.00 0.00 0.39 -0.04 -1.26 -4.94 135.00 128.02 2yuy n PRO 59 Ca -0.07 0.35 0.00 0.00 -0.04 0.00 0.00 63.50 63.73 2yuy n PRO 59 Cb 0.58 -0.97 0.00 0.00 -0.04 0.00 0.00 33.50 33.07 2yuy n PRO 59 CO 0.00 0.00 0.00 -1.33 -0.04 0.00 0.00 175.50 174.13 2yuy n MET 60 N -1.54 0.00 -3.78 0.54 2.81 -1.26 -5.07 117.12 108.83 2yuy n MET 60 Ca 0.00 0.00 -0.28 0.00 -1.81 0.00 0.00 57.70 55.61 2yuy n MET 60 Cb 0.00 -0.32 0.01 0.00 -0.71 0.00 0.00 33.22 32.20 2yuy n MET 60 CO 0.00 0.00 0.00 -3.47 1.51 0.00 0.00 175.97 174.01 2yuy n ASP 61 N -2.16 -5.03 -4.65 7.83 2.03 -1.26 -4.97 116.55 108.34 2yuy n ASP 61 Ca 0.00 -0.97 -0.31 0.00 0.52 0.00 0.00 54.79 54.03 2yuy n ASP 61 Cb 0.08 -2.22 -0.08 0.00 -0.72 0.00 0.00 41.12 38.18 2yuy n ASP 61 CO 0.00 0.00 0.00 -0.89 -1.92 0.00 0.00 177.20 174.39 2yuy s THR 62 N -3.17 1.17 -0.45 5.18 2.01 -1.26 -4.97 115.64 114.15 2yuy s THR 62 Ca 0.17 -2.00 0.02 0.00 0.31 0.00 0.00 61.69 60.20 2yuy s THR 62 Cb -0.09 -2.28 0.14 0.00 0.01 0.00 0.00 72.50 70.28 2yuy s THR 62 CO 0.90 0.00 0.24 -0.63 -0.69 0.00 0.00 174.62 174.44 2yuy s ILE 63 N -2.91 1.49 -0.00 1.82 1.09 -1.26 -4.86 121.20 116.56 2yuy s ILE 63 Ca 0.12 -2.61 -0.27 0.00 -1.10 0.00 0.00 60.65 56.78 2yuy s ILE 63 Cb 0.03 -2.04 -0.04 0.00 -1.06 0.00 0.00 42.46 39.35 2yuy s ILE 63 CO 0.06 -0.89 0.87 -0.36 -0.10 0.00 0.00 174.94 174.52 2yuy s PHE 64 N 0.30 3.66 -0.68 3.97 0.08 -1.24 -2.08 117.98 121.99 2yuy s PHE 64 Ca 0.18 1.55 -0.26 0.00 0.12 0.00 0.00 56.93 58.52 2yuy s PHE 64 Cb -0.24 -2.98 -0.02 0.00 -0.57 0.00 0.00 43.02 39.21 2yuy s PHE 64 CO 0.00 0.08 1.80 0.08 -0.10 0.00 0.00 175.22 177.08 2yuy s VAL 65 N 0.70 3.42 0.21 -0.44 1.01 -0.15 -2.12 120.40 123.02 2yuy s VAL 65 Ca 0.46 0.12 -0.17 0.00 0.00 0.00 0.00 61.98 62.38 2yuy s VAL 65 Cb -0.20 -4.09 0.20 0.00 0.00 0.00 0.00 36.38 32.30 2yuy s VAL 65 CO 0.25 -1.05 1.58 0.50 0.00 0.00 0.00 175.10 176.39 2yuy h LYS 66 N 13.78 -0.08 0.00 2.72 1.63 -0.67 0.30 116.57 134.24 2yuy h LYS 66 Ca -0.20 0.01 -0.03 0.00 -0.85 0.00 0.00 60.65 59.58 2yuy h LYS 66 Cb 1.12 0.02 0.01 0.00 -0.60 0.00 0.00 32.23 32.78 2yuy h LYS 66 CO 1.23 -0.06 0.21 1.04 -3.45 0.00 0.00 179.45 178.42 2yuy n GLN 67 N -5.46 0.88 -3.67 1.90 6.02 -1.25 -4.61 117.38 111.19 2yuy n GLN 67 Ca 0.07 -1.75 -0.26 0.00 -0.01 0.00 0.00 57.00 55.05 2yuy n GLN 67 Cb 0.38 2.17 -0.17 0.00 1.02 0.00 0.00 30.24 33.64 2yuy n GLN 67 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 2yuy s VAL 68 N -2.30 0.15 -0.07 5.09 1.01 -1.26 -2.77 120.40 120.26 2yuy s VAL 68 Ca 0.13 -0.23 -0.39 0.00 0.00 0.00 0.00 61.98 61.49 2yuy s VAL 68 Cb -0.04 -0.69 -0.17 0.00 0.00 0.00 0.00 36.38 35.48 2yuy s VAL 68 CO 0.09 -0.18 1.42 1.17 0.00 0.00 0.00 175.10 177.60 2yuy n LYS 69 N 5.19 0.87 -2.18 2.72 4.81 -1.26 -4.76 118.16 123.54 2yuy n LYS 69 Ca -0.07 0.31 -0.31 0.00 -0.87 0.00 0.00 58.31 57.38 2yuy n LYS 69 Cb 0.49 -1.93 -0.05 0.00 0.02 0.00 0.00 35.03 33.56 2yuy n LYS 69 CO 0.00 0.00 0.00 -2.00 1.17 0.00 0.00 177.40 176.57 2yuy s GLU 70 N 1.37 2.83 0.00 1.64 -6.30 -1.26 -1.89 118.70 115.09 2yuy s GLU 70 Ca 0.91 -0.62 0.00 0.00 -2.50 0.00 0.00 54.97 52.76 2yuy s GLU 70 Cb -1.08 -5.16 0.00 0.00 0.00 0.00 0.00 34.13 27.89 2yuy s GLU 70 CO 0.56 -3.14 0.00 0.41 0.02 0.00 0.00 175.26 173.11 2yuy n GLY 71 N 6.71 1.83 0.00 -1.50 0.00 -1.26 -5.14 105.19 105.83 2yuy n GLY 71 Ca 0.39 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.41 2yuy n GLY 71 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2yuy n GLY 72 N -0.47 1.92 0.21 -0.02 0.00 -0.79 -4.98 105.19 101.06 2yuy n GLY 72 Ca 0.00 -2.12 -0.19 0.00 0.00 0.00 0.00 46.02 43.71 2yuy n GLY 72 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yuy h PRO 73 N 0.00 0.74 -0.06 1.61 0.13 -1.89 -2.87 132.00 129.67 2yuy h PRO 73 Ca 0.00 -0.72 -0.01 0.00 -0.87 0.00 0.00 66.00 64.39 2yuy h PRO 73 Cb 0.00 0.19 -0.00 0.00 0.13 0.00 0.00 31.00 31.32 2yuy h PRO 73 CO 0.00 1.31 -0.01 0.00 -0.23 0.00 0.00 178.00 179.06 2yuy h ALA 74 N 0.45 0.08 -0.85 -0.56 0.00 -1.90 -1.08 119.26 115.40 2yuy h ALA 74 Ca -0.10 -0.20 0.17 0.00 0.00 0.00 0.00 54.91 54.77 2yuy h ALA 74 Cb 1.60 -0.02 -0.10 0.00 0.00 0.00 0.00 17.79 19.26 2yuy h ALA 74 CO 0.19 -0.21 0.40 0.35 0.00 0.00 0.00 179.25 179.98 2yuy h PHE 75 N -0.22 0.69 0.19 0.00 3.57 -1.75 -1.20 116.94 118.22 2yuy h PHE 75 Ca 0.02 0.04 -0.01 0.00 3.53 0.00 0.00 57.97 61.54 2yuy h PHE 75 Cb 0.40 -0.18 0.00 0.00 2.79 0.00 0.00 35.95 38.96 