#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yuy n SER 2 N 0.00 -5.95 0.00 1.61 2.88 -1.26 -5.06 113.62 105.84 2yuy n SER 2 Ca 0.00 0.69 0.00 0.00 -1.33 0.00 0.00 58.87 58.23 2yuy n SER 2 Cb 0.00 -3.19 0.00 0.00 -0.75 0.00 0.00 64.21 60.27 2yuy n SER 2 CO 0.00 0.00 0.00 -0.24 -1.23 0.00 0.00 175.04 173.57 2yuy n SER 3 N -3.72 0.00 0.00 -3.46 2.88 -1.26 -5.07 113.62 103.00 2yuy n SER 3 Ca -0.02 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.52 2yuy n SER 3 Cb 0.46 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.92 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 -0.20 -0.33 1.25 0.46 0.00 -1.26 -5.15 105.19 99.96 2yuy n GLY 4 Ca 0.00 0.36 0.15 0.00 0.00 0.00 0.00 46.02 46.53 2yuy n GLY 4 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2yuy n SER 5 N 0.00 -6.86 -1.49 1.61 7.64 -1.26 -5.01 113.62 108.25 2yuy n SER 5 Ca 0.00 1.22 0.05 0.00 1.01 0.00 0.00 58.87 61.15 2yuy n SER 5 Cb 0.00 -4.26 -0.03 0.00 -1.01 0.00 0.00 64.21 58.91 2yuy n SER 5 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2yuy n SER 6 N -4.03 -8.05 -3.78 6.43 7.64 -1.26 -4.95 113.62 105.62 2yuy n SER 6 Ca -0.08 1.71 -0.26 0.00 1.01 0.00 0.00 58.87 61.25 2yuy n SER 6 Cb 0.59 -4.90 -0.17 0.00 -1.01 0.00 0.00 64.21 58.73 2yuy n SER 6 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2yuy s GLY 7 N -5.90 0.67 0.00 0.23 0.00 -1.26 -4.98 107.32 96.07 2yuy s GLY 7 Ca 0.00 -0.49 0.00 0.00 0.00 0.00 0.00 44.72 44.23 2yuy s GLY 7 CO 0.00 1.20 0.00 0.61 0.00 0.00 0.00 173.10 174.91 2yuy n GLY 8 N 5.05 -1.11 3.79 0.20 0.00 -1.26 -5.14 105.19 106.72 2yuy n GLY 8 Ca -0.09 0.41 -0.29 0.00 0.00 0.00 0.00 46.02 46.05 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 0.00 1.00 0.17 1.61 0.04 -1.26 -5.05 135.00 131.51 2yuy s PRO 9 Ca 0.00 0.22 -0.08 0.00 0.04 0.00 0.00 61.00 61.19 2yuy s PRO 9 Cb 0.00 -1.83 -0.06 0.00 0.04 0.00 0.00 34.50 32.65 2yuy s PRO 9 CO 0.00 -2.28 0.46 0.21 0.04 0.00 0.00 177.00 175.43 2yuy s LYS 10 N -5.33 3.73 -0.02 4.56 2.47 -1.15 -5.04 119.74 118.96 2yuy s LYS 10 Ca 0.65 0.12 0.02 0.00 -1.56 0.00 0.00 55.97 55.20 2yuy s LYS 10 Cb -0.14 -2.79 0.01 0.00 -1.46 0.00 0.00 37.83 33.45 2yuy s LYS 10 CO 0.53 0.42 -0.05 0.99 0.16 0.00 0.00 175.35 177.40 2yuy s THR 11 N -1.68 0.48 -0.07 3.43 2.01 -1.26 -3.42 115.64 115.12 2yuy s THR 11 Ca 0.43 -0.20 -0.03 0.00 0.31 0.00 0.00 61.69 62.20 2yuy s THR 11 Cb -0.12 -0.45 0.04 0.00 0.01 0.00 0.00 72.50 71.98 2yuy s THR 11 CO 0.22 0.16 0.15 0.68 -0.69 0.00 0.00 174.62 175.14 2yuy s VAL 12 N 0.24 -0.16 0.15 3.82 -7.23 -1.05 -4.95 120.40 111.22 2yuy s VAL 12 Ca -0.03 0.28 0.04 0.00 -1.81 0.00 0.00 61.98 60.46 2yuy s VAL 12 Cb -0.07 -0.26 -0.04 0.00 0.56 0.00 0.00 36.38 36.57 2yuy s VAL 12 CO -0.00 0.12 0.18 -0.89 -0.31 0.00 0.00 175.10 174.19 2yuy s THR 13 N 1.77 4.78 0.25 5.32 2.01 -1.26 0.77 115.64 129.28 2yuy s THR 13 Ca -0.02 -0.90 0.01 0.00 0.31 0.00 0.00 61.69 61.09 2yuy s THR 13 Cb -0.12 -3.43 -0.05 0.00 0.01 0.00 0.00 72.50 68.92 2yuy s THR 13 CO -0.06 -0.07 0.11 -0.76 -0.69 0.00 0.00 174.62 173.16 2yuy s LEU 14 N -3.03 1.52 -0.08 4.42 1.02 -0.39 -4.31 118.68 117.82 2yuy s LEU 14 Ca 0.32 -1.41 -0.02 0.00 0.02 0.00 0.00 54.13 53.04 2yuy s LEU 14 Cb -0.11 0.13 0.04 0.00 0.02 0.00 0.00 46.19 46.27 2yuy s LEU 14 CO 0.25 -0.78 0.05 -0.54 0.02 0.00 0.00 176.35 175.35 2yuy s LYS 15 N -4.03 0.17 -0.44 1.70 1.02 -1.26 -1.80 119.74 115.10 2yuy s LYS 15 Ca 0.38 0.17 -0.42 0.00 0.02 0.00 0.00 55.97 56.12 2yuy s LYS 15 Cb 0.07 -0.99 -0.17 0.00 -0.52 0.00 0.00 37.83 36.23 2yuy s LYS 15 CO 0.14 -0.41 2.06 -2.13 -0.92 0.00 0.00 175.35 174.09 2yuy n ARG 16 N 5.24 0.40 0.00 1.68 0.63 0.17 -4.70 116.66 120.07 2yuy n ARG 16 Ca -0.05 0.12 0.00 0.00 -0.92 0.00 0.00 57.85 57.00 2yuy n ARG 16 Cb 0.50 -1.82 0.00 0.00 0.45 0.00 0.00 32.46 31.59 2yuy n ARG 16 CO 0.00 0.00 0.00 -2.37 -2.51 0.00 0.00 177.63 172.75 2yuy n THR 17 N 6.26 0.00 -4.49 5.15 5.66 -1.26 -5.00 114.28 120.61 2yuy n THR 17 Ca 0.46 0.00 -0.24 0.00 -3.05 0.00 0.00 64.05 61.22 2yuy n THR 17 Cb 0.05 -0.80 -0.08 0.00 -1.55 0.00 0.00 70.33 67.95 2yuy n THR 17 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 175.07 171.47 2yuy s SER 18 N -4.42 2.61 0.24 1.09 0.15 -1.26 -5.06 113.70 107.04 2yuy s SER 18 Ca 0.00 -1.64 -0.30 0.00 0.70 0.00 0.00 55.95 54.71 2yuy s SER 18 Cb 0.00 0.44 -0.10 0.00 -1.71 0.00 0.00 66.02 64.65 2yuy s SER 18 CO 0.00 -0.90 1.48 -1.10 1.20 0.00 0.00 173.24 173.92 2yuy s GLN 19 N -3.73 4.24 -1.56 5.44 -1.52 -1.26 -1.89 119.66 119.38 2yuy s GLN 19 Ca 0.26 2.34 0.00 0.00 -1.95 0.00 0.00 55.36 56.01 2yuy s GLN 19 Cb 0.03 -3.11 0.00 0.00 -0.22 0.00 0.00 33.01 29.71 2yuy s GLN 19 CO 0.15 -0.47 0.00 0.41 -0.25 0.00 0.00 175.29 175.13 2yuy n GLY 20 N 2.48 0.18 1.04 3.09 0.00 -1.26 -4.65 105.19 106.06 2yuy n GLY 20 Ca 0.08 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.22 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 -3.21 -2.36 0.00 1.61 3.72 -0.79 -4.57 117.46 111.85 2yuy n PHE 21 Ca -0.19 1.21 0.00 0.00 -0.05 0.00 0.00 57.45 58.42 2yuy n PHE 21 Cb 0.62 -2.15 0.00 0.00 -0.94 0.00 0.00 39.48 37.02 2yuy n PHE 21 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2yuy n GLY 22 N -3.24 -3.06 3.12 1.37 0.00 -1.26 -4.76 105.19 97.35 2yuy n GLY 22 Ca -0.01 0.18 -0.23 0.00 0.00 0.00 0.00 46.02 45.96 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 -0.84 -2.70 -3.53 1.61 -1.74 -1.26 -4.07 117.46 104.94 2yuy n PHE 23 Ca 0.00 -0.26 -0.14 0.00 -0.56 0.00 0.00 57.45 56.49 2yuy n PHE 23 Cb 0.00 -1.40 -0.04 0.00 1.52 0.00 0.00 39.48 39.56 2yuy n PHE 23 CO 0.00 0.00 0.00 -0.08 -0.56 0.00 0.00 176.76 176.12 2yuy s THR 24 N -2.11 0.02 0.41 1.97 -1.32 -1.09 -4.90 115.64 108.62 2yuy s THR 24 Ca 0.49 -0.16 0.07 0.00 -1.21 0.00 0.00 61.69 60.88 2yuy s THR 24 Cb -0.09 -1.00 -0.05 0.00 -1.51 0.00 0.00 72.50 69.85 2yuy s THR 24 CO 0.44 -0.09 0.19 -0.76 -2.21 0.00 0.00 174.62 172.20 2yuy s LEU 25 N -2.09 3.14 -0.15 9.08 2.01 -1.26 -1.50 118.68 127.90 2yuy s LEU 25 Ca -0.04 -1.04 -0.05 0.00 0.01 0.00 0.00 54.13 53.01 2yuy s LEU 25 Cb -0.00 -1.50 0.08 0.00 0.01 0.00 0.00 46.19 44.77 2yuy s LEU 25 CO -0.03 -0.54 0.28 -0.60 1.01 0.00 0.00 176.35 176.46 2yuy s ARG 26 N -3.92 0.18 -0.31 1.70 3.52 -1.23 -4.86 118.95 114.04 2yuy s ARG 26 Ca 0.41 0.68 0.01 0.00 -0.13 0.00 0.00 55.73 56.71 2yuy s ARG 26 Cb 0.03 -0.20 0.31 0.00 -1.56 0.00 0.00 34.95 33.53 2yuy s ARG 26 CO 0.23 -0.36 1.39 1.58 -0.81 0.00 0.00 175.30 177.33 2yuy n HIS 27 N 5.35 -0.11 1.09 5.12 -0.00 -1.26 -4.52 115.22 120.90 2yuy n HIS 27 Ca -0.06 -0.55 0.12 0.00 0.46 0.00 0.00 57.72 57.68 2yuy n HIS 27 Cb 0.50 1.09 0.14 0.00 -0.12 0.00 0.00 29.99 31.59 2yuy n HIS 27 CO 0.00 0.00 0.00 0.34 0.46 0.00 0.00 176.34 177.14 2yuy n PHE 28 N 0.84 0.00 0.00 1.57 7.35 -1.26 -4.60 117.46 121.37 2yuy n PHE 28 Ca -0.05 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.64 2yuy n PHE 28 Cb 0.75 -0.04 0.00 0.00 0.35 0.00 0.00 39.48 40.54 2yuy n PHE 28 CO 0.00 0.00 0.00 -0.89 -0.76 0.00 0.00 176.76 175.11 2yuy n ILE 29 N -0.17 0.00 -0.85 -2.13 5.41 -1.26 -4.90 119.36 115.46 2yuy n ILE 29 Ca 0.11 1.05 0.11 0.00 1.00 0.00 0.00 62.75 65.01 2yuy n ILE 29 Cb 0.43 -1.68 -0.03 0.00 -0.71 0.00 0.00 39.64 37.65 2yuy n ILE 29 CO 0.00 0.00 0.00 0.55 0.00 0.00 0.00 176.55 177.10 2yuy n VAL 30 N -1.03 0.00 -2.93 1.39 3.14 -1.26 -4.87 118.33 112.77 2yuy n VAL 30 Ca 0.00 0.07 -0.06 0.00 -2.96 0.00 0.00 64.34 61.39 2yuy n VAL 30 Cb 0.00 -0.34 -0.01 0.00 -1.06 0.00 0.00 33.84 32.44 2yuy n VAL 30 CO 0.00 0.00 0.00 -0.31 -6.46 0.00 0.00 176.83 170.06 2yuy s TYR 31 N -2.03 -1.36 0.80 1.45 1.51 -1.26 -4.99 117.35 111.48 2yuy s TYR 31 Ca 0.00 -0.57 -0.12 0.00 -1.01 0.00 0.00 57.07 55.38 2yuy s TYR 31 Cb 0.00 0.19 0.07 0.00 -0.11 0.00 0.00 41.96 42.11 2yuy s TYR 31 CO 0.00 -1.21 1.10 -1.25 -1.11 0.00 0.00 175.55 173.08 2yuy s PRO 32 N 1.02 2.03 0.00 -1.71 0.04 -1.26 -5.07 135.00 130.05 2yuy s PRO 32 Ca 0.27 0.62 0.00 0.00 0.04 0.00 0.00 61.00 61.93 2yuy s PRO 32 Cb -0.01 -1.91 0.00 0.00 0.04 0.00 0.00 34.50 32.62 2yuy s PRO 32 CO -0.07 -1.65 0.00 -0.35 0.04 0.00 0.00 177.00 174.97 2yuy n PRO 