#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 1.66 0.45 1.61 0.15 -1.26 -5.15 113.70 111.16 2yuy s SER 2 Ca 0.00 -0.69 0.05 0.00 0.70 0.00 0.00 55.95 56.01 2yuy s SER 2 Cb 0.00 0.49 0.01 0.00 -1.71 0.00 0.00 66.02 64.82 2yuy s SER 2 CO 0.00 -0.38 0.63 -0.44 1.20 0.00 0.00 173.24 174.24 2yuy s SER 3 N 2.36 5.60 0.10 5.45 0.01 -1.26 -5.13 113.70 120.83 2yuy s SER 3 Ca 0.09 -0.20 0.02 0.00 1.31 0.00 0.00 55.95 57.17 2yuy s SER 3 Cb -0.14 -0.89 -0.04 0.00 0.21 0.00 0.00 66.02 65.16 2yuy s SER 3 CO -0.31 -0.82 -0.07 -0.83 0.41 0.00 0.00 173.24 171.62 2yuy s GLY 4 N -4.34 0.77 0.00 3.44 0.00 -1.26 -5.15 107.32 100.78 2yuy s GLY 4 Ca 0.54 -1.32 0.00 0.00 0.00 0.00 0.00 44.72 43.93 2yuy s GLY 4 CO 0.35 -1.42 0.00 1.44 0.00 0.00 0.00 173.10 173.46 2yuy n SER 5 N 0.04 0.00 -4.30 1.64 7.64 -1.26 -5.15 113.62 112.22 2yuy n SER 5 Ca -0.13 0.00 -0.33 0.00 1.01 0.00 0.00 58.87 59.42 2yuy n SER 5 Cb 0.60 0.00 0.12 0.00 -1.01 0.00 0.00 64.21 63.93 2yuy n SER 5 CO 0.00 0.00 0.00 -0.24 -3.01 0.00 0.00 175.04 171.79 2yuy n SER 6 N 0.00 -2.70 -3.06 6.43 2.88 -1.26 -4.94 113.62 110.97 2yuy n SER 6 Ca 0.00 0.16 -0.26 0.00 -1.33 0.00 0.00 58.87 57.45 2yuy n SER 6 Cb 0.00 -1.04 -0.05 0.00 -0.75 0.00 0.00 64.21 62.37 2yuy n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2yuy n GLY 7 N 2.00 5.13 7.00 0.46 0.00 -1.26 -5.05 105.19 113.47 2yuy n GLY 7 Ca 0.03 -2.60 0.00 0.00 0.00 0.00 0.00 46.02 43.45 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 0.05 1.05 3.77 -0.02 0.00 -1.26 -4.48 105.19 104.31 2yuy n GLY 8 Ca 0.30 0.69 -0.30 0.00 0.00 0.00 0.00 46.02 46.71 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 -0.02 0.23 1.61 0.04 -1.26 -5.04 135.00 130.55 2yuy s PRO 9 Ca 0.00 -0.15 -0.14 0.00 0.04 0.00 0.00 61.00 60.76 2yuy s PRO 9 Cb 0.00 -1.74 -0.08 0.00 0.04 0.00 0.00 34.50 32.72 2yuy s PRO 9 CO 0.00 -2.90 0.63 0.21 0.04 0.00 0.00 177.00 174.98 2yuy s LYS 10 N -5.59 3.98 -0.02 4.56 2.47 -1.09 -5.03 119.74 119.03 2yuy s LYS 10 Ca 0.71 0.54 0.04 0.00 -1.56 0.00 0.00 55.97 55.69 2yuy s LYS 10 Cb -0.08 -2.70 -0.01 0.00 -1.46 0.00 0.00 37.83 33.58 2yuy s LYS 10 CO 0.54 0.33 -0.12 0.99 0.16 0.00 0.00 175.35 177.25 2yuy s THR 11 N -1.72 0.98 -0.10 3.43 2.01 -1.26 -3.26 115.64 115.72 2yuy s THR 11 Ca 0.46 -0.51 -0.05 0.00 0.31 0.00 0.00 61.69 61.90 2yuy s THR 11 Cb -0.13 -0.83 0.04 0.00 0.01 0.00 0.00 72.50 71.60 2yuy s THR 11 CO 0.20 0.28 0.22 0.68 -0.69 0.00 0.00 174.62 175.31 2yuy s VAL 12 N -0.18 -0.05 0.10 3.82 -7.23 -0.97 -5.00 120.40 