2yuy h PHE 75 CO 0.05 0.09 -0.09 0.93 -2.23 0.00 0.00 178.31 177.06 2yuy h GLU 76 N 0.53 -0.25 -1.19 1.11 4.39 -1.38 -2.71 114.58 115.09 2yuy h GLU 76 Ca 0.49 0.02 0.34 0.00 0.34 0.00 0.00 59.36 60.55 2yuy h GLU 76 Cb 0.78 0.06 -0.05 0.00 -0.10 0.00 0.00 28.75 29.44 2yuy h GLU 76 CO -0.42 0.10 1.06 0.00 -1.16 0.00 0.00 179.01 178.59 2yuy h ALA 77 N 0.06 3.08 0.00 3.43 0.00 -0.27 -3.42 119.26 122.13 2yuy h ALA 77 Ca -0.03 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.84 2yuy h ALA 77 Cb 0.46 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.34 2yuy h ALA 77 CO 0.04 -1.67 0.00 0.41 0.00 0.00 0.00 179.25 178.03 2yuy n GLY 78 N -1.74 1.05 3.50 0.00 0.00 -0.77 -4.89 105.19 102.34 2yuy n GLY 78 Ca 0.26 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.96 2yuy n GLY 78 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2yuy n LEU 79 N 0.00 0.74 0.00 0.99 7.94 -0.54 -5.00 117.00 121.12 2yuy n LEU 79 Ca 0.00 0.29 -0.05 0.00 -1.11 0.00 0.00 56.01 55.14 2yuy n LEU 79 Cb 0.00 -1.28 -0.02 0.00 0.53 0.00 0.00 43.42 42.65 2yuy n LEU 79 CO 0.00 -3.05 -0.03 0.00 -1.11 0.00 0.00 177.39 173.20 2yuy s THR 81 N -2.07 4.89 0.00 0.00 -4.23 -1.26 -4.27 115.64 108.69 2yuy s THR 81 Ca 0.07 -0.02 0.00 0.00 -1.18 0.00 0.00 61.69 60.56 2yuy s THR 81 Cb 0.00 -3.14 0.00 0.00 1.34 0.00 0.00 72.50 70.71 2yuy s THR 81 CO 0.05 0.55 0.00 0.61 -0.54 0.00 0.00 174.62 175.29 2yuy n GLY 82 N 2.63 0.61 3.75 3.99 0.00 0.11 -4.90 105.19 111.38 2yuy n GLY 82 Ca -0.18 -0.40 -0.40 0.00 0.00 0.00 0.00 46.02 45.03 2yuy n GLY 82 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2yuy s ASP 83 N -2.37 7.41 -0.12 1.61 1.01 -1.26 -4.59 116.67 118.36 2yuy s ASP 83 Ca 0.00 1.68 -0.16 0.00 0.71 0.00 0.00 52.55 54.78 2yuy s ASP 83 Cb 0.00 -2.53 -0.05 0.00 1.01 0.00 0.00 42.92 41.35 2yuy s ASP 83 CO 0.00 0.06 0.39 -0.13 0.21 0.00 0.00 175.17 175.70 2yuy s ARG 84 N -0.48 4.24 0.14 8.23 0.52 -1.25 -0.98 118.95 129.37 2yuy s ARG 84 Ca 0.41 0.30 -0.27 0.00 -0.52 0.00 0.00 55.73 55.65 2yuy s ARG 84 Cb -0.23 -3.40 -0.07 0.00 0.52 0.00 0.00 34.95 31.77 2yuy s ARG 84 CO 0.27 0.26 0.83 0.42 0.02 0.00 0.00 175.30 177.11 2yuy s ILE 85 N 0.33 4.43 -0.01 1.52 -1.09 -0.88 -3.72 121.20 