33 N -3.45 0.13 0.00 0.56 -0.04 -1.26 -5.03 135.00 125.91 2yuy n PRO 33 Ca 0.07 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.53 2yuy n PRO 33 Cb 0.56 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.02 2yuy n PRO 33 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2yuy n GLU 34 N -0.72 0.00 0.01 0.54 2.13 -1.26 -4.87 120.64 116.47 2yuy n GLU 34 Ca 0.00 0.06 -0.02 0.00 0.66 0.00 0.00 57.16 57.86 2yuy n GLU 34 Cb 0.00 -0.91 -0.01 0.00 0.27 0.00 0.00 31.44 30.79 2yuy n GLU 34 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 2yuy n SER 35 N -0.69 0.90 -1.39 4.31 2.88 -1.26 -5.14 113.62 113.23 2yuy n SER 35 Ca 0.00 0.13 0.18 0.00 -1.33 0.00 0.00 58.87 57.84 2yuy n SER 35 Cb 0.00 -0.30 -0.07 0.00 -0.75 0.00 0.00 64.21 63.09 2yuy n SER 35 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2yuy n ALA 36 N -3.48 -3.64 -3.09 -1.46 0.00 -1.26 -4.85 120.51 102.74 2yuy n ALA 36 Ca -0.04 0.74 -0.33 0.00 0.00 0.00 0.00 53.44 53.81 2yuy n ALA 36 Cb 0.24 -1.43 -0.14 0.00 0.00 0.00 0.00 19.45 18.12 2yuy n ALA 36 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2yuy s ILE 37 N -3.49 3.07 0.54 0.00 1.01 -1.26 -5.11 121.20 115.96 2yuy s ILE 37 Ca 0.00 -0.65 -0.13 0.00 0.00 0.00 0.00 60.65 59.87 2yuy s ILE 37 Cb 0.00 -2.29 -0.06 0.00 0.01 0.00 0.00 42.46 40.12 2yuy s ILE 37 CO 0.00 0.52 0.96 -1.58 0.00 0.00 0.00 174.94 174.84 2yuy s GLN 38 N 0.37 3.75 0.23 2.79 2.00 -1.26 -4.95 119.66 122.60 2yuy s GLN 38 Ca -0.10 0.74 0.00 0.00 -2.00 0.00 0.00 55.36 54.00 2yuy s GLN 38 Cb -0.16 -2.17 0.00 0.00 0.80 0.00 0.00 33.01 31.48 2yuy s GLN 38 CO 0.05 -0.35 0.00 1.19 -0.50 0.00 0.00 175.29 175.68 2yuy n PHE 39 N -2.06 -3.30 -1.28 1.67 3.72 -1.26 -5.13 117.46 109.81 2yuy n PHE 39 Ca 0.05 0.74 -0.36 0.00 -0.05 0.00 0.00 57.45 57.84 2yuy n PHE 39 Cb 0.54 2.05 0.08 0.00 -0.94 0.00 0.00 39.48 41.22 2yuy n PHE 39 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 2yuy n SER 40 N -2.98 -0.26 0.03 4.37 2.88 -1.26 -4.82 113.62 111.57 2yuy n SER 40 Ca 0.00 0.62 0.00 0.00 -1.33 0.00 0.00 58.87 58.16 2yuy n SER 40 Cb 0.00 -1.33 0.00 0.00 -0.75 0.00 0.00 64.21 62.13 2yuy n SER 40 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2yuy n TYR 41 N -2.54 -1.58 -1.24 0.66 9.36 -1.26 -5.15 117.16 115.41 2yuy n TYR 41 Ca 0.12 0.17 -0.29 0.00 3.32 0.00 0.00 57.90 61.22 2yuy n TYR 41 Cb 0.50 0.65 0.15 0.00 -0.63 0.00 0.00 39.34 40.01 2yuy n TYR 41 CO 0.00 0.00 0.00 0.21 0.22 0.00 0.00 176.86 177.29 2yuy s LYS 42 N -2.00 0.94 -0.38 2.98 2.20 -1.26 -5.01 119.74 117.22 2yuy s LYS 42 Ca 0.00 0.63 -0.09 0.00 -0.36 0.00 0.00 55.97 56.14 2yuy s LYS 42 Cb 0.00 -1.79 0.04 0.00 -1.51 0.00 0.00 37.83 34.58 2yuy s LYS 42 CO 0.00 -2.41 0.19 0.34 -0.36 0.00 0.00 175.35 173.11 2yuy s ASP 43 N -3.53 5.60 0.07 1.43 2.15 -1.26 -5.07 116.67 116.06 2yuy s ASP 43 Ca 0.64 -1.16 0.06 0.00 0.43 0.00 0.00 52.55 52.52 2yuy s ASP 43 Cb -0.18 -1.97 -0.04 0.00 -0.30 0.00 0.00 42.92 40.43 2yuy s ASP 43 CO 0.57 -0.41 -0.10 -0.70 -0.17 0.00 0.00 175.17 174.36 2yuy s GLU 44 N 1.48 2.24 -0.37 4.34 2.56 -1.26 -5.10 118.70 122.60 2yuy s GLU 44 Ca 0.01 -0.94 0.00 0.00 0.00 0.00 0.00 54.97 54.05 2yuy s GLU 44 Cb -0.20 -2.35 0.12 0.00 2.00 0.00 0.00 34.13 33.70 2yuy s GLU 44 CO 0.05 0.54 0.18 -2.00 -0.56 0.00 0.00 175.26 173.46 2yuy s GLU 45 N -1.91 0.87 0.15 4.30 -6.30 -1.26 -5.10 118.70 109.45 2yuy s GLU 45 Ca 0.20 -1.47 -0.16 0.00 -2.50 0.00 0.00 54.97 51.03 2yuy s GLU 45 Cb -0.11 -1.92 0.03 0.00 0.00 0.00 0.00 34.13 32.13 2yuy s GLU 45 CO 0.11 -1.11 0.43 1.21 0.02 0.00 0.00 175.26 175.92 2yuy s ASN 46 N 1.01 -0.22 -1.16 -1.70 2.47 -1.26 -5.07 114.94 109.01 2yuy s ASN 46 Ca 0.15 -0.41 -0.22 0.00 0.42 0.00 0.00 52.86 52.80 2yuy s ASN 46 Cb -0.21 0.50 -0.03 0.00 -1.45 0.00 0.00 41.25 40.05 2yuy s ASN 46 CO -0.09 -0.91 1.85 -0.83 -3.72 0.00 0.00 177.10 173.40 2yuy s GLY 47 N -2.84 0.61 -0.20 1.21 0.00 -1.26 -4.60 107.32 100.24 2yuy s GLY 47 Ca 0.06 -2.26 -0.15 0.00 0.00 0.00 0.00 44.72 42.37 2yuy s GLY 47 CO -0.08 3.28 -0.19 0.70 0.00 0.00 0.00 173.10 176.81 2yuy n ASN 