#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 5.33 0.02 1.61 0.15 -1.26 -3.84 113.70 115.71 2yuy s SER 2 Ca 0.00 -1.33 -0.29 0.00 0.70 0.00 0.00 55.95 55.04 2yuy s SER 2 Cb 0.00 -1.87 -0.16 0.00 -1.71 0.00 0.00 66.02 62.28 2yuy s SER 2 CO 0.00 -0.39 1.19 -1.28 1.20 0.00 0.00 173.24 173.96 2yuy h SER 3 N 8.21 -0.87 0.00 5.45 0.87 -1.61 -3.49 113.55 122.11 2yuy h SER 3 Ca -0.22 0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.37 2yuy h SER 3 Cb 1.08 0.23 0.00 0.00 -0.44 0.00 0.00 62.40 63.26 2yuy h SER 3 CO 0.64 -0.51 0.00 0.61 -0.53 0.00 0.00 176.83 177.04 2yuy n GLY 4 N -0.84 1.48 0.50 5.77 0.00 -1.26 -4.93 105.19 105.90 2yuy n GLY 4 Ca -0.13 -0.33 -0.18 0.00 0.00 0.00 0.00 46.02 45.39 2yuy n GLY 4 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2yuy h SER 5 N 0.00 -1.38 -0.86 1.61 0.87 -2.05 -3.44 113.55 108.30 2yuy h SER 5 Ca 0.00 0.11 0.15 0.00 -1.23 0.00 0.00 61.79 60.82 2yuy h SER 5 Cb 0.00 0.46 -0.21 0.00 -0.44 0.00 0.00 62.40 62.21 2yuy h SER 5 CO 0.00 -0.66 -0.07 -0.44 -0.53 0.00 0.00 176.83 175.13 2yuy s SER 6 N -4.33 -0.97 0.00 6.23 0.01 -1.26 -5.15 113.70 108.23 2yuy s SER 6 Ca -0.17 0.73 0.00 0.00 1.31 0.00 0.00 55.95 57.82 2yuy s SER 6 Cb 0.04 1.87 0.00 0.00 0.21 0.00 0.00 66.02 68.14 2yuy s SER 6 CO 0.59 -0.18 0.00 0.61 0.41 0.00 0.00 173.24 174.67 2yuy n GLY 7 N 5.40 4.14 0.00 3.44 0.00 -1.26 -4.93 105.19 111.97 2yuy n GLY 7 Ca -0.05 -0.53 0.00 0.00 0.00 0.00 0.00 46.02 45.45 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 -0.48 0.31 3.80 -0.02 0.00 -1.25 -1.45 105.19 106.11 2yuy n GLY 8 Ca 0.00 -1.13 -0.33 0.00 0.00 0.00 0.00 46.02 44.56 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 -1.89 3.66 0.22 1.61 0.04 -1.25 -4.94 135.00 132.45 2yuy s PRO 9 Ca 0.00 1.29 -0.15 0.00 0.04 0.00 0.00 61.00 62.19 2yuy s PRO 9 Cb 0.00 -2.08 -0.08 0.00 0.04 0.00 0.00 34.50 32.39 2yuy s PRO 9 CO 0.00 -0.54 0.63 0.21 0.04 0.00 0.00 177.00 177.34 2yuy s LYS 10 N -3.54 4.00 -0.01 4.56 2.47 -1.04 -5.02 119.74 121.16 2yuy s LYS 10 Ca 0.66 0.57 0.02 0.00 -1.56 0.00 0.00 55.97 55.65 2yuy s LYS 10 Cb -0.16 -2.74 -0.00 0.00 -1.46 0.00 0.00 37.83 33.47 2yuy s LYS 10 CO 0.26 0.35 -0.08 0.99 0.16 0.00 0.00 175.35 177.03 2yuy s THR 11 N -1.68 0.62 -0.01 3.43 2.01 -1.26 -3.02 115.64 115.73 2yuy s THR 11 Ca 0.45 -0.31 -0.00 0.00 0.31 0.00 0.00 61.69 62.14 2yuy s THR 11 Cb -0.13 -0.54 0.02 0.00 0.01 0.00 0.00 72.50 71.85 2yuy s THR 11 CO 0.20 0.19 0.02 0.68 -0.69 0.00 0.00 174.62 175.01 2yuy s VAL 12 N -0.01 -0.03 0.09 3.82 -7.23 0.04 -4.97 120.40 112.11 2yuy s VAL 12 Ca 0.00 0.11 0.05 0.00 -1.81 0.00 0.00 61.98 60.33 2yuy s VAL 12 Cb -0.05 -0.05 -0.04 0.00 0.56 0.00 0.00 36.38 36.80 2yuy s VAL 12 CO -0.00 0.05 0.01 -0.89 -0.31 0.00 0.00 175.10 173.95 2yuy s THR 13 N 0.55 4.06 0.01 5.32 2.01 -1.26 0.14 115.64 126.46 2yuy s THR 13 Ca -0.05 -0.96 0.01 0.00 0.31 0.00 0.00 61.69 61.00 2yuy s THR 13 Cb -0.07 -2.93 -0.01 0.00 0.01 0.00 0.00 72.50 69.50 2yuy s THR 13 CO -0.02 0.13 -0.04 -0.76 -0.69 0.00 0.00 174.62 173.24 2yuy s LEU 14 N -2.30 2.09 -0.23 4.42 1.02 0.14 -4.40 118.68 119.43 2yuy s LEU 14 Ca 0.26 -0.22 0.00 0.00 0.02 0.00 0.00 54.13 54.20 2yuy s LEU 14 Cb -0.12 -0.12 0.03 0.00 0.02 0.00 0.00 46.19 46.01 2yuy s LEU 14 CO 0.18 -0.06 -0.12 -0.54 0.02 0.00 0.00 176.35 175.84 2yuy s LYS 15 N -0.57 2.73 -0.43 1.70 1.02 -1.26 0.58 119.74 123.51 2yuy s LYS 15 Ca -0.04 -1.03 -0.41 0.00 0.02 0.00 0.00 55.97 54.52 2yuy s LYS 15 Cb -0.04 -2.83 -0.16 0.00 -0.52 0.00 0.00 37.83 34.27 2yuy s LYS 15 CO -0.00 -0.38 2.08 -2.13 -0.92 0.00 0.00 175.35 173.99 2yuy n ARG 16 N 4.59 0.44 0.00 1.68 0.63 0.70 -4.84 116.66 119.87 2yuy n ARG 16 Ca -0.17 0.13 -0.00 0.00 -0.92 0.00 0.00 57.85 56.88 2yuy n ARG 16 Cb 0.47 -1.85 -0.00 0.00 0.45 0.00 0.00 32.46 31.52 2yuy n ARG 16 CO 0.00 0.00 0.00 1.79 -2.51 0.00 0.00 177.63 176.91 2yuy h THR 17 N 6.71 0.00 0.00 5.15 1.35 -1.92 -3.49 112.91 120.71 2yuy h THR 17 Ca -0.21 -0.06 0.00 0.00 -0.55 0.00 0.00 66.41 65.59 2yuy h THR 17 