121.77 2yuy s ILE 85 Ca 0.22 1.81 0.00 0.00 -2.23 0.00 0.00 60.65 60.45 2yuy s ILE 85 Cb -0.14 -4.20 -0.01 0.00 -1.58 0.00 0.00 42.46 36.53 2yuy s ILE 85 CO 0.08 0.45 -0.01 2.30 -1.23 0.00 0.00 174.94 176.53 2yuy n ILE 86 N 2.07 0.07 -4.28 2.92 -5.35 0.14 -4.56 119.36 110.37 2yuy n ILE 86 Ca -0.03 -0.03 -0.16 0.00 -0.27 0.00 0.00 62.75 62.26 2yuy n ILE 86 Cb 0.49 -0.60 -0.10 0.00 -1.74 0.00 0.00 39.64 37.68 2yuy n ILE 86 CO 0.00 0.00 0.00 -0.54 -1.76 0.00 0.00 176.55 174.25 2yuy s LYS 87 N -2.03 1.15 -0.24 6.28 1.02 -1.22 -2.51 119.74 122.19 2yuy s LYS 87 Ca -0.02 -1.45 -0.13 0.00 0.02 0.00 0.00 55.97 54.39 2yuy s LYS 87 Cb 0.00 -0.85 0.08 0.00 -0.52 0.00 0.00 37.83 36.54 2yuy s LYS 87 CO 0.03 0.13 0.59 0.08 -0.92 0.00 0.00 175.35 175.26 2yuy s VAL 88 N -2.95 -0.14 -0.98 3.17 1.01 -1.26 -2.30 120.40 116.95 2yuy s VAL 88 Ca 0.17 0.04 0.00 0.00 0.00 0.00 0.00 61.98 62.19 2yuy s VAL 88 Cb -0.00 -0.87 0.00 0.00 0.00 0.00 0.00 36.38 35.51 2yuy s VAL 88 CO 0.03 0.02 0.00 0.59 0.00 0.00 0.00 175.10 175.74 2yuy n ASN 89 N 4.47 -3.35 -3.83 3.32 5.03 0.43 0.18 115.26 121.51 2yuy n ASN 89 Ca -0.20 0.24 -0.28 0.00 0.87 0.00 0.00 54.58 55.21 2yuy n ASN 89 Cb 0.56 -2.95 0.04 0.00 -1.02 0.00 0.00 39.78 36.41 2yuy n ASN 89 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2yuy n GLY 90 N -0.61 -0.50 0.34 7.41 0.00 -1.26 -4.85 105.19 105.72 2yuy n GLY 90 Ca -0.12 0.20 0.07 0.00 0.00 0.00 0.00 46.02 46.17 2yuy n GLY 90 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2yuy n GLU 91 N -4.73 1.74 -2.69 1.61 -0.58 0.13 -5.06 120.64 111.06 2yuy n GLU 91 Ca 0.01 -0.80 -0.02 0.00 -0.42 0.00 0.00 57.16 55.93 2yuy n GLU 91 Cb 0.54 -1.20 -0.02 0.00 -0.57 0.00 0.00 31.44 30.19 2yuy n GLU 91 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 2yuy n SER 92 N -0.06 -4.81 -1.16 1.62 2.88 -1.26 -4.87 113.62 105.97 2yuy n SER 92 Ca 0.06 1.37 0.07 0.00 -1.33 0.00 0.00 58.87 59.04 2yuy n SER 92 Cb 0.29 -5.16 0.25 0.00 -0.75 0.00 0.00 64.21 58.84 2yuy n SER 92 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 2yuy n VAL 93 N 1.18 1.20 -1.96 2.46 0.24 -1.04 -4.81 118.33 115.59 2yuy n VAL 93 Ca -0.18 -0.80 -0.24 0.00 -2.04 0.00 0.00 64.34 61.08 2yuy n VAL 93 Cb 