48 N 12.48 1.89 -1.58 1.64 4.13 -1.26 -5.11 115.26 127.46 2yuy n ASN 48 Ca 0.44 0.44 0.00 0.00 1.68 0.00 0.00 54.58 57.14 2yuy n ASN 48 Cb 0.47 -0.84 0.00 0.00 -1.54 0.00 0.00 39.78 37.87 2yuy n ASN 48 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 2yuy n ARG 49 N -4.45 -4.26 -1.47 3.52 1.74 -1.26 -4.93 116.66 105.54 2yuy n ARG 49 Ca -0.25 3.26 -0.29 0.00 -0.77 0.00 0.00 57.85 59.80 2yuy n ARG 49 Cb 0.57 -3.95 0.15 0.00 -1.02 0.00 0.00 32.46 28.21 2yuy n ARG 49 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 2yuy s GLY 50 N -4.80 1.58 0.00 -0.13 0.00 -1.26 -5.09 107.32 97.62 2yuy s GLY 50 Ca 0.00 -0.57 0.00 0.00 0.00 0.00 0.00 44.72 44.15 2yuy s GLY 50 CO 0.00 0.03 0.00 0.61 0.00 0.00 0.00 173.10 173.74 2yuy n GLY 51 N -2.05 3.22 0.29 0.20 0.00 -1.26 -4.97 105.19 100.62 2yuy n GLY 51 Ca 0.07 -1.88 0.06 0.00 0.00 0.00 0.00 46.02 44.27 2yuy n GLY 51 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 2yuy h LYS 52 N 0.00 0.08 -2.76 1.61 3.64 -2.05 -3.47 116.57 113.63 2yuy h LYS 52 Ca 0.00 -0.00 0.28 0.00 -1.27 0.00 0.00 60.65 59.66 2yuy h LYS 52 Cb 0.00 -0.02 -0.11 0.00 -0.41 0.00 0.00 32.23 31.70 2yuy h LYS 52 CO 0.00 0.05 -0.65 1.04 -2.27 0.00 0.00 179.45 177.62 2yuy n GLN 53 N -5.38 -2.34 0.01 1.90 6.02 -1.26 -4.93 117.38 111.39 2yuy n GLN 53 Ca 0.14 1.73 -0.01 0.00 -0.01 0.00 0.00 57.00 58.85 2yuy n GLN 53 Cb 0.49 -2.91 -0.00 0.00 1.02 0.00 0.00 30.24 28.84 2yuy n GLN 53 CO 0.00 0.00 0.00 -2.13 -1.01 0.00 0.00 177.06 173.92 2yuy n ARG 54 N -3.69 0.09 -1.60 -1.09 0.63 -1.26 -5.14 116.66 104.60 2yuy n ARG 54 Ca -0.03 0.03 0.00 0.00 -0.92 0.00 0.00 57.85 56.94 2yuy n ARG 54 Cb 0.64 -0.50 0.00 0.00 0.45 0.00 0.00 32.46 33.05 2yuy n ARG 54 CO 0.00 0.00 0.00 -1.71 -2.51 0.00 0.00 177.63 173.41 2yuy n ASN 55 N -3.22 -7.14 -0.12 6.15 2.85 -1.26 -5.07 115.26 107.44 2yuy n ASN 55 Ca -0.02 1.00 0.00 0.00 -0.11 0.00 0.00 54.58 55.45 2yuy n ASN 55 Cb 0.09 -3.89 0.00 0.00 1.24 0.00 0.00 39.78 37.21 2yuy n ASN 55 CO 0.00 0.00 0.00 -1.14 -2.11 0.00 0.00 177.26 174.01 2yuy n ARG 56 N 1.23 3.12 -2.22 1.20 0.63 -1.26 -4.98 116.66 114.38 2yuy n ARG 56 Ca 0.00 0.00 -0.43 0.00 -0.92 0.00 0.00 57.85 56.50 2yuy n ARG 56 Cb 0.00 0.00 0.00 0.00 0.45 0.00 0.00 32.46 32.91 2yuy n ARG 56 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 2yuy n LEU 57 N 0.00 5.82 -4.25 6.15 4.32 -1.26 -4.97 117.00 122.82 2yuy n LEU 57 Ca 0.00 -4.05 -0.34 0.00 -0.02 0.00 0.00 56.01 51.59 2yuy n LEU 57 Cb 0.00 -1.70 0.09 0.00 -1.62 0.00 0.00 43.42 40.19 2yuy n LEU 57 CO 0.00 0.61 -0.60 -0.62 -1.22 0.00 0.00 177.39 175.56 2yuy n GLU 58 N 7.19 -0.17 0.00 3.23 1.02 -1.26 -4.97 120.64 125.68 2yuy n GLU 58 Ca 0.50 -0.02 0.00 0.00 -0.02 0.00 0.00 57.16 57.61 2yuy n GLU 58 Cb 0.43 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.34 2yuy n GLU 58 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 2yuy n PRO 59 N 0.03 0.00 0.00 3.49 -0.04 -1.26 -4.94 135.00 132.28 2yuy n PRO 59 Ca 0.03 0.22 0.00 0.00 -0.04 0.00 0.00 63.50 63.71 2yuy n PRO 59 Cb 0.54 -0.84 0.00 0.00 -0.04 0.00 0.00 33.50 33.16 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 -1.16 0.00 -2.41 0.54 2.81 -1.26 -5.11 117.12 110.53 2yuy n MET 60 Ca 0.00 0.00 -0.03 0.00 -1.81 0.00 0.00 57.70 55.86 2yuy n MET 60 Cb 0.00 -0.16 -0.02 0.00 -0.71 0.00 0.00 33.22 32.33 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 -2.38 -2.96 0.00 7.83 2.03 -1.26 -4.94 116.55 114.87 2yuy n ASP 61 Ca 0.00 1.11 0.00 0.00 0.52 0.00 0.00 54.79 56.42 2yuy n ASP 61 Cb 0.00 -4.44 0.00 0.00 -0.72 0.00 0.00 41.12 35.96 2yuy n ASP 61 CO 0.00 0.00 0.00 0.41 -1.92 0.00 0.00 177.20 175.69 2yuy n THR 62 N 1.06 0.00 -1.69 5.18 -1.04 -1.26 -5.10 114.28 111.43 2yuy n THR 62 Ca -0.21 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.80 2yuy n THR 62 Cb 0.33 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.84 2yuy n THR 62 CO 0.00 0.00 0.00 -0.38 -0.64 0.00 0.00 175.07 174.05 2yuy n ILE 63 N 0.00 -9.95 -4.51 12.58 5.41 -1.26 -3.66 119.36 117.96 2yuy n ILE 63 Ca 0.00 2.31 -0.25 0.00 1.00 0.00 0.00 