Cb 1.38 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 67.80 2yuy h THR 17 CO 1.05 0.00 0.00 -1.20 -0.25 0.00 0.00 175.52 175.12 2yuy n SER 18 N -2.19 0.00 -3.71 5.36 7.64 -1.26 -5.10 113.62 114.36 2yuy n SER 18 Ca -0.00 0.00 -0.24 0.00 1.01 0.00 0.00 58.87 59.63 2yuy n SER 18 Cb 0.01 0.00 -0.17 0.00 -1.01 0.00 0.00 64.21 63.03 2yuy n SER 18 CO 0.00 0.00 0.00 -1.58 -3.01 0.00 0.00 175.04 170.45 2yuy s GLN 19 N 0.00 0.37 -0.01 1.43 0.74 -1.26 -5.00 119.66 115.93 2yuy s GLN 19 Ca 0.00 -0.03 -0.01 0.00 0.05 0.00 0.00 55.36 55.37 2yuy s GLN 19 Cb 0.00 -1.40 0.00 0.00 1.10 0.00 0.00 33.01 32.71 2yuy s GLN 19 CO 0.00 -0.49 0.01 0.41 -0.55 0.00 0.00 175.29 174.68 2yuy n GLY 20 N 5.18 -3.10 3.32 2.59 0.00 -1.26 -4.96 105.19 106.96 2yuy n GLY 20 Ca -0.07 -0.33 -0.38 0.00 0.00 0.00 0.00 46.02 45.23 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 0.14 -2.20 0.00 1.61 3.72 -1.26 -4.88 117.46 114.59 2yuy n PHE 21 Ca -0.02 0.43 0.00 0.00 -0.05 0.00 0.00 57.45 57.81 2yuy n PHE 21 Cb 0.03 -1.77 0.00 0.00 -0.94 0.00 0.00 39.48 36.80 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 2.28 -2.00 3.10 1.37 0.00 -1.26 -4.62 105.19 104.06 2yuy n GLY 22 Ca 0.09 0.39 -0.25 0.00 0.00 0.00 0.00 46.02 46.25 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 -0.51 -1.86 -3.69 1.61 -1.74 -1.26 -4.48 117.46 105.52 2yuy n PHE 23 Ca 0.00 0.14 -0.10 0.00 -0.56 0.00 0.00 57.45 56.93 2yuy n PHE 23 Cb 0.00 -1.45 -0.03 0.00 1.52 0.00 0.00 39.48 39.53 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 -2.12 0.01 0.52 1.97 -1.32 -1.13 -4.96 115.64 108.62 2yuy s THR 24 Ca 0.42 -0.64 0.06 0.00 -1.21 0.00 0.00 61.69 60.32 2yuy s THR 24 Cb -0.06 -1.54 0.03 0.00 -1.51 0.00 0.00 72.50 69.41 2yuy s THR 24 CO 0.48 -0.05 0.37 -0.76 -2.21 0.00 0.00 174.62 172.45 2yuy s LEU 25 N -2.85 2.77 0.14 9.08 2.01 -1.26 0.12 118.68 128.68 2yuy s LEU 25 Ca 0.08 -1.21 -0.11 0.00 0.01 0.00 0.00 54.13 52.89 2yuy s LEU 25 Cb -0.02 -1.25 0.01 0.00 0.01 0.00 0.00 46.19 44.93 2yuy s LEU 25 CO -0.03 -1.02 0.30 -0.60 1.01 0.00 0.00 176.35 176.02 2yuy s ARG 26 N -4.22 1.08 0.00 1.70 6.06 -1.25 -4.64 118.95 117.67 2yuy s ARG 26 Ca 0.34 -1.00 0.00 0.00 -2.50 0.00 0.00 55.73 52.58 2yuy s ARG 26 Cb -0.02 0.40 0.00 0.00 0.06 0.00 0.00 34.95 35.39 2yuy s ARG 26 CO 0.21 -0.39 0.00 0.72 -2.50 0.00 0.00 175.30 173.33 2yuy n HIS 27 N -0.19 0.00 -2.66 5.12 8.25 -1.26 -4.83 115.22 119.65 2yuy n HIS 27 Ca -0.11 0.00 -0.40 0.00 -0.26 0.00 0.00 57.72 56.95 2yuy n HIS 27 Cb 0.63 -1.45 -0.05 0.00 1.12 0.00 0.00 29.99 30.23 2yuy n HIS 27 CO 0.00 0.00 0.00 -0.59 0.64 0.00 0.00 176.34 176.39 2yuy s PHE 28 N 0.00 3.86 -0.06 4.41 -0.71 -1.26 -5.03 117.98 119.20 2yuy s PHE 28 Ca 0.00 1.85 -0.01 0.00 -1.04 0.00 0.00 56.93 57.73 2yuy s PHE 28 Cb 0.00 -3.07 0.03 0.00 -1.21 0.00 0.00 43.02 38.76 2yuy s PHE 28 CO 0.00 0.15 0.00 0.42 -1.34 0.00 0.00 175.22 174.45 2yuy s ILE 29 N -1.17 0.30 0.00 -4.49 -1.09 -1.26 -5.11 121.20 108.38 2yuy s ILE 29 Ca 0.42 0.12 0.00 0.00 -2.23 0.00 0.00 60.65 58.96 2yuy s ILE 29 Cb -0.28 -0.44 0.00 0.00 -1.58 0.00 0.00 42.46 40.16 2yuy s ILE 29 CO 0.35 0.22 0.00 0.52 -1.23 0.00 0.00 174.94 174.80 2yuy n VAL 30 N 4.82 0.00 -3.73 2.92 0.31 -1.26 -4.24 118.33 117.15 2yuy n VAL 30 Ca -0.13 0.00 -0.26 0.00 -0.01 0.00 0.00 64.34 63.94 2yuy n VAL 30 Cb 0.50 0.00 0.03 0.00 -0.91 0.00 0.00 33.84 33.46 2yuy n VAL 30 CO 0.00 0.00 0.00 -1.22 -1.32 0.00 0.00 176.83 174.29 2yuy n TYR 31 N 0.00 -1.88 -1.57 3.52 4.01 -1.26 -4.95 117.16 115.03 2yuy n TYR 31 Ca 0.00 0.65 -0.31 0.00 -0.16 0.00 0.00 57.90 58.08 2yuy n TYR 31 Cb 0.00 -3.81 0.06 0.00 -0.31 0.00 0.00 39.34 35.29 2yuy n TYR 31 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 2yuy s PRO 32 N -6.02 2.63 0.00 -0.72 0.04 -1.26 -5.00 135.00 124.66 2yuy s PRO 32 Ca 0.23 0.83 0.00 0.00 0.04 0.00 0.00 61.00 62.10 2yuy s PRO 32 Cb -0.08 -1.96 0.00 0.00 0.04 0.00 0.00 34.50 32.50 2yuy s PRO 32 CO 0.85 -1.29 0.00 -0.35 0.04 0.00 0.00 177.00 176.25 2yuy n PRO 33 N -3.24 0.01 -0.09 0.56 -0.04 -1.26 -5.03 135.00 125.91 2yuy n PRO 33 Ca 0.07 0.00 -0.04 0.00 -0.04 0.00 0.00 63.50 63.50 2yuy n PRO 33 Cb 0.55 0.00 0.03 0.00 -0.04 0.00 0.00 33.50 34.04 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 -0.83 -1.63 -0.32 0.54 1.02 -1.26 -4.79 120.64 113.37 2yuy n GLU 34 Ca 0.00 -0.20 0.24 0.00 -0.02 0.00 0.00 57.16 57.18 2yuy n GLU 34 Cb 0.00 -0.20 0.45 0.00 -0.02 0.00 0.00 31.44 31.67 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 -3.26 0.15 0.00 1.62 2.88 -1.26 -4.54 113.62 109.21 2yuy n SER 35 Ca 0.02 1.62 0.00 0.00 -1.33 0.00 0.00 58.87 59.17 2yuy n SER 35 Cb 0.07 -0.70 0.00 0.00 -0.75 0.00 0.00 64.21 62.83 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 -2.66 0.00 -1.04 -1.46 0.00 -1.26 -4.55 120.51 109.54 2yuy n ALA 36 Ca 0.31 0.00 -0.37 0.00 0.00 0.00 0.00 53.44 53.38 2yuy n ALA 36 Cb 1.03 0.00 0.04 0.00 0.00 0.00 0.00 19.45 20.52 2yuy n ALA 36 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.50 176.61 2yuy n ILE 37 N 0.00 0.01 -3.54 0.00 5.41 -1.26 -5.00 119.36 114.97 2yuy n ILE 37 Ca 0.00 -0.50 -0.17 0.00 1.00 0.00 0.00 62.75 63.08 2yuy n ILE 37 Cb 0.00 -0.01 -0.06 0.00 -0.71 0.00 0.00 39.64 38.86 2yuy n ILE 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2yuy s GLN 38 N -1.84 1.02 -0.14 0.38 -2.07 -1.26 -5.12 119.66 110.63 2yuy s GLN 38 Ca 0.43 0.22 -0.40 0.00 -1.82 0.00 0.00 55.36 53.80 2yuy s GLN 38 Cb -0.24 0.48 -0.18 0.00 -1.09 0.00 0.00 33.01 31.98 2yuy s GLN 38 CO 0.80 -0.31 1.45 1.97 -1.32 0.00 0.00 175.29 177.88 2yuy n PHE 39 N 0.96 1.55 -3.64 9.60 -1.74 -1.26 -4.92 117.46 118.01 2yuy n PHE 39 Ca -0.19 0.77 -0.06 0.00 -0.56 0.00 0.00 57.45 57.41 2yuy n PHE 39 Cb 0.57 -2.31 -0.06 0.00 1.52 0.00 0.00 39.48 39.20 2yuy n PHE 39 CO 0.00 0.00 0.00 0.45 -0.56 0.00 0.00 176.76 176.65 2yuy s SER 40 N 1.73 -0.21 0.10 5.98 0.15 -1.26 -5.09 113.70 115.11 2yuy s SER 40 Ca 0.93 0.36 0.00 0.00 0.70 0.00 0.00 55.95 57.95 2yuy s SER 40 Cb -1.14 0.35 0.00 0.00 -1.71 0.00 0.00 66.02 63.52 2yuy s SER 40 CO 0.60 -0.10 0.00 0.00 1.20 0.00 0.00 173.24 174.94 2yuy n TYR 41 N 1.51 -0.53 -4.97 3.44 4.19 -1.26 -5.07 117.16 114.48 2yuy n TYR 41 Ca -0.09 0.09 -0.32 0.00 3.31 0.00 0.00 57.90 60.88 2yuy n TYR 41 Cb 0.57 0.18 -0.15 0.00 0.49 0.00 0.00 39.34 40.43 2yuy n TYR 41 CO 0.00 0.00 0.00 0.21 0.91 0.00 0.00 176.86 177.98 2yuy s LYS 42 N -2.00 2.92 0.05 2.98 2.47 -1.26 -5.00 119.74 119.90 2yuy s LYS 42 Ca 0.00 -0.76 -0.00 0.00 -1.56 0.00 0.00 55.97 53.65 2yuy s LYS 42 Cb 0.00 -2.42 -0.00 0.00 -1.46 0.00 0.00 37.83 33.95 2yuy s LYS 42 CO 0.00 0.36 -0.01 -0.25 0.16 0.00 0.00 175.35 175.61 2yuy n ASP 43 N 3.07 0.60 -1.34 1.43 8.00 -1.26 -5.14 116.55 121.91 2yuy n ASP 43 Ca -0.18 0.08 0.16 0.00 0.71 0.00 0.00 54.79 55.56 2yuy n ASP 43 Cb 0.52 -0.19 -0.08 0.00 -0.02 0.00 0.00 41.12 41.36 2yuy n ASP 43 CO 0.00 0.00 0.00 1.21 -0.39 0.00 0.00 177.20 178.02 2yuy n GLU 44 N -3.28 -2.87 -1.17 -1.24 0.00 -1.26 -5.00 120.64 105.82 2yuy n GLU 44 Ca -0.01 2.28 0.07 0.00 0.00 0.00 0.00 57.16 59.50 2yuy n GLU 44 Cb 0.25 -3.45 -0.04 0.00 0.00 0.00 0.00 31.44 28.21 2yuy n GLU 44 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.13 177.52 2yuy n GLU 45 N -4.14 -2.90 -1.25 5.31 4.71 -1.26 -4.89 120.64 116.22 2yuy n GLU 45 Ca -0.07 2.31 -0.31 0.00 -0.01 0.00 0.00 57.16 59.09 2yuy n GLU 45 Cb 0.63 -3.08 0.09 0.00 -1.01 0.00 0.00 31.44 28.06 2yuy n GLU 45 CO 0.00 0.00 0.00 1.21 0.09 0.00 0.00 177.13 178.43 2yuy s ASN 46 N -5.72 4.47 0.00 1.62 3.84 -1.26 -5.01 114.94 112.88 2yuy s ASN 46 Ca 0.00 1.84 0.00 0.00 0.21 0.00 0.00 52.86 54.91 2yuy s ASN 46 Cb 0.00 -2.52 0.00 0.00 -0.55 0.00 0.00 41.25 38.18 2yuy s ASN 46 CO 0.00 -2.06 0.00 0.61 -2.79 0.00 0.00 177.10 172.86 2yuy n GLY 47 N -1.15 4.62 0.00 1.21 0.00 -1.26 -5.17 105.19 103.43 2yuy n GLY 47 Ca 0.09 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.41 2yuy n GLY 47 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2yuy n ASN 48 N 0.00 0.00 -3.60 1.61 3.02 -1.26 -5.14 115.26 109.89 