0.29 0.05 -0.05 0.00 -1.47 0.00 0.00 33.84 32.66 2yuy n VAL 93 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 2yuy s ILE 94 N -1.69 3.37 0.00 1.34 1.09 -1.13 -0.65 121.20 123.53 2yuy s ILE 94 Ca 0.36 -0.30 0.00 0.00 -1.10 0.00 0.00 60.65 59.60 2yuy s ILE 94 Cb 0.22 -3.83 0.00 0.00 -1.06 0.00 0.00 42.46 37.79 2yuy s ILE 94 CO 0.18 -0.78 0.00 0.61 -0.10 0.00 0.00 174.94 174.85 2yuy n GLY 95 N 6.84 1.11 1.17 6.18 0.00 -1.26 -5.11 105.19 114.12 2yuy n GLY 95 Ca 0.41 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.35 2yuy n GLY 95 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2yuy n LYS 96 N -0.78 0.06 -4.39 1.61 5.02 0.17 -5.12 118.16 114.74 2yuy n LYS 96 Ca 0.00 -0.74 -0.21 0.00 -2.02 0.00 0.00 58.31 55.34 2yuy n LYS 96 Cb 0.00 -0.29 -0.10 0.00 -0.02 0.00 0.00 35.03 34.61 2yuy n LYS 96 CO 0.00 0.00 0.00 -0.08 -0.52 0.00 0.00 177.40 176.80 2yuy s THR 97 N -1.24 2.04 0.18 -0.18 -1.32 -1.26 -5.00 115.64 108.86 2yuy s THR 97 Ca 0.21 -2.21 -0.23 0.00 -1.21 0.00 0.00 61.69 58.25 2yuy s THR 97 Cb -0.01 -2.10 0.08 0.00 -1.51 0.00 0.00 72.50 68.97 2yuy s THR 97 CO 0.14 -0.45 1.57 0.22 -2.21 0.00 0.00 174.62 173.90 2yuy h TYR 98 N 2.63 -1.14 -0.82 9.09 3.20 -1.94 0.31 116.97 128.30 2yuy h TYR 98 Ca -0.40 0.08 0.20 0.00 3.14 0.00 0.00 58.73 61.75 2yuy h TYR 98 Cb 1.23 0.59 -0.14 0.00 1.54 0.00 0.00 36.73 39.95 2yuy h TYR 98 CO 0.74 -0.41 0.13 1.03 -1.64 0.00 0.00 178.16 178.01 2yuy h SER 99 N -0.18 -0.16 0.10 -2.11 0.87 -1.98 1.05 113.55 111.14 2yuy h SER 99 Ca 0.21 0.19 -0.00 0.00 -1.23 0.00 0.00 61.79 60.96 2yuy h SER 99 Cb 0.56 0.30 0.00 0.00 -0.44 0.00 0.00 62.40 62.82 2yuy h SER 99 CO -0.71 -0.16 -0.05 1.56 -0.53 0.00 0.00 176.83 176.94 2yuy h GLN 100 N 0.17 -0.13 -1.18 2.24 1.08 -0.86 0.40 115.11 116.83 2yuy h GLN 100 Ca 0.48 0.01 0.34 0.00 -1.45 0.00 0.00 58.65 58.03 2yuy h GLN 100 Cb 0.92 0.03 -0.09 0.00 -0.05 0.00 0.00 27.48 28.28 2yuy h GLN 100 CO -0.66 -0.09 0.79 -0.39 -0.95 0.00 0.00 178.83 177.53 2yuy h VAL 101 N -0.14 0.38 0.90 -0.54 -1.51 -0.54 0.15 116.25 114.95 2yuy h VAL 101 Ca -0.01 -0.07 -0.04 0.00 -1.23 0.00 0.00 66.70 65.34 2yuy h VAL 101 Cb 0.10 0.15 0.01 0.00 -2.13 0.00 0.00 31.29 29.42 2yuy h VAL 101 CO 0.02 