62.75 65.81 2yuy n ILE 63 Cb 0.00 -4.67 -0.14 0.00 -0.71 0.00 0.00 39.64 34.13 2yuy n ILE 63 CO 0.00 0.00 0.00 -0.36 0.00 0.00 0.00 176.55 176.19 2yuy s PHE 64 N -0.37 1.82 0.16 1.39 0.40 -1.26 -0.92 117.98 119.19 2yuy s PHE 64 Ca 0.00 -0.39 -0.30 0.00 -0.60 0.00 0.00 56.93 55.64 2yuy s PHE 64 Cb 0.00 -1.05 -0.08 0.00 0.51 0.00 0.00 43.02 42.40 2yuy s PHE 64 CO 0.00 0.14 1.24 0.08 0.70 0.00 0.00 175.22 177.38 2yuy s VAL 65 N -0.93 3.54 -0.16 -0.44 1.01 0.70 -3.53 120.40 120.59 2yuy s VAL 65 Ca 0.07 1.23 -0.15 0.00 0.00 0.00 0.00 61.98 63.13 2yuy s VAL 65 Cb -0.09 -3.79 -0.05 0.00 0.00 0.00 0.00 36.38 32.45 2yuy s VAL 65 CO 0.03 0.17 -0.29 1.17 0.00 0.00 0.00 175.10 176.18 2yuy n LYS 66 N 2.92 0.47 -4.28 2.72 4.81 -0.56 -3.57 118.16 120.66 2yuy n LYS 66 Ca 0.06 0.25 -0.15 0.00 -0.87 0.00 0.00 58.31 57.60 2yuy n LYS 66 Cb 0.44 -1.40 -0.10 0.00 0.02 0.00 0.00 35.03 34.00 2yuy n LYS 66 CO 0.00 0.00 0.00 -0.65 1.17 0.00 0.00 177.40 177.92 2yuy s GLN 67 N -2.62 1.24 -0.13 1.64 -0.21 -1.25 -4.82 119.66 113.51 2yuy s GLN 67 Ca -0.24 -1.63 -0.02 0.00 0.02 0.00 0.00 55.36 53.49 2yuy s GLN 67 Cb 0.03 -0.31 0.04 0.00 1.00 0.00 0.00 33.01 33.77 2yuy s GLN 67 CO 0.35 -0.18 0.03 0.08 -2.12 0.00 0.00 175.29 173.46 2yuy s VAL 68 N -3.65 0.31 0.45 1.09 1.01 -1.26 -2.66 120.40 115.68 2yuy s VAL 68 Ca 0.29 -0.13 -0.20 0.00 0.00 0.00 0.00 61.98 61.95 2yuy s VAL 68 Cb 0.07 -0.67 -0.15 0.00 0.00 0.00 0.00 36.38 35.62 2yuy s VAL 68 CO 0.08 0.01 -0.00 1.17 0.00 0.00 0.00 175.10 176.35 2yuy n LYS 69 N 5.15 0.01 -3.05 2.72 0.00 -1.26 -4.81 118.16 116.93 2yuy n LYS 69 Ca -0.07 0.00 -0.44 0.00 0.00 0.00 0.00 58.31 57.80 2yuy n LYS 69 Cb 0.49 -1.01 -0.01 0.00 0.00 0.00 0.00 35.03 34.50 2yuy n LYS 69 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.40 175.40 2yuy s GLU 70 N -1.01 4.02 0.00 1.64 -6.30 -1.26 -3.88 118.70 111.91 2yuy s GLU 70 Ca 0.58 -2.59 0.00 0.00 -2.50 0.00 0.00 54.97 50.46 2yuy s GLU 70 Cb -0.57 -4.90 0.00 0.00 0.00 0.00 0.00 34.13 28.66 2yuy s GLU 70 CO 0.64 -1.63 0.00 0.41 0.02 0.00 0.00 175.26 174.70 2yuy n GLY 71 N 4.00 1.87 0.00 -1.50 0.00 -1.26 -5.12 105.19 103.18 2yuy n GLY 71 Ca 0.31 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.33 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 -0.90 1.74 0.03 -0.02 0.00 -1.25 -4.98 105.19 99.81 2yuy n GLY 72 Ca 0.00 -1.94 -0.01 0.00 0.00 0.00 0.00 46.02 44.07 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 -0.06 -0.93 1.61 0.13 -1.92 -3.09 132.00 127.75 2yuy h PRO 73 Ca 0.00 0.00 0.25 0.00 -0.87 0.00 0.00 66.00 65.39 2yuy h PRO 73 Cb 0.00 0.01 -0.14 0.00 0.13 0.00 0.00 31.00 31.01 2yuy h PRO 73 CO 0.00 -0.04 0.42 0.00 -0.23 0.00 0.00 178.00 178.15 2yuy h ALA 74 N -1.85 1.56 -0.61 -0.56 0.00 -1.94 1.40 119.26 117.27 2yuy h ALA 74 Ca -0.01 0.18 0.15 0.00 0.00 0.00 0.00 54.91 55.23 2yuy h ALA 74 Cb 0.04 0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 2yuy h ALA 74 CO 0.01 -0.42 0.42 0.35 0.00 0.00 0.00 179.25 179.61 2yuy h PHE 75 N 0.35 0.19 0.00 0.00 3.57 -1.79 -1.09 116.94 118.17 2yuy h PHE 75 Ca 0.61 0.01 -0.07 0.00 3.53 0.00 0.00 57.97 62.05 2yuy h PHE 75 Cb 1.25 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 39.92 2yuy h PHE 75 CO -0.12 0.08 -0.44 0.93 -2.23 0.00 0.00 178.31 176.53 2yuy h GLU 76 N 0.17 0.00 -1.82 1.11 4.39 0.19 -3.32 114.58 115.30 2yuy h GLU 76 Ca 0.29 0.00 0.54 0.00 0.34 0.00 0.00 59.36 60.53 2yuy h GLU 76 Cb 0.92 0.00 -0.09 0.00 -0.10 0.00 0.00 28.75 29.48 2yuy h GLU 76 CO -0.05 0.73 1.29 0.00 -1.16 0.00 0.00 179.01 179.83 2yuy n ALA 77 N -2.99 1.75 0.00 3.43 0.00 0.13 -4.63 120.51 118.20 2yuy n ALA 77 Ca -0.15 0.66 0.00 0.00 0.00 0.00 0.00 53.44 53.96 2yuy n ALA 77 Cb 0.44 -1.09 0.00 0.00 0.00 0.00 0.00 19.45 18.80 2yuy n ALA 77 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2yuy n GLY 78 N -1.83 1.20 2.54 0.00 0.00 -0.91 -4.79 105.19 101.40 2yuy n GLY 78 Ca 0.42 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 46.22 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 0.00 0.00 0.99 7.94 -0.46 -5.02 117.00 120.45 