2yuy n ASN 48 Ca 0.00 0.00 -0.04 0.00 -0.03 0.00 0.00 54.58 54.51 2yuy n ASN 48 Cb 0.00 0.00 -0.02 0.00 -0.61 0.00 0.00 39.78 39.15 2yuy n ASN 48 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2yuy s ARG 49 N 0.00 0.31 0.00 3.52 3.03 -1.26 -5.19 118.95 119.36 2yuy s ARG 49 Ca 0.00 -0.11 0.00 0.00 2.03 0.00 0.00 55.73 57.65 2yuy s ARG 49 Cb 0.00 0.14 0.00 0.00 -1.03 0.00 0.00 34.95 34.06 2yuy s ARG 49 CO 0.00 -0.13 0.00 0.41 -1.13 0.00 0.00 175.30 174.45 2yuy n GLY 50 N -0.09 1.70 3.65 3.88 0.00 -1.26 -5.18 105.19 107.89 2yuy n GLY 50 Ca 0.00 -1.01 -0.04 0.00 0.00 0.00 0.00 46.02 44.98 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 0.24 -0.03 -0.02 0.00 -1.26 -5.19 107.32 101.07 2yuy s GLY 51 Ca 0.00 3.32 -0.31 0.00 0.00 0.00 0.00 44.72 47.73 2yuy s GLY 51 CO 0.00 1.86 1.21 0.54 0.00 0.00 0.00 173.10 176.72 2yuy s LYS 52 N -0.01 0.49 0.76 2.90 1.02 -1.26 -5.15 119.74 118.49 2yuy s LYS 52 Ca 0.07 -0.25 -0.17 0.00 0.02 0.00 0.00 55.97 55.63 2yuy s LYS 52 Cb -0.05 0.18 -0.13 0.00 -0.52 0.00 0.00 37.83 37.31 2yuy s LYS 52 CO -0.13 -0.22 -0.33 0.94 -0.92 0.00 0.00 175.35 174.68 2yuy n GLN 53 N -0.39 0.03 -4.01 1.68 -0.06 -1.26 -5.00 117.38 108.37 2yuy n GLN 53 Ca -0.06 0.02 -0.11 0.00 -2.00 0.00 0.00 57.00 54.85 2yuy n GLN 53 Cb 0.62 -1.13 -0.11 0.00 -4.06 0.00 0.00 30.24 25.56 2yuy n GLN 53 CO 0.00 0.00 0.00 0.50 -0.20 0.00 0.00 177.06 177.36 2yuy s ARG 54 N -1.74 0.39 0.12 3.69 3.52 -1.26 -4.85 118.95 118.82 2yuy s ARG 54 Ca 0.50 -0.65 -0.14 0.00 -0.13 0.00 0.00 55.73 55.31 2yuy s ARG 54 Cb -0.33 -0.04 -0.03 0.00 -1.56 0.00 0.00 34.95 32.99 2yuy s ARG 54 CO 0.73 -0.01 1.54 -0.97 -0.81 0.00 0.00 175.30 175.77 2yuy h ASN 55 N 4.63 0.75 -4.27 -2.12 -1.24 -1.94 -3.49 115.58 107.90 2yuy h ASN 55 Ca -0.33 -0.35 0.00 0.00 0.71 0.00 0.00 56.30 56.33 2yuy h ASN 55 Cb 1.21 -0.20 0.00 0.00 0.73 0.00 0.00 38.32 40.05 2yuy h ASN 55 CO 0.41 0.93 -0.92 -1.14 -1.29 0.00 0.00 177.43 175.43 2yuy n ARG 56 N -4.36 -5.02 -2.11 6.67 0.63 -1.26 -4.93 116.66 106.28 2yuy n ARG 56 Ca -0.01 3.62 -0.03 0.00 -0.92 0.00 0.00 57.85 60.51 2yuy n ARG 56 Cb 0.34 -3.98 0.00 0.00 0.45 0.00 0.00 32.46 29.28 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 0.54 -4.76 -4.94 6.15 7.99 -1.26 -5.05 117.00 115.66 2yuy n LEU 57 Ca 0.00 0.32 -0.25 0.00 -0.01 0.00 0.00 56.01 56.07 2yuy n LEU 57 Cb 0.00 -2.11 -0.02 0.00 -0.11 0.00 0.00 43.42 41.18 2yuy n LEU 57 CO 0.00 -1.16 0.03 -1.61 -1.51 0.00 0.00 177.39 173.14 2yuy s GLU 58 N -1.58 3.48 0.00 3.23 2.02 -1.26 -4.97 118.70 119.62 2yuy s GLU 58 Ca 0.10 -0.48 0.23 0.00 0.02 0.00 0.00 54.97 54.84 2yuy s GLU 58 Cb -0.03 -2.82 1.35 0.00 0.10 0.00 0.00 34.13 32.73 2yuy s GLU 58 CO 0.36 0.36 1.74 -0.35 0.02 0.00 0.00 175.26 177.39 2yuy n PRO 59 N -1.13 0.76 -1.06 0.39 -0.04 -1.26 -4.90 135.00 127.76 2yuy n PRO 59 Ca -0.06 0.00 -0.36 0.00 -0.04 0.00 0.00 63.50 63.04 2yuy n PRO 59 Cb 0.55 -1.47 -0.01 0.00 -0.04 0.00 0.00 33.50 32.53 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 -0.97 0.00 -2.73 0.54 2.81 -1.26 -4.90 117.12 110.61 2yuy n MET 60 Ca 0.17 0.00 -0.01 0.00 -1.81 0.00 0.00 57.70 56.05 2yuy n MET 60 Cb 0.08 -0.79 0.10 0.00 -0.71 0.00 0.00 33.22 31.91 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 1.70 -0.47 -0.68 7.83 2.03 -1.26 -5.13 116.55 120.56 2yuy n ASP 61 Ca 0.12 -2.16 0.08 0.00 0.52 0.00 0.00 54.79 53.35 2yuy n ASP 61 Cb 0.25 0.31 -0.04 0.00 -0.72 0.00 0.00 41.12 40.91 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 -1.24 -0.50 -0.07 5.18 -1.04 -1.26 -4.83 114.28 110.51 2yuy n THR 62 Ca -0.10 0.47 -0.09 0.00 -2.04 0.00 0.00 64.05 62.29 2yuy n THR 62 Cb 0.85 -0.71 -0.06 0.00 -1.82 0.00 0.00 70.33 68.59 2yuy n THR 62 CO 0.00 0.00 0.00 0.40 -0.64 0.00 0.00 175.07 174.83 2yuy h ILE 63 N -0.63 0.75 -4.36 12.58 5.03 -1.89 -3.49 117.51 125.50 2yuy h ILE 63 Ca -0.09 -1.63 0.00 0.00 -0.12 0.00 0.00 64.86 63.02 2yuy h ILE 63 Cb 0.64 1.49 0.00 0.00 -3.03 0.00 0.00 36.82 35.92 2yuy h ILE 63 CO 0.03 0.25 -0.95 0.49 -0.68 0.00 0.00 