0.04 -0.43 0.40 -1.23 0.00 0.00 177.57 176.37 2yuy h ILE 102 N 0.21 0.00 -0.92 7.19 1.08 0.14 -1.78 117.51 123.43 2yuy h ILE 102 Ca 0.65 -0.05 0.23 0.00 -0.39 0.00 0.00 64.86 65.30 2yuy h ILE 102 Cb 2.03 0.00 -0.13 0.00 -3.07 0.00 0.00 36.82 35.66 2yuy h ILE 102 CO -0.24 0.00 0.44 0.00 -0.69 0.00 0.00 178.15 177.66 2yuy h ALA 103 N -1.40 1.53 -0.39 1.87 0.00 0.15 0.45 119.26 121.46 2yuy h ALA 103 Ca -0.12 0.16 0.07 0.00 0.00 0.00 0.00 54.91 55.02 2yuy h ALA 103 Cb 0.92 0.12 -0.06 0.00 0.00 0.00 0.00 17.79 18.77 2yuy h ALA 103 CO 0.20 -0.34 -0.01 -0.07 0.00 0.00 0.00 179.25 179.03 2yuy h LEU 104 N 0.43 -0.19 -1.15 0.00 3.38 -0.81 1.60 115.31 118.57 2yuy h LEU 104 Ca 0.58 0.09 -0.00 0.00 0.09 0.00 0.00 57.88 58.64 2yuy h LEU 104 Cb 1.12 0.17 -0.04 0.00 0.09 0.00 0.00 40.66 42.00 2yuy h LEU 104 CO -0.52 -0.06 0.47 0.40 0.09 0.00 0.00 178.44 178.82 2yuy h ILE 105 N 0.09 1.22 0.00 1.22 2.04 0.69 0.15 117.51 122.91 2yuy h ILE 105 Ca 0.19 -0.47 0.00 0.00 1.00 0.00 0.00 64.86 65.58 2yuy h ILE 105 Cb 0.28 0.12 0.00 0.00 -0.74 0.00 0.00 36.82 36.48 2yuy h ILE 105 CO -0.33 0.23 0.00 1.56 0.00 0.00 0.00 178.15 179.60 2yuy h GLN 106 N 1.07 0.00 -0.44 2.37 4.20 0.89 -2.80 115.11 120.40 2yuy h GLN 106 Ca 0.28 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.97 2yuy h GLN 106 Cb -0.04 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.72 2yuy h GLN 106 CO -0.05 0.00 0.02 0.09 -0.67 0.00 0.00 178.83 178.22 2yuy n ASN 107 N -3.06 4.75 0.12 1.46 3.02 0.52 -4.48 115.26 117.60 2yuy n ASN 107 Ca 0.03 -3.02 0.09 0.00 -0.03 0.00 0.00 54.58 51.65 2yuy n ASN 107 Cb 0.44 -0.63 0.46 0.00 -0.61 0.00 0.00 39.78 39.45 2yuy n ASN 107 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 2yuy n SER 108 N -0.01 0.46 0.00 6.41 7.64 0.31 -4.84 113.62 123.60 2yuy n SER 108 Ca 0.26 0.69 0.00 0.00 1.01 0.00 0.00 58.87 60.83 2yuy n SER 108 Cb 1.07 -0.76 0.00 0.00 -1.01 0.00 0.00 64.21 63.51 2yuy n SER 108 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 2yuy n ASP 109 N -2.10 0.00 -0.05 6.43 2.03 -1.26 -2.29 116.55 119.31 2yuy n ASP 109 Ca -0.00 0.00 -0.04 0.00 0.52 0.00 0.00 54.79 55.27 2yuy n ASP 109 Cb 0.07 0.00 -0.01 0.00 -0.72 0.00 0.00 41.12 40.45 2yuy n