110.89 2yuy s VAL 12 Ca 0.03 0.16 0.03 0.00 -1.81 0.00 0.00 61.98 60.39 2yuy s VAL 12 Cb -0.06 -0.35 -0.04 0.00 0.56 0.00 0.00 36.38 36.49 2yuy s VAL 12 CO -0.00 0.07 0.10 -0.89 -0.31 0.00 0.00 175.10 174.06 2yuy s THR 13 N 1.27 4.56 0.06 5.32 2.01 -1.26 0.42 115.64 128.02 2yuy s THR 13 Ca -0.09 -0.82 0.02 0.00 0.31 0.00 0.00 61.69 61.11 2yuy s THR 13 Cb -0.11 -3.22 -0.03 0.00 0.01 0.00 0.00 72.50 69.15 2yuy s THR 13 CO -0.08 0.08 -0.08 -0.76 -0.69 0.00 0.00 174.62 173.09 2yuy s LEU 14 N -2.55 2.32 -0.15 4.42 1.02 0.22 -4.41 118.68 119.55 2yuy s LEU 14 Ca 0.30 -0.67 -0.00 0.00 0.02 0.00 0.00 54.13 53.78 2yuy s LEU 14 Cb -0.12 -0.15 0.03 0.00 0.02 0.00 0.00 46.19 45.97 2yuy s LEU 14 CO 0.23 -0.27 -0.09 -0.54 0.02 0.00 0.00 176.35 175.70 2yuy s LYS 15 N -2.16 1.79 -0.34 1.70 1.02 -1.26 0.35 119.74 120.85 2yuy s LYS 15 Ca -0.04 -0.49 -0.38 0.00 0.02 0.00 0.00 55.97 55.08 2yuy s LYS 15 Cb -0.06 -1.96 -0.14 0.00 -0.52 0.00 0.00 37.83 35.15 2yuy s LYS 15 CO -0.01 -0.32 2.03 -2.13 -0.92 0.00 0.00 175.35 174.00 2yuy n ARG 16 N 4.84 1.00 -2.19 1.68 0.63 0.47 -4.75 116.66 118.35 2yuy n ARG 16 Ca -0.14 0.31 -0.39 0.00 -0.92 0.00 0.00 57.85 56.71 2yuy n ARG 16 Cb 0.49 -2.22 0.02 0.00 0.45 0.00 0.00 32.46 31.20 2yuy n ARG 16 CO 0.00 0.00 0.00 0.25 -2.51 0.00 0.00 177.63 175.37 2yuy n THR 17 N 6.19 4.75 -3.74 5.15 -2.24 -1.26 -4.74 114.28 118.40 2yuy n THR 17 Ca 0.38 -4.89 -0.27 0.00 -2.27 0.00 0.00 64.05 57.00 2yuy n THR 17 Cb 0.16 -1.47 0.06 0.00 -2.10 0.00 0.00 70.33 66.98 2yuy n THR 17 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 2yuy n SER 18 N -0.04 -5.68 -1.78 3.42 7.64 -1.26 -4.90 113.62 111.03 2yuy n SER 18 Ca 0.51 -0.65 0.01 0.00 1.01 0.00 0.00 58.87 59.75 2yuy n SER 18 Cb 0.27 -4.52 0.00 0.00 -1.01 0.00 0.00 64.21 58.95 2yuy n SER 18 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2yuy n GLN 19 N -4.87 0.05 -1.09 1.43 6.02 -1.26 -5.01 117.38 112.65 2yuy n GLN 19 Ca 0.02 -0.21 -0.15 0.00 -0.01 0.00 0.00 57.00 56.66 2yuy n GLN 19 Cb 0.54 0.35 -0.15 0.00 1.02 0.00 0.00 30.24 32.00 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 -0.25 3.25 3.06 1.08 0.00 -1.26 -4.85 105.19 106.21 2yuy n GLY 20 Ca 0.01 -1.33 0.10 0.00 0.00 0.00 0.00 46.02 44.80 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 2.21 -2.77 0.00 1.61 3.72 -1.26 -4.74 117.46 116.24 2yuy n PHE 21 Ca 0.44 0.92 0.00 0.00 -0.05 0.00 0.00 57.45 58.76 2yuy n PHE 21 Cb 0.85 -1.63 0.00 0.00 -0.94 0.00 0.00 39.48 37.76 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 -2.25 -0.27 3.16 1.37 0.00 -1.26 -4.96 105.19 100.99 2yuy n GLY 22 Ca 0.01 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.67 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 -1.91 -1.46 -3.79 1.61 -1.74 -1.26 -3.82 117.46 105.09 2yuy n PHE 23 Ca 0.00 0.35 -0.10 0.00 -0.56 0.00 0.00 57.45 57.14 2yuy n PHE 23 Cb 0.00 -1.49 -0.07 0.00 1.52 0.00 0.00 39.48 39.44 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 -2.14 0.10 0.26 1.97 -1.32 -1.03 -4.85 115.64 108.63 2yuy s THR 24 Ca 0.48 -0.86 0.08 0.00 -1.21 0.00 0.00 61.69 60.18 2yuy s THR 24 Cb -0.03 -1.09 -0.04 0.00 -1.51 0.00 0.00 72.50 69.83 2yuy s THR 24 CO 0.67 -0.48 0.11 -0.76 -2.21 0.00 0.00 174.62 171.95 2yuy s LEU 25 N -2.41 3.56 0.01 9.08 2.01 -1.26 -1.98 118.68 127.68 2yuy s LEU 25 Ca -0.01 -0.42 -0.30 0.00 0.01 0.00 0.00 54.13 53.42 2yuy s LEU 25 Cb 0.01 -2.08 0.11 0.00 0.01 0.00 0.00 46.19 44.24 2yuy s LEU 25 CO -0.07 -0.02 1.20 -0.60 1.01 0.00 0.00 176.35 177.87 2yuy s ARG 26 N -3.77 0.58 0.59 1.70 3.52 -1.19 -4.79 118.95 115.60 2yuy s ARG 26 Ca 0.32 -0.31 0.00 0.00 -0.13 0.00 0.00 55.73 55.61 2yuy s ARG 26 Cb -0.07 0.20 0.00 0.00 -1.56 0.00 0.00 34.95 33.52 2yuy s ARG 26 CO 0.23 -0.26 0.00 0.72 -0.81 0.00 0.00 175.30 175.17 2yuy n HIS 27 N -0.44 -4.13 -3.63 5.12 8.25 -1.26 -3.82 115.22 115.31 2yuy n HIS 27 Ca -0.07 2.25 -0.09 0.00 -0.26 0.00 0.00 57.72 59.54 2yuy n HIS 27 Cb 0.62 -3.55 -0.07 0.00 1.12 0.00 0.00 29.99 28.11 2yuy n HIS 27 CO 0.00 0.00 0.00 0.12 0.64 0.00 0.00 176.34 177.10 2yuy s PHE 28 N -5.09 -0.48 0.00 4.41 5.36 -1.26 -4.57 117.98 116.35 2yuy s PHE 28 Ca 0.00 1.15 0.00 0.00 -0.96 0.00 0.00 56.93 57.12 2yuy s PHE 28 Cb 0.00 0.36 0.00 0.00 -0.34 0.00 0.00 43.02 43.04 2yuy s PHE 28 CO 0.00 -0.24 0.06 -0.89 -1.46 0.00 0.00 175.22 172.69 2yuy n ILE 29 N 2.16 0.00 -0.93 3.12 5.41 -1.26 -5.00 119.36 122.86 2yuy n ILE 29 Ca -0.12 0.33 0.11 0.00 1.00 0.00 0.00 62.75 64.07 2yuy n ILE 29 Cb 0.56 -0.89 -0.03 0.00 -0.71 0.00 0.00 39.64 38.57 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 -0.10 0.00 -3.22 1.39 3.14 -1.26 -4.89 118.33 113.39 2yuy n VAL 30 Ca 0.00 0.12 -0.01 0.00 -2.96 0.00 0.00 64.34 61.48 2yuy n VAL 30 Cb 0.00 -0.40 -0.02 0.00 -1.06 0.00 0.00 33.84 32.36 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 -2.30 -1.52 0.81 1.45 1.51 -1.26 -4.99 117.35 111.05 2yuy s TYR 31 Ca 0.00 0.37 -0.12 0.00 -1.01 0.00 0.00 57.07 56.31 2yuy s TYR 31 Cb 0.00 0.18 0.08 0.00 -0.11 0.00 0.00 41.96 42.11 2yuy s TYR 31 CO 0.00 -1.11 1.10 -1.25 -1.11 0.00 0.00 175.55 173.18 2yuy s PRO 32 N 2.14 1.95 -0.03 -1.71 0.04 -1.26 -5.03 135.00 131.10 2yuy s PRO 32 Ca 0.14 0.59 -0.04 0.00 0.04 0.00 0.00 61.00 61.72 2yuy s PRO 32 Cb -0.08 -1.91 -0.02 0.00 0.04 0.00 0.00 34.50 32.53 2yuy s PRO 32 CO -0.14 -1.71 0.32 -1.00 0.04 0.00 0.00 177.00 174.51 2yuy h PRO 33 N -1.15 -0.14 0.00 0.56 0.13 -2.01 -3.49 132.00 125.89 2yuy h PRO 33 Ca -0.47 0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2yuy h PRO 33 Cb 1.28 0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.44 2yuy h PRO 33 CO 0.60 -0.10 0.00 -0.85 -0.23 0.00 0.00 178.00 177.42 2yuy n GLU 34 N -3.29 0.00 -1.48 0.86 0.00 -1.26 -4.98 120.64 110.49 2yuy n GLU 34 Ca -0.02 0.00 -0.04 0.00 0.00 0.00 0.00 57.16 57.10 2yuy n GLU 34 Cb 0.06 0.00 0.10 0.00 0.00 0.00 0.00 31.44 31.60 2yuy n GLU 34 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.13 177.58 2yuy n SER 35 N -0.69 2.56 0.00 -1.84 2.88 -1.26 -4.94 113.62 110.33 2yuy n SER 35 Ca 0.00 -3.29 0.00 0.00 -1.33 0.00 0.00 58.87 54.25 2yuy n SER 35 Cb 0.00 -0.43 0.00 0.00 -0.75 0.00 0.00 64.21 63.03 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 -0.65 0.00 -2.62 -1.46 0.00 -1.26 -4.98 120.51 109.54 2yuy n ALA 36 Ca 0.23 0.00 -0.05 0.00 0.00 0.00 0.00 53.44 53.62 2yuy n ALA 36 Cb 0.87 0.00 0.01 0.00 0.00 0.00 0.00 19.45 20.32 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 -9.12 -0.04 0.00 5.41 -1.26 -4.98 119.36 109.37 2yuy n ILE 37 Ca 0.00 0.52 -0.01 0.00 1.00 0.00 0.00 62.75 64.25 2yuy n ILE 37 Cb 0.00 -6.57 -0.10 0.00 -0.71 0.00 0.00 39.64 32.26 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 -0.63 1.39 -0.97 0.38 10.64 -1.26 -5.11 117.38 121.82 2yuy n GLN 38 Ca 0.07 -0.05 0.11 0.00 -1.83 0.00 0.00 57.00 55.31 2yuy n GLN 38 Cb 0.40 -1.31 -0.04 0.00 -0.86 0.00 0.00 30.24 28.43 2yuy n GLN 38 CO 0.00 0.00 0.00 1.19 -1.83 0.00 0.00 177.06 176.42 2yuy n PHE 39 N -2.26 -2.20 -0.74 2.61 3.01 -1.26 -5.00 117.46 111.63 2yuy n PHE 39 Ca -0.13 1.13 0.05 0.00 1.01 0.00 0.00 57.45 59.51 2yuy n PHE 39 Cb 0.68 -2.00 -0.03 0.00 -0.01 0.00 0.00 39.48 38.12 2yuy n PHE 39 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 2yuy n SER 40 N -4.29 -3.98 -3.56 4.37 2.88 -1.26 -5.04 113.62 102.74 2yuy n SER 40 Ca -0.01 0.80 -0.00 0.00 -1.33 0.00 0.00 58.87 58.33 2yuy n SER 40 Cb 0.61 -2.29 -0.04 0.00 -0.75 0.00 0.00 64.21 61.73 2yuy n SER 40 CO 0.00 0.00 0.00 -0.47 -1.23 0.00 0.00 175.04 173.34 2yuy s TYR 41 N -4.04 -1.05 0.14 0.66 6.14 -1.26 -5.10 117.35 112.85 2yuy s TYR 41 Ca 