178.15 177.30 2yuy n PHE 64 N -4.65 -4.91 -1.95 1.37 3.01 -1.24 -3.91 117.46 105.18 2yuy n PHE 64 Ca -0.09 2.84 -0.41 0.00 1.01 0.00 0.00 57.45 60.80 2yuy n PHE 64 Cb 0.30 -3.62 -0.01 0.00 -0.01 0.00 0.00 39.48 36.13 2yuy n PHE 64 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 2yuy s VAL 65 N -0.97 2.39 -0.08 -4.37 1.01 -0.24 -3.84 120.40 114.29 2yuy s VAL 65 Ca 0.00 0.38 -0.04 0.00 0.00 0.00 0.00 61.98 62.32 2yuy s VAL 65 Cb 0.00 -3.24 -0.01 0.00 0.00 0.00 0.00 36.38 33.12 2yuy s VAL 65 CO 0.00 0.09 -0.08 0.50 0.00 0.00 0.00 175.10 175.61 2yuy h LYS 66 N 3.43 0.00 -4.05 2.72 1.63 0.63 -3.23 116.57 117.70 2yuy h LYS 66 Ca -0.49 0.00 -0.15 0.00 -0.85 0.00 0.00 60.65 59.16 2yuy h LYS 66 Cb 1.23 0.00 -0.11 0.00 -0.60 0.00 0.00 32.23 32.75 2yuy h LYS 66 CO 0.67 0.00 -0.32 -0.65 -3.45 0.00 0.00 179.45 175.70 2yuy s GLN 67 N -1.66 1.44 -0.08 1.90 -0.21 -1.24 -4.85 119.66 114.96 2yuy s GLN 67 Ca -0.06 -1.44 0.00 0.00 0.02 0.00 0.00 55.36 53.88 2yuy s GLN 67 Cb 0.01 0.39 0.02 0.00 1.00 0.00 0.00 33.01 34.43 2yuy s GLN 67 CO 0.10 -0.56 -0.06 0.08 -2.12 0.00 0.00 175.29 172.72 2yuy s VAL 68 N -4.00 0.82 -0.27 1.09 1.01 -1.26 -2.82 120.40 114.97 2yuy s VAL 68 Ca 0.30 -0.21 -0.29 0.00 0.00 0.00 0.00 61.98 61.78 2yuy s VAL 68 Cb 0.02 -0.85 -0.02 0.00 0.00 0.00 0.00 36.38 35.54 2yuy s VAL 68 CO 0.11 0.32 1.61 -0.75 0.00 0.00 0.00 175.10 176.39 2yuy s LYS 69 N 1.41 3.67 -0.73 2.72 2.47 -1.26 -4.89 119.74 123.13 2yuy s LYS 69 Ca -0.02 1.49 -0.26 0.00 -1.56 0.00 0.00 55.97 55.63 2yuy s LYS 69 Cb -0.13 -4.06 -0.08 0.00 -1.46 0.00 0.00 37.83 32.10 2yuy s LYS 69 CO -0.04 -1.45 2.17 -2.00 0.16 0.00 0.00 175.35 174.19 2yuy s GLU 70 N 4.90 2.17 0.00 4.03 2.56 -1.26 -1.37 118.70 129.74 2yuy s GLU 70 Ca 0.71 0.46 0.00 0.00 0.00 0.00 0.00 54.97 56.14 2yuy s GLU 70 Cb -0.22 -4.75 0.00 0.00 2.00 0.00 0.00 34.13 31.15 2yuy s GLU 70 CO 0.30 -3.58 0.00 0.41 -0.56 0.00 0.00 175.26 171.83 2yuy n GLY 71 N 6.45 1.73 0.00 -1.50 0.00 -1.26 -5.13 105.19 105.48 2yuy n GLY 71 Ca 0.38 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.40 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 -0.38 6.44 0.12 -0.02 0.00 -0.47 -5.04 105.19 105.85 2yuy n GLY 72 Ca 0.00 -2.00 -0.04 0.00 0.00 0.00 0.00 46.02 43.98 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 -0.23 -0.52 1.61 0.13 -1.88 -3.13 132.00 127.98 2yuy h PRO 73 Ca 0.00 0.02 0.09 0.00 -0.87 0.00 0.00 66.00 65.24 2yuy h PRO 73 Cb 0.00 0.05 -0.10 0.00 0.13 0.00 0.00 31.00 31.08 2yuy h PRO 73 CO 0.00 -0.15 -0.36 0.00 -0.23 0.00 0.00 178.00 177.25 2yuy h ALA 74 N -1.36 -0.18 -0.92 -0.56 0.00 -1.90 0.22 119.26 114.55 2yuy h ALA 74 Ca -0.02 0.12 0.23 0.00 0.00 0.00 0.00 54.91 55.24 2yuy h ALA 74 Cb 0.18 0.81 -0.17 0.00 0.00 0.00 0.00 17.79 18.62 2yuy h ALA 74 CO 0.04 -0.74 -0.04 0.35 0.00 0.00 0.00 179.25 178.85 2yuy h PHE 75 N -0.22 -0.16 0.35 0.00 3.57 -1.77 0.94 116.94 119.65 2yuy h PHE 75 Ca 0.19 0.07 -0.02 0.00 3.53 0.00 0.00 57.97 61.75 2yuy h PHE 75 Cb 0.56 0.22 0.00 0.00 2.79 0.00 0.00 35.95 39.52 2yuy h PHE 75 CO -0.63 -0.38 -0.17 0.93 -2.23 0.00 0.00 178.31 175.84 2yuy h GLU 76 N 0.03 -0.45 -1.87 1.11 4.39 -0.62 -2.67 114.58 114.51 2yuy h GLU 76 Ca 0.52 0.03 0.55 0.00 0.34 0.00 0.00 59.36 60.80 2yuy h GLU 76 Cb 0.97 0.10 -0.08 0.00 -0.10 0.00 0.00 28.75 29.65 2yuy h GLU 76 CO -0.88 -0.14 1.34 0.00 -1.16 0.00 0.00 179.01 178.17 2yuy h ALA 77 N -0.25 3.75 0.00 3.43 0.00 0.14 -3.42 119.26 122.90 2yuy h ALA 77 Ca -0.05 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.81 2yuy h ALA 77 Cb 0.51 0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.45 2yuy h ALA 77 CO 0.08 -2.30 0.00 0.41 0.00 0.00 0.00 179.25 177.44 2yuy n GLY 78 N -1.89 1.28 3.66 0.00 0.00 -0.41 -4.79 105.19 103.04 2yuy n GLY 78 Ca 0.42 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.15 2yuy n GLY 78 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2yuy s LEU 79 N 0.00 1.88 0.00 0.99 2.96 -0.86 -5.02 118.68 118.63 2yuy s LEU 79 Ca 0.00 1.48 0.00 0.00 -0.22 