ASP 109 CO 0.00 0.00 0.00 0.41 -1.92 0.00 0.00 177.20 175.69 2yuy n THR 110 N 0.00 0.99 -4.30 5.18 -1.04 -1.26 -4.86 114.28 108.99 2yuy n THR 110 Ca 0.00 0.29 -0.23 0.00 -2.04 0.00 0.00 64.05 62.07 2yuy n THR 110 Cb 0.00 -2.11 -0.08 0.00 -1.82 0.00 0.00 70.33 66.33 2yuy n THR 110 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 2yuy s THR 111 N -1.97 3.18 -0.26 12.58 -4.23 -0.97 -1.30 115.64 122.67 2yuy s THR 111 Ca -0.13 -1.95 0.02 0.00 -1.18 0.00 0.00 61.69 58.45 2yuy s THR 111 Cb 0.02 -2.79 0.06 0.00 1.34 0.00 0.00 72.50 71.13 2yuy s THR 111 CO 0.19 -0.33 -0.07 -0.22 -0.54 0.00 0.00 174.62 173.64 2yuy s LEU 112 N -3.68 3.23 -0.06 4.79 1.98 0.32 -4.56 118.68 120.70 2yuy s LEU 112 Ca 0.32 -1.39 -0.20 0.00 -2.89 0.00 0.00 54.13 49.97 2yuy s LEU 112 Cb -0.05 -1.41 -0.04 0.00 0.66 0.00 0.00 46.19 45.34 2yuy s LEU 112 CO 0.20 -0.23 0.58 -0.70 -1.89 0.00 0.00 176.35 174.31 2yuy s GLU 113 N 1.20 4.35 0.48 1.98 2.12 -1.26 -0.00 118.70 127.56 2yuy s GLU 113 Ca -0.06 0.68 0.02 0.00 0.36 0.00 0.00 54.97 55.97 2yuy s GLU 113 Cb -0.19 -3.40 -0.01 0.00 0.26 0.00 0.00 34.13 30.78 2yuy s GLU 113 CO -0.06 0.22 0.06 -0.51 -0.54 0.00 0.00 175.26 174.43 2yuy s LEU 114 N 0.35 2.13 -0.29 2.70 1.43 0.23 -0.43 118.68 124.81 2yuy s LEU 114 Ca 0.31 -1.70 -0.17 0.00 -1.03 0.00 0.00 54.13 51.55 2yuy s LEU 114 Cb -0.17 -0.43 0.13 0.00 0.03 0.00 0.00 46.19 45.74 2yuy s LEU 114 CO 0.15 -0.92 0.91 -0.44 0.23 0.00 0.00 176.35 176.27 2yuy s SER 115 N -3.77 -0.61 0.16 2.29 0.01 -0.97 -1.85 113.70 108.95 2yuy s SER 115 Ca 0.12 1.00 0.01 0.00 1.31 0.00 0.00 55.95 58.39 2yuy s SER 115 Cb 0.01 1.23 -0.01 0.00 0.21 0.00 0.00 66.02 67.47 2yuy s SER 115 CO 0.07 -0.16 0.05 1.33 0.41 0.00 0.00 173.24 174.95 2yuy n VAL 116 N 3.72 0.00 -3.73 3.43 0.24 -1.10 0.23 118.33 121.12 2yuy n VAL 116 Ca -0.18 -0.93 -0.30 0.00 -2.04 0.00 0.00 64.34 60.89 2yuy n VAL 116 Cb 0.58 0.32 -0.14 0.00 -1.47 0.00 0.00 33.84 33.13 2yuy n VAL 116 CO 0.00 0.00 0.00 -0.04 -2.14 0.00 0.00 176.83 174.65 2yuy s MET 117 N -2.61 0.86 0.47 7.34 -1.94 -1.24 -1.40 119.30 120.77 2yuy s MET 117 Ca 0.08 -1.31 -0.21 0.00 -1.71 0.00 0.00 55.69 52.54 2yuy s MET 117 Cb 0.00 -2.09 -0.09 0.00 2.01 0.00 0.00 34.83 