2yuy n LEU 79 Ca 0.00 -0.65 0.00 0.00 -1.11 0.00 0.00 56.01 54.25 2yuy n LEU 79 Cb 0.00 -0.77 0.00 0.00 0.53 0.00 0.00 43.42 43.18 2yuy n LEU 79 CO 0.00 -2.53 0.00 0.00 -1.11 0.00 0.00 177.39 173.75 2yuy s THR 81 N -2.23 4.78 0.00 0.00 -4.23 -1.26 -4.27 115.64 108.43 2yuy s THR 81 Ca 0.00 -0.05 0.00 0.00 -1.18 0.00 0.00 61.69 60.46 2yuy s THR 81 Cb 0.00 -3.11 0.00 0.00 1.34 0.00 0.00 72.50 70.73 2yuy s THR 81 CO 0.00 0.52 0.00 0.61 -0.54 0.00 0.00 174.62 175.21 2yuy n GLY 82 N 2.99 0.83 3.75 3.99 0.00 -1.23 -5.06 105.19 110.46 2yuy n GLY 82 Ca -0.18 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.44 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 -1.92 7.50 -0.01 1.61 1.01 -1.26 -4.80 116.67 118.79 2yuy s ASP 83 Ca 0.00 1.78 -0.01 0.00 0.71 0.00 0.00 52.55 55.03 2yuy s ASP 83 Cb 0.00 -2.57 -0.04 0.00 1.01 0.00 0.00 42.92 41.33 2yuy s ASP 83 CO 0.00 0.06 0.08 0.00 0.21 0.00 0.00 175.17 175.52 2yuy s ARG 84 N -0.58 3.08 0.04 8.23 1.70 -1.26 -0.21 118.95 129.95 2yuy s ARG 84 Ca 0.42 -0.46 -0.25 0.00 -0.47 0.00 0.00 55.73 54.97 2yuy s ARG 84 Cb -0.24 -2.87 -0.05 0.00 -0.57 0.00 0.00 34.95 31.21 2yuy s ARG 84 CO 0.29 0.66 0.76 0.42 -1.08 0.00 0.00 175.30 176.34 2yuy s ILE 85 N -1.17 4.74 -0.04 4.99 -1.09 -0.10 -3.72 121.20 124.80 2yuy s ILE 85 Ca 0.22 1.61 0.01 0.00 -2.23 0.00 0.00 60.65 60.26 2yuy s ILE 85 Cb -0.12 -4.11 -0.03 0.00 -1.58 0.00 0.00 42.46 36.62 2yuy s ILE 85 CO 0.13 0.36 -0.03 2.30 -1.23 0.00 0.00 174.94 176.47 2yuy n ILE 86 N 2.82 0.25 -4.22 2.92 -5.35 0.19 -4.59 119.36 111.38 2yuy n ILE 86 Ca -0.03 -0.11 -0.13 0.00 -0.27 0.00 0.00 62.75 62.22 2yuy n ILE 86 Cb 0.50 -0.69 -0.10 0.00 -1.74 0.00 0.00 39.64 37.61 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 -2.09 1.00 -0.21 6.28 1.02 -1.18 -4.13 119.74 120.43 2yuy s LYS 87 Ca -0.05 -1.44 -0.09 0.00 0.02 0.00 0.00 55.97 54.41 2yuy s LYS 87 Cb 0.01 -0.38 0.08 0.00 -0.52 0.00 0.00 37.83 37.03 2yuy s LYS 87 CO 0.11 -0.02 0.46 0.08 -0.92 0.00 0.00 175.35 175.07 2yuy s VAL 88 N -3.52 -0.41 -1.37 3.17 1.01 -1.10 -1.95 120.40 116.24 2yuy s VAL 88 Ca 0.17 0.11 -0.10 0.00 0.00 0.00 0.00 61.98 62.16 2yuy s VAL 88 Cb 0.05 -0.71 0.07 0.00 0.00 0.00 0.00 36.38 35.79 2yuy s VAL 88 CO -0.00 0.05 0.58 0.59 0.00 0.00 0.00 175.10 176.31 2yuy n ASN 89 N 4.91 -4.15 -0.38 3.32 3.02 0.57 0.18 115.26 122.74 2yuy n ASN 89 Ca -0.15 -0.45 -0.05 0.00 -0.03 0.00 0.00 54.58 53.90 2yuy n ASN 89 Cb 0.52 -3.40 -0.02 0.00 -0.61 0.00 0.00 39.78 36.27 2yuy n ASN 89 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2yuy n GLY 90 N -1.29 0.57 3.66 7.41 0.00 -1.26 -4.95 105.19 109.33 2yuy n GLY 90 Ca -0.02 -0.07 -0.38 0.00 0.00 0.00 0.00 46.02 45.55 2yuy n GLY 90 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2yuy s GLU 91 N -2.12 4.15 -0.38 1.61 2.12 0.48 -5.02 118.70 119.55 2yuy s GLU 91 Ca 0.00 0.17 -0.28 0.00 0.36 0.00 0.00 54.97 55.22 2yuy s GLU 91 Cb 0.00 -3.55 -0.01 0.00 0.26 0.00 0.00 34.13 30.82 2yuy s GLU 91 CO 0.00 -0.07 1.71 -1.54 -0.54 0.00 0.00 175.26 174.82 2yuy s SER 92 N 1.12 5.94 -0.22 -1.70 1.04 -1.26 -2.70 113.70 115.93 2yuy s SER 92 Ca 0.18 1.09 0.14 0.00 0.48 0.00 0.00 55.95 57.85 2yuy s SER 92 Cb -0.15 -2.53 0.51 0.00 0.10 0.00 0.00 66.02 63.95 2yuy s SER 92 CO 0.08 -1.71 1.43 1.33 0.98 0.00 0.00 173.24 175.35 2yuy n VAL 93 N 7.31 2.37 0.10 5.02 0.24 -1.26 -4.58 118.33 127.54 2yuy n VAL 93 Ca 0.21 -2.21 0.02 0.00 -2.04 0.00 0.00 64.34 60.33 2yuy n VAL 93 Cb 0.48 -0.28 0.38 0.00 -1.47 0.00 0.00 33.84 32.95 2yuy n VAL 93 CO 0.00 0.00 0.00 0.40 -2.14 0.00 0.00 176.83 175.09 2yuy h ILE 94 N 1.38 1.17 -0.01 1.34 5.03 -1.88 -2.64 117.51 121.91 2yuy h ILE 94 Ca 0.09 -0.75 -0.00 0.00 -0.12 0.00 0.00 64.86 64.07 2yuy h ILE 94 Cb 1.51 1.15 -0.00 0.00 -3.03 0.00 0.00 36.82 36.45 2yuy h ILE 94 CO 0.28 0.24 -0.34 0.61 -0.68 0.00 0.00 178.15 178.25 2yuy n GLY 95 N -0.91 5.06 3.96 5.37 0.00 -1.26 -5.03 105.19 112.39 2yuy n GLY 95 Ca -0.00 -1.26 -0.22 0.00 0.00 0.00 0.00 46.02 44.54 2yuy n GLY 95 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2yuy