0.00 0.00 54.13 55.39 2yuy s LEU 79 Cb 0.00 -3.74 -0.00 0.00 0.50 0.00 0.00 46.19 42.95 2yuy s LEU 79 CO 0.00 -3.09 0.02 0.00 -1.32 0.00 0.00 176.35 171.96 2yuy s THR 81 N -2.33 4.81 0.00 0.00 -4.23 -1.26 -4.25 115.64 108.38 2yuy s THR 81 Ca 0.02 -0.04 0.00 0.00 -1.18 0.00 0.00 61.69 60.48 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 0.01 0.55 0.00 0.61 -0.54 0.00 0.00 174.62 175.25 2yuy n GLY 82 N 2.71 0.74 3.75 3.99 0.00 -1.22 -4.96 105.19 110.19 2yuy n GLY 82 Ca -0.18 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.43 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 -2.57 7.18 -0.12 1.61 1.01 -1.26 -4.67 116.67 117.85 2yuy s ASP 83 Ca 0.00 2.23 -0.15 0.00 0.71 0.00 0.00 52.55 55.34 2yuy s ASP 83 Cb 0.00 -2.61 -0.05 0.00 1.01 0.00 0.00 42.92 41.27 2yuy s ASP 83 CO 0.00 -0.26 0.35 -0.13 0.21 0.00 0.00 175.17 175.33 2yuy s ARG 84 N -0.73 4.17 -0.18 8.23 3.00 -1.26 -1.07 118.95 131.11 2yuy s ARG 84 Ca 0.49 0.22 -0.27 0.00 0.00 0.00 0.00 55.73 56.18 2yuy s ARG 84 Cb -0.32 -3.38 -0.01 0.00 0.00 0.00 0.00 34.95 31.25 2yuy s ARG 84 CO 0.38 0.33 0.90 0.42 0.00 0.00 0.00 175.30 177.33 2yuy s ILE 85 N 0.13 4.82 -0.14 1.52 -1.09 -1.26 -3.78 121.20 121.40 2yuy s ILE 85 Ca 0.20 1.76 -0.05 0.00 -2.23 0.00 0.00 60.65 60.33 2yuy s ILE 85 Cb -0.14 -4.19 -0.07 0.00 -1.58 0.00 0.00 42.46 36.48 2yuy s ILE 85 CO 0.07 -0.02 -0.17 2.30 -1.23 0.00 0.00 174.94 175.88 2yuy n ILE 86 N 4.87 0.80 -4.32 2.92 -5.35 0.57 -4.74 119.36 114.10 2yuy n ILE 86 Ca 0.07 -0.23 -0.17 0.00 -0.27 0.00 0.00 62.75 62.15 2yuy n ILE 86 Cb 0.48 -1.53 -0.10 0.00 -1.74 0.00 0.00 39.64 36.74 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 -2.27 1.35 0.00 6.28 1.02 -1.17 -1.96 119.74 122.99 2yuy s LYS 87 Ca -0.20 -1.70 0.00 0.00 0.02 0.00 0.00 55.97 54.09 2yuy s LYS 87 Cb 0.07 -0.48 0.00 0.00 -0.52 0.00 0.00 37.83 36.90 2yuy s LYS 87 CO 0.27 -0.17 0.00 0.28 -0.92 0.00 0.00 175.35 174.81 2yuy n VAL 88 N -0.43 0.00 -2.61 3.17 0.31 -1.26 -0.34 118.33 117.17 2yuy n VAL 88 Ca -0.04 0.00 -0.38 0.00 -0.01 0.00 0.00 64.34 63.92 2yuy n VAL 88 Cb 0.65 0.00 0.01 0.00 -0.91 0.00 0.00 33.84 33.59 2yuy n VAL 88 CO 0.00 0.00 0.00 -0.46 -1.32 0.00 0.00 176.83 175.05 2yuy n ASN 89 N 0.00 6.74 -1.31 4.52 0.23 -1.09 -3.12 115.26 121.22 2yuy n ASN 89 Ca 0.00 -3.71 -0.07 0.00 -0.53 0.00 0.00 54.58 50.27 2yuy n ASN 89 Cb 0.00 -1.01 0.02 0.00 -2.08 0.00 0.00 39.78 36.71 2yuy n ASN 89 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 2yuy n GLY 90 N -0.17 0.43 0.03 4.83 0.00 -1.26 -4.94 105.19 104.11 2yuy n GLY 90 Ca 0.44 -0.44 -0.03 0.00 0.00 0.00 0.00 46.02 46.00 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 -1.82 1.69 -1.03 1.61 -0.58 -1.26 -5.13 120.64 114.12 2yuy n GLU 91 Ca -0.01 0.02 0.00 0.00 -0.42 0.00 0.00 57.16 56.75 2yuy n GLU 91 Cb 0.53 -1.12 0.00 0.00 -0.57 0.00 0.00 31.44 30.28 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 -2.42 -5.81 -2.19 1.62 2.88 -1.26 -4.81 113.62 101.62 2yuy n SER 92 Ca -0.09 0.70 -0.23 0.00 -1.33 0.00 0.00 58.87 57.91 2yuy n SER 92 Cb 0.63 -2.31 0.18 0.00 -0.75 0.00 0.00 64.21 61.96 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 0.20 3.19 -1.95 2.46 0.24 -0.83 -4.81 118.33 116.83 2yuy n VAL 93 Ca 0.00 -1.97 -0.30 0.00 -2.04 0.00 0.00 64.34 60.03 2yuy n VAL 93 Cb 0.00 -0.47 -0.04 0.00 -1.47 0.00 0.00 33.84 31.85 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 -3.32 3.33 0.00 1.34 1.01 -1.26 -2.23 121.20 120.07 2yuy s ILE 94 Ca 0.57 -0.11 0.00 0.00 0.00 0.00 0.00 60.65 61.10 2yuy s ILE 94 Cb 0.48 -3.79 0.00 0.00 0.01 0.00 0.00 42.46 39.16 2yuy s ILE 94 CO 0.10 -0.75 0.00 0.61 0.00 0.00 0.00 174.94 174.90 2yuy n GLY 95 N 6.41 2.92 3.74 6.18 0.00 -1.26 -5.05 105.19 118.13 2yuy n GLY 95 Ca 0.34 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 46.00 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 -0.04 2.66 0.53 1.61 1.02 -0.95 -5.03 119.74 119.54 2yuy s LYS 96 Ca 0.00 2.01 0.06 0.00 0.02 0.00 0.00 55.97 58.06 2yuy s LYS 96 Cb 0.00 -1.87 