34.67 2yuy s MET 117 CO 0.05 -1.03 1.04 -1.25 -0.01 0.00 0.00 175.02 173.83 2yuy s PRO 118 N 1.31 3.87 0.32 2.03 0.04 -1.26 -4.88 135.00 136.43 2yuy s PRO 118 Ca 0.12 1.40 0.10 0.00 0.04 0.00 0.00 61.00 62.65 2yuy s PRO 118 Cb -0.19 -2.18 -0.06 0.00 0.04 0.00 0.00 34.50 32.11 2yuy s PRO 118 CO -0.18 -0.38 -0.09 0.15 0.04 0.00 0.00 177.00 176.54 2yuy s LYS 119 N -3.08 1.88 -0.40 4.56 -0.14 -1.26 -5.04 119.74 116.25 2yuy s LYS 119 Ca 0.65 -1.81 -0.35 0.00 -1.36 0.00 0.00 55.97 53.11 2yuy s LYS 119 Cb -0.18 -1.81 -0.12 0.00 -1.68 0.00 0.00 37.83 34.05 2yuy s LYS 119 CO 0.21 0.21 2.24 -3.47 -0.76 0.00 0.00 175.35 173.78 2yuy n ASP 120 N -0.79 1.98 -0.78 2.83 -0.08 -1.26 -4.29 116.55 114.17 2yuy n ASP 120 Ca -0.05 0.34 0.00 0.00 -1.51 0.00 0.00 54.79 53.57 2yuy n ASP 120 Cb 0.62 -1.25 0.00 0.00 2.34 0.00 0.00 41.12 42.83 2yuy n ASP 120 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 2yuy n SER 121 N 10.27 -4.73 0.00 1.67 7.64 -1.26 -5.08 113.62 122.14 2yuy n SER 121 Ca 0.43 0.60 0.00 0.00 1.01 0.00 0.00 58.87 60.91 2yuy n SER 121 Cb 0.23 -1.82 0.00 0.00 -1.01 0.00 0.00 64.21 61.62 2yuy n SER 121 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2yuy n GLY 122 N -0.90 -2.15 3.80 0.23 0.00 -1.26 -5.15 105.19 99.76 2yuy n GLY 122 Ca 0.00 0.71 -0.30 0.00 0.00 0.00 0.00 46.02 46.43 2yuy n GLY 122 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2yuy s PRO 123 N 0.00 2.01 0.00 1.61 0.04 -1.26 -5.05 135.00 132.36 2yuy s PRO 123 Ca 0.00 0.61 0.00 0.00 0.04 0.00 0.00 61.00 61.65 2yuy s PRO 123 Cb 0.00 -1.91 0.00 0.00 0.04 0.00 0.00 34.50 32.63 2yuy s PRO 123 CO 0.00 -1.66 0.00 0.45 0.04 0.00 0.00 177.00 175.83 2yuy n SER 124 N -3.46 0.00 -3.97 6.66 2.88 -1.26 -5.17 113.62 109.30 2yuy n SER 124 Ca 0.07 0.00 -0.08 0.00 -1.33 0.00 0.00 58.87 57.53 2yuy n SER 124 Cb 0.56 0.00 -0.08 0.00 -0.75 0.00 0.00 64.21 63.94 2yuy n SER 124 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2yuy s SER 125 N 0.00 0.27 0.00 -3.46 0.15 -1.26 -5.30 113.70 104.10 2yuy s SER 125 Ca 0.00 -0.82 0.00 0.00 0.70 0.00 0.00 55.95 55.83 2yuy s SER 125 Cb 0.00 0.29 0.00 0.00 -1.71 0.00 0.00 66.02 64.60 2yuy s SER 125 CO 0.00 -0.69 0.00 0.61 1.20 0.00 0.00 173.24 174.36