s LYS 96 N -3.13 2.34 0.13 1.61 1.02 -1.00 -5.13 119.74 115.58 2yuy s LYS 96 Ca 0.36 -1.76 0.01 0.00 0.02 0.00 0.00 55.97 54.60 2yuy s LYS 96 Cb 0.34 -2.40 0.01 0.00 -0.52 0.00 0.00 37.83 35.26 2yuy s LYS 96 CO -0.04 -0.66 0.08 -2.37 -0.92 0.00 0.00 175.35 171.44 2yuy n THR 97 N -1.95 0.00 0.12 2.17 5.66 -1.26 -4.96 114.28 114.06 2yuy n THR 97 Ca 0.07 -0.54 -0.09 0.00 -3.05 0.00 0.00 64.05 60.44 2yuy n THR 97 Cb 0.63 -0.27 -0.06 0.00 -1.55 0.00 0.00 70.33 69.08 2yuy n THR 97 CO 0.00 0.00 0.00 0.22 -3.05 0.00 0.00 175.07 172.24 2yuy h TYR 98 N 0.66 -0.35 -0.19 1.09 3.20 -1.99 -2.35 116.97 117.04 2yuy h TYR 98 Ca -0.09 -0.01 0.05 0.00 3.14 0.00 0.00 58.73 61.83 2yuy h TYR 98 Cb 0.31 0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.69 2yuy h TYR 98 CO 0.00 -0.06 0.46 1.03 -1.64 0.00 0.00 178.16 177.95 2yuy h SER 99 N -1.00 0.00 0.00 -2.11 0.87 -1.98 0.25 113.55 109.58 2yuy h SER 99 Ca -0.04 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.52 2yuy h SER 99 Cb 0.46 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.42 2yuy h SER 99 CO 0.06 0.00 0.00 0.00 -0.53 0.00 0.00 176.83 176.36 2yuy n GLN 100 N -3.16 0.00 -0.12 2.24 6.02 -1.18 -2.80 117.38 118.38 2yuy n GLN 100 Ca 0.02 0.46 0.27 0.00 -0.01 0.00 0.00 57.00 57.75 2yuy n GLN 100 Cb 0.56 -1.02 0.70 0.00 1.02 0.00 0.00 30.24 31.49 2yuy n GLN 100 CO 0.00 0.00 0.00 -0.39 -1.01 0.00 0.00 177.06 175.66 2yuy h VAL 101 N 0.00 0.35 0.22 5.09 -1.51 -0.92 0.37 116.25 119.86 2yuy h VAL 101 Ca 0.00 0.00 -0.01 0.00 -1.23 0.00 0.00 66.70 65.46 2yuy h VAL 101 Cb 0.00 0.46 0.00 0.00 -2.13 0.00 0.00 31.29 29.62 2yuy h VAL 101 CO 0.00 0.00 -0.11 0.40 -1.23 0.00 0.00 177.57 176.63 2yuy h ILE 102 N 0.00 0.82 -0.67 7.19 1.08 -0.61 -1.46 117.51 123.87 2yuy h ILE 102 Ca 0.39 -0.24 0.12 0.00 -0.39 0.00 0.00 64.86 64.73 2yuy h ILE 102 Cb 1.82 0.97 -0.04 0.00 -3.07 0.00 0.00 36.82 36.50 2yuy h ILE 102 CO -0.00 0.06 0.45 0.00 -0.69 0.00 0.00 178.15 177.96 2yuy h ALA 103 N 0.33 2.07 -0.65 1.87 0.00 -0.10 0.21 119.26 122.98 2yuy h ALA 103 Ca -0.03 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.83 2yuy h ALA 103 Cb 0.32 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 2yuy h ALA 103 CO 0.05 -0.23 0.23 -0.07 0.00 0.00 0.00 179.25 179.23 2yuy h LEU 104 N 0.41 0.92 -1.08 0.00 3.38 -0.86 1.52 115.31 119.59 2yuy h LEU 104 Ca 0.32 -0.19 -0.05 0.00 0.09 0.00 0.00 57.88 58.05 2yuy h LEU 104 Cb 0.68 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 2yuy h LEU 104 CO -0.09 0.86 -0.22 0.40 0.09 0.00 0.00 178.44 179.48 2yuy h ILE 105 N 0.92 0.53 0.00 1.22 2.04 0.32 -1.50 117.51 121.04 2yuy h ILE 105 Ca 0.21 -1.12 0.00 0.00 1.00 0.00 0.00 64.86 64.95 2yuy h ILE 105 Cb 0.25 1.78 0.00 0.00 -0.74 0.00 0.00 36.82 38.11 2yuy h ILE 105 CO -0.01 0.21 -1.09 0.00 0.00 0.00 0.00 178.15 177.27 2yuy n GLN 106 N -3.37 0.56 -0.67 2.37 6.02 0.17 -3.75 117.38 118.71 2yuy n GLN 106 Ca 0.00 0.07 0.08 0.00 -0.01 0.00 0.00 57.00 57.14 2yuy n GLN 106 Cb 0.43 -1.76 0.33 0.00 1.02 0.00 0.00 30.24 30.26 2yuy n GLN 106 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 2yuy n ASN 107 N -2.53 4.77 0.00 1.08 3.02 0.51 -4.40 115.26 117.71 2yuy n ASN 107 Ca -0.00 -2.99 0.10 0.00 -0.03 0.00 0.00 54.58 51.65 2yuy n ASN 107 Cb 0.53 -0.62 0.50 0.00 -0.61 0.00 0.00 39.78 39.58 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 0.00 0.00 6.41 7.64 -0.60 -4.91 113.62 122.17 2yuy n SER 108 Ca 0.25 0.01 0.00 0.00 1.01 0.00 0.00 58.87 60.14 2yuy n SER 108 Cb 1.05 -0.29 0.00 0.00 -1.01 0.00 0.00 64.21 63.96 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 -1.29 0.00 -0.05 6.43 2.03 -1.26 -2.68 116.55 119.73 2yuy n ASP 109 Ca 0.09 0.00 -0.04 0.00 0.52 0.00 0.00 54.79 55.37 2yuy n ASP 109 Cb 0.16 0.00 -0.01 0.00 -0.72 0.00 0.00 41.12 40.55 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 0.90 -2.96 5.18 -1.04 -1.26 -4.84 114.28 110.25 2yuy n THR 110 Ca 0.00 0.31 -0.19 0.00 -2.04 0.00 0.00 64.05 62.13 2yuy n THR 110 Cb 0.00 -2.05 0.05 0.00 -1.82 0.00 0.00 70.33 66.51 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 -1.89 2.37 -0.26 12.58 -4.23 -1.09 0.42 115.64 123.54 2yuy s THR 111 Ca -0.12 -0.94 -0.02 0.00 -1.18 0.00 0.00 61.69 59.44 2yuy s THR 111 Cb 0.02 -2.43 0.13 0.00 1.34 0.00 0.00 72.50 71.56 2yuy s THR 111 CO 0.17 0.00 0.35 -0.22 -0.54 0.00 0.00 174.62 174.38 2yuy s LEU 112 N -4.65 -0.53 0.21 4.79 1.98 -0.74 -4.43 118.68 115.31 2yuy s LEU 112 Ca 0.61 -0.13 -0.27 0.00 -2.89 0.00 0.00 54.13 51.45 2yuy s LEU 112 Cb -0.07 0.91 -0.09 0.00 0.66 0.00 0.00 46.19 47.60 2yuy s LEU 112 CO 0.38 -0.33 0.85 -0.70 -1.89 0.00 0.00 176.35 174.66 2yuy s GLU 113 N 2.48 4.65 0.38 1.98 2.12 -1.26 -1.26 118.70 127.79 2yuy s GLU 113 Ca 0.11 1.27 0.04 0.00 0.36 0.00 0.00 54.97 56.74 2yuy s GLU 113 Cb -0.15 -3.20 -0.01 0.00 0.26 0.00 0.00 34.13 31.03 2yuy s GLU 113 CO -0.21 0.52 0.14 1.28 -0.54 0.00 0.00 175.26 176.44 2yuy n LEU 114 N 1.40 0.00 -3.64 2.70 4.77 0.23 -0.31 117.00 122.15 2yuy n LEU 114 Ca -0.03 -2.93 -0.06 0.00 -0.03 0.00 0.00 56.01 52.96 2yuy n LEU 114 Cb 0.48 0.96 -0.07 0.00 -2.33 0.00 0.00 43.42 42.47 2yuy n LEU 114 CO 0.47 -0.45 0.51 -0.44 -1.33 0.00 0.00 177.39 176.15 2yuy s SER 115 N -3.35 -0.73 0.02 -1.43 0.01 -0.82 -2.53 113.70 104.88 2yuy s SER 115 Ca 0.19 1.20 0.00 0.00 1.31 0.00 0.00 55.95 58.65 2yuy s SER 115 Cb 0.01 1.28 -0.00 0.00 0.21 0.00 0.00 66.02 67.52 2yuy s SER 115 CO 0.14 -0.19 0.01 1.33 0.41 0.00 0.00 173.24 174.93 2yuy n VAL 116 N 3.76 0.00 -3.58 3.43 0.24 -1.22 0.55 118.33 121.51 2yuy n VAL 116 Ca -0.18 -0.14 -0.29 0.00 -2.04 0.00 0.00 64.34 61.68 2yuy n VAL 116 Cb 0.58 0.05 -0.14 0.00 -1.47 0.00 0.00 33.84 32.86 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 -2.09 0.57 0.67 7.34 -1.94 -1.24 -2.91 119.30 119.68 2yuy s MET 117 Ca 0.01 -1.10 -0.12 0.00 -1.71 0.00 0.00 55.69 52.77 2yuy s MET 117 Cb 0.00 -1.55 -0.00 0.00 2.01 0.00 0.00 34.83 35.29 2yuy s MET 117 CO 0.01 -1.09 1.06 -1.25 -0.01 0.00 0.00 175.02 173.73 2yuy s PRO 118 N 1.43 3.05 0.58 2.03 0.04 -1.26 -4.83 135.00 136.04 2yuy s PRO 118 Ca 0.13 0.99 0.08 0.00 0.04 0.00 0.00 61.00 62.24 2yuy s PRO 118 Cb -0.20 -2.00 0.08 0.00 0.04 0.00 0.00 34.50 32.42 2yuy s PRO 118 CO -0.17 -1.01 0.65 0.21 0.04 0.00 0.00 177.00 176.71 2yuy s LYS 119 N -4.85 2.23 0.04 4.56 2.20 -1.26 -5.04 119.74 117.62 2yuy s LYS 119 Ca 0.59 -1.87 -0.26 0.00 -0.36 0.00 0.00 55.97 54.08 2yuy s LYS 119 Cb -0.14 -2.39 -0.17 0.00 -1.51 0.00 0.00 37.83 33.62 2yuy s LYS 119 CO 0.51 -0.83 1.49 -0.44 -0.36 0.00 0.00 175.35 175.72 2yuy h ASP 120 N 0.36 -0.21 -3.75 1.43 3.32 -2.07 -3.49 116.42 112.01 2yuy h ASP 120 Ca -0.32 -0.14 0.18 0.00 0.02 0.00 0.00 57.03 56.77 2yuy h ASP 120 Cb 1.30 0.05 -0.10 0.00 0.22 0.00 0.00 39.33 40.80 2yuy h ASP 120 CO 0.47 0.03 -1.10 -0.24 -1.72 0.00 0.00 179.24 176.68 2yuy n SER 121 N -5.11 -7.80 -4.61 6.45 2.88 -1.26 -4.60 113.62 99.57 2yuy n SER 121 Ca -0.09 1.60 -0.43 0.00 -1.33 0.00 0.00 58.87 58.62 2yuy n SER 121 Cb 0.19 -4.81 -0.03 0.00 -0.75 0.00 0.00 64.21 58.81 2yuy n SER 121 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2yuy s GLY 122 N -6.29 0.68 -0.02 0.46 0.00 -1.26 -4.93 107.32 95.96 2yuy s GLY 122 Ca 0.00 0.71 -0.30 0.00 0.00 0.00 0.00 44.72 45.13 2yuy s GLY 122 CO 0.00 3.63 1.20 2.56 0.00 0.00 0.00 173.10 180.50 2yuy s PRO 123 N 5.97 4.37 -0.30 2.90 0.04 -1.26 -4.97 135.00 141.75 2yuy s PRO 123 Ca 0.94 1.70 -0.03 0.00 0.04 0.00 0.00 61.00 63.65 2yuy s PRO 123 Cb -0.31 -3.51 0.19 0.00 0.04 0.00 0.00 34.50 30.91 2yuy s PRO 123 CO 0.35 -0.40 0.84 -1.54 0.04 0.00 0.00 177.00 176.29 2yuy s SER 124 N 1.40 -0.96 0.12 6.66 1.04 -1.26 -5.05 113.70 115.64 2yuy s SER 124 Ca 0.57 0.10 -0.33 0.00 0.48 0.00 0.00 55.95 56.77 2yuy s SER 124 Cb -0.26 1.60 -0.12 0.00 0.10 0.00 0.00 66.02 67.34 2yuy s SER 124 CO 0.24 -0.17 1.54 -1.28 0.98 0.00 0.00 173.24 174.54 2yuy h SER 125 N 7.56 -1.70 0.00 7.02 0.87 -2.05 -3.56 113.55 121.68 2yuy h SER 125 Ca -0.05 0.20 0.00 0.00 -1.23 0.00 0.00 61.79 60.71 2yuy h SER 125 Cb 1.18 0.67 0.00 0.00 -0.44 0.00 0.00 62.40 63.81 2yuy h SER 125 CO 0.01 -0.47 0.00 0.61 -0.53 0.00 0.00 176.83 176.46