0.04 0.00 -0.52 0.00 0.00 37.83 35.48 2yuy s LYS 96 CO 0.00 -1.50 0.46 -0.08 -0.92 0.00 0.00 175.35 173.31 2yuy s THR 97 N -1.44 1.85 0.06 2.17 -1.32 -1.26 -4.88 115.64 110.81 2yuy s THR 97 Ca 0.81 -1.40 -0.16 0.00 -1.21 0.00 0.00 61.69 59.73 2yuy s THR 97 Cb -0.36 -2.25 -0.06 0.00 -1.51 0.00 0.00 72.50 68.32 2yuy s THR 97 CO 0.38 0.00 1.26 0.22 -2.21 0.00 0.00 174.62 174.27 2yuy h TYR 98 N 0.70 -0.81 -0.94 9.09 3.20 -1.96 0.13 116.97 126.39 2yuy h TYR 98 Ca -0.36 0.04 0.22 0.00 3.14 0.00 0.00 58.73 61.76 2yuy h TYR 98 Cb 1.30 0.37 -0.18 0.00 1.54 0.00 0.00 36.73 39.76 2yuy h TYR 98 CO 0.84 -0.24 -0.11 0.66 -1.64 0.00 0.00 178.16 177.66 2yuy h SER 99 N -0.22 -0.67 0.00 -2.11 4.64 -1.94 1.53 113.55 114.78 2yuy h SER 99 Ca 0.03 0.27 0.00 0.00 -0.47 0.00 0.00 61.79 61.62 2yuy h SER 99 Cb 0.30 0.52 0.00 0.00 -0.31 0.00 0.00 62.40 62.91 2yuy h SER 99 CO -0.26 -0.32 0.00 0.00 -0.87 0.00 0.00 176.83 175.39 2yuy n GLN 100 N -5.53 0.00 -0.29 4.77 6.02 -0.27 -1.70 117.38 120.38 2yuy n GLN 100 Ca 0.18 0.47 0.12 0.00 -0.01 0.00 0.00 57.00 57.76 2yuy n GLN 100 Cb 0.59 -1.40 0.27 0.00 1.02 0.00 0.00 30.24 30.71 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 0.37 -0.73 5.09 -1.51 0.12 0.34 116.25 119.93 2yuy h VAL 101 Ca 0.00 -0.09 0.14 0.00 -1.23 0.00 0.00 66.70 65.52 2yuy h VAL 101 Cb 0.00 0.11 -0.14 0.00 -2.13 0.00 0.00 31.29 29.13 2yuy h VAL 101 CO 0.00 0.05 -0.26 0.40 -1.23 0.00 0.00 177.57 176.53 2yuy h ILE 102 N 0.25 0.19 -0.56 7.19 1.08 0.23 0.62 117.51 126.51 2yuy h ILE 102 Ca 0.53 0.00 0.02 0.00 -0.39 0.00 0.00 64.86 65.01 2yuy h ILE 102 Cb 1.03 0.19 -0.03 0.00 -3.07 0.00 0.00 36.82 34.93 2yuy h ILE 102 CO -0.61 0.00 0.36 0.00 -0.69 0.00 0.00 178.15 177.21 2yuy h ALA 103 N 1.48 0.72 -0.30 1.87 0.00 0.55 0.14 119.26 123.72 2yuy h ALA 103 Ca 0.32 -0.03 0.09 0.00 0.00 0.00 0.00 54.91 55.29 2yuy h ALA 103 Cb 0.56 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 2yuy h ALA 103 CO -0.78 0.11 0.39 -0.07 0.00 0.00 0.00 179.25 178.90 2yuy h LEU 104 N 0.72 0.00 0.02 0.00 3.38 0.88 0.95 115.31 121.26 2yuy h LEU 104 Ca 0.22 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 58.01 2yuy h LEU 104 Cb -0.03 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 2yuy h LEU 104 CO -0.07 0.00 -0.96 0.40 0.09 0.00 0.00 178.44 177.89 2yuy h ILE 105 N 0.00 1.16 -0.34 1.22 2.04 0.10 -2.65 117.51 119.04 2yuy h ILE 105 Ca 0.14 -2.26 0.01 0.00 1.00 0.00 0.00 64.86 63.75 2yuy h ILE 105 Cb 0.92 2.60 -0.02 0.00 -0.74 0.00 0.00 36.82 39.59 2yuy h ILE 105 CO -0.00 0.46 0.23 1.56 0.00 0.00 0.00 178.15 180.39 2yuy h GLN 106 N -0.88 0.44 -0.66 2.37 4.20 0.10 0.19 115.11 120.86 2yuy h GLN 106 Ca -0.25 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.43 2yuy h GLN 106 Cb 1.30 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 28.98 2yuy h GLN 106 CO -0.11 0.29 0.00 0.09 -0.67 0.00 0.00 178.83 178.43 2yuy n ASN 107 N -4.49 4.09 0.31 1.46 3.02 0.31 -4.28 115.26 115.68 2yuy n ASN 107 Ca 0.02 -2.24 0.19 0.00 -0.03 0.00 0.00 54.58 52.52 2yuy n ASN 107 Cb 0.07 -0.51 1.05 0.00 -0.61 0.00 0.00 39.78 39.78 2yuy n ASN 107 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 2yuy h SER 108 N 3.84 0.00 0.00 6.41 4.64 -0.24 -3.48 113.55 124.72 2yuy h SER 108 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2yuy h SER 108 Cb 1.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 2yuy h SER 108 CO 0.13 0.00 0.00 -0.67 -0.87 0.00 0.00 176.83 175.42 2yuy n ASP 109 N -3.44 0.00 -0.07 4.97 2.03 -1.26 -3.96 116.55 114.82 2yuy n ASP 109 Ca -0.03 0.00 -0.07 0.00 0.52 0.00 0.00 54.79 55.21 2yuy n ASP 109 Cb 0.11 0.00 -0.01 0.00 -0.72 0.00 0.00 41.12 40.50 2yuy n ASP 109 CO 0.00 0.00 0.00 0.74 -1.92 0.00 0.00 177.20 176.02 2yuy h THR 110 N 0.00 0.77 -1.13 5.18 2.02 -1.97 -3.44 112.91 114.34 2yuy h THR 110 Ca 0.00 -0.01 -0.47 0.00 0.77 0.00 0.00 66.41 66.70 2yuy h THR 110 Cb 0.00 0.73 0.01 0.00 -1.74 0.00 0.00 68.15 67.15 2yuy h THR 110 CO 0.00 0.01 -0.22 0.42 0.37 0.00 0.00 175.52 176.09 2yuy s THR 111 N -6.20 2.50 -0.29 3.16 -4.23 -1.25 -0.21 115.64 109.11 2yuy s THR 111 Ca -0.13 -1.10 -0.03 0.00 -1.18 0.00 0.00 61.69 59.24 2yuy s THR 111 Cb 0.11 -2.60 0.17 0.00 1.34 0.00 0.00 72.50 71.52 2yuy s THR 111 CO 0.69 0.00 0.59 -0.22 -0.54 0.00 0.00 174.62 175.14 2yuy s LEU 112 N -4.42 -1.27 0.11 4.79 1.98 0.20 -4.57 118.68 115.49 2yuy s LEU 112 Ca 0.54 1.00 -0.02 0.00 -2.89 0.00 0.00 54.13 52.76 2yuy s LEU 112 Cb -0.07 2.11 -0.05 0.00 0.66 0.00 0.00 46.19 48.85 2yuy s LEU 112 CO 0.33 -0.25 0.30 -0.70 -1.89 0.00 0.00 176.35 174.14 2yuy s GLU 113 N 2.84 3.52 0.28 1.98 2.12 -1.26 0.27 118.70 128.46 2yuy s GLU 113 Ca 0.14 -0.29 0.03 0.00 0.36 0.00 0.00 54.97 55.21 2yuy s GLU 113 Cb -0.14 -2.94 -0.04 0.00 0.26 0.00 0.00 34.13 31.27 2yuy s GLU 113 CO -0.20 0.53 0.19 -0.51 -0.54 0.00 0.00 175.26 174.72 2yuy s LEU 114 N -2.68 1.55 -0.20 2.70 1.43 0.36 -2.68 118.68 119.17 2yuy s LEU 114 Ca 0.38 -1.57 -0.12 0.00 -1.03 0.00 0.00 54.13 51.78 2yuy s LEU 114 Cb -0.12 0.36 0.06 0.00 0.03 0.00 0.00 46.19 46.51 2yuy s LEU 114 CO 0.27 -0.93 0.48 -0.44 0.23 0.00 0.00 176.35 175.96 2yuy s SER 115 N -3.32 -0.61 0.01 2.29 0.01 0.54 -0.78 113.70 111.85 2yuy s SER 115 Ca 0.38 1.04 0.00 0.00 1.31 0.00 0.00 55.95 58.68 2yuy s SER 115 Cb 0.05 0.94 -0.00 0.00 0.21 0.00 0.00 66.02 67.22 2yuy s SER 115 CO 0.19 -0.20 0.00 1.33 0.41 0.00 0.00 173.24 174.98 2yuy n VAL 116 N 4.01 0.00 -3.61 3.43 0.24 -1.17 -0.32 118.33 120.91 2yuy n VAL 116 Ca -0.21 -0.06 -0.29 0.00 -2.04 0.00 0.00 64.34 61.73 2yuy n VAL 116 Cb 0.56 0.02 -0.14 0.00 -1.47 0.00 0.00 33.84 32.81 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 -2.04 0.59 0.99 7.34 -1.94 -1.25 -2.51 119.30 120.49 2yuy s MET 117 Ca 0.00 -1.08 -0.15 0.00 -1.71 0.00 0.00 55.69 52.75 2yuy s MET 117 Cb 0.00 -1.63 0.19 0.00 2.01 0.00 0.00 34.83 35.39 2yuy s MET 117 CO 0.00 -1.07 1.18 -1.25 -0.01 0.00 0.00 175.02 173.87 2yuy s PRO 118 N 1.48 0.46 0.47 2.03 0.04 -1.26 -4.83 135.00 133.39 2yuy s PRO 118 Ca 0.12 0.04 0.03 0.00 0.04 0.00 0.00 61.00 61.23 2yuy s PRO 118 Cb -0.19 -1.78 0.03 0.00 0.04 0.00 0.00 34.50 32.59 2yuy s PRO 118 CO -0.20 -2.61 0.24 1.63 0.04 0.00 0.00 177.00 176.10 2yuy n LYS 119 N -4.00 0.83 0.27 4.56 5.02 -1.26 -5.06 118.16 118.52 2yuy n LYS 119 Ca 0.10 -3.08 -0.15 0.00 -2.02 0.00 0.00 58.31 53.16 2yuy n LYS 119 Cb 0.59 0.51 -0.08 0.00 -0.02 0.00 0.00 35.03 36.03 2yuy n LYS 119 CO 0.00 0.00 0.00 0.22 -0.52 0.00 0.00 177.40 177.10 2yuy h ASP 120 N 0.74 -0.59 -4.76 4.39 1.82 -2.06 -3.49 116.42 112.46 2yuy h ASP 120 Ca -0.33 -0.06 0.00 0.00 -0.39 0.00 0.00 57.03 56.26 2yuy h ASP 120 Cb 1.11 0.15 -0.05 0.00 0.68 0.00 0.00 39.33 41.22 2yuy h ASP 120 CO 0.52 -0.26 -1.19 -1.20 -1.61 0.00 0.00 179.24 175.50 2yuy n SER 121 N -5.30 -5.88 -4.59 2.28 7.64 -1.26 -4.84 113.62 101.67 2yuy n SER 121 Ca -0.11 1.62 -0.45 0.00 1.01 0.00 0.00 58.87 60.94 2yuy n SER 121 Cb 0.32 -5.11 -0.02 0.00 -1.01 0.00 0.00 64.21 58.39 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 1.73 -0.24 2.80 0.23 0.00 -1.26 -4.78 105.19 103.66 2yuy n GLY 122 Ca -0.16 0.34 -0.39 0.00 0.00 0.00 0.00 46.02 45.81 2yuy n GLY 122 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2yuy n PRO 123 N 0.83 2.32 -3.41 1.61 -0.04 -1.26 -4.69 135.00 130.36 2yuy n PRO 123 Ca 0.10 -2.08 -0.20 0.00 -0.04 0.00 0.00 63.50 61.28 2yuy n PRO 123 Cb 0.31 -2.95 -0.10 0.00 -0.04 0.00 0.00 33.50 30.72 2yuy n PRO 123 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2yuy s SER 124 N 3.79 1.87 -0.20 3.54 1.04 -1.26 -5.11 113.70 117.38 2yuy s SER 124 Ca 0.52 -1.28 -0.07 0.00 0.48 0.00 0.00 55.95 55.61 2yuy s SER 124 Cb 0.14 0.32 0.09 0.00 0.10 0.00 0.00 66.02 66.67 2yuy s SER 124 CO 0.00 -0.34 0.41 -0.55 0.98 0.00 0.00 173.24 173.75 2yuy s SER 125 N 1.85 -0.24 0.00 7.02 0.15 -1.26 -5.22 113.70 115.99 2yuy s SER 125 Ca 0.13 0.98 0.00 0.00 0.70 0.00 0.00 55.95 57.76 2yuy s SER 125 Cb -0.16 1.31 0.00 0.00 -1.71 0.00 0.00 66.02 65.47 2yuy s SER 125 CO -0.19 -0.23 0.00 0.61 1.20 0.00 0.00 173.24 174.63