0.00 1.84 -0.33 0.00 0.64 0.00 0.00 57.07 59.22 2yuy s TYR 41 Cb 0.00 0.63 -0.18 0.00 0.42 0.00 0.00 41.96 42.83 2yuy s TYR 41 CO 0.00 -0.52 0.84 1.17 0.64 0.00 0.00 175.55 177.68 2yuy n LYS 42 N 5.12 0.30 -3.40 4.97 3.00 -1.26 -4.88 118.16 122.01 2yuy n LYS 42 Ca -0.12 0.11 -0.43 0.00 -0.00 0.00 0.00 58.31 57.87 2yuy n LYS 42 Cb 0.51 -1.38 -0.09 0.00 0.00 0.00 0.00 35.03 34.08 2yuy n LYS 42 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.40 176.89 2yuy s ASP 43 N -0.48 6.14 0.17 3.14 1.01 -1.26 -5.04 116.67 120.36 2yuy s ASP 43 Ca 0.74 -0.93 -0.00 0.00 0.71 0.00 0.00 52.55 53.06 2yuy s ASP 43 Cb -1.01 -2.19 -0.04 0.00 1.01 0.00 0.00 42.92 40.70 2yuy s ASP 43 CO 0.56 -0.54 0.07 -1.61 0.21 0.00 0.00 175.17 173.86 2yuy s GLU 44 N 1.82 1.08 0.19 8.23 0.41 -1.26 -5.12 118.70 124.06 2yuy s GLU 44 Ca 0.07 -1.54 -0.32 0.00 -0.41 0.00 0.00 54.97 52.77 2yuy s GLU 44 Cb -0.20 0.10 -0.15 0.00 -1.78 0.00 0.00 34.13 32.10 2yuy s GLU 44 CO 0.10 -0.27 1.17 0.39 -0.49 0.00 0.00 175.26 176.16 2yuy n GLU 45 N -0.21 1.26 -1.84 1.61 1.02 -1.26 -4.84 120.64 116.38 2yuy n GLU 45 Ca -0.03 0.45 -0.42 0.00 -0.02 0.00 0.00 57.16 57.14 2yuy n GLU 45 Cb 0.64 -1.94 -0.02 0.00 -0.02 0.00 0.00 31.44 30.10 2yuy n GLU 45 CO 0.00 0.00 0.00 1.21 1.18 0.00 0.00 177.13 179.52 2yuy s ASN 46 N -0.04 6.47 0.00 1.62 3.84 -1.26 -5.00 114.94 120.57 2yuy s ASN 46 Ca 0.71 2.81 0.00 0.00 0.21 0.00 0.00 52.86 56.60 2yuy s ASN 46 Cb -0.82 -2.62 0.00 0.00 -0.55 0.00 0.00 41.25 37.26 2yuy s ASN 46 CO 0.53 -0.87 0.00 0.61 -2.79 0.00 0.00 177.10 174.58 2yuy n GLY 47 N 2.83 0.67 3.37 1.21 0.00 -1.26 -5.09 105.19 106.92 2yuy n GLY 47 Ca 0.10 -1.72 -0.32 0.00 0.00 0.00 0.00 46.02 44.08 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 -1.00 3.75 0.24 1.61 3.84 -1.26 -5.10 114.94 117.02 2yuy s ASN 48 Ca 0.00 -0.35 -0.20 0.00 0.21 0.00 0.00 52.86 52.53 2yuy s ASN 48 Cb 0.00 -1.23 0.03 0.00 -0.55 0.00 0.00 41.25 39.50 2yuy s ASN 48 CO 0.00 0.23 0.63 -0.13 -2.79 0.00 0.00 177.10 175.04 2yuy s ARG 49 N -0.06 1.60 0.10 0.43 3.00 -1.26 -5.19 118.95 117.57 2yuy s ARG 49 Ca -0.04 -0.92 0.01 0.00 0.00 0.00 0.00 55.73 54.79 2yuy s ARG 49 Cb -0.14 0.57 -0.00 0.00 0.00 0.00 0.00 34.95 35.38 2yuy s ARG 49 CO 0.04 -0.71 0.11 0.41 0.00 0.00 0.00 175.30 175.15 2yuy n GLY 50 N -0.41 3.35 0.00 -3.53 0.00 -1.26 -5.13 105.19 98.20 2yuy n GLY 50 Ca -0.07 -1.62 0.00 0.00 0.00 0.00 0.00 46.02 44.33 2yuy n GLY 50 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2yuy n GLY 51 N -0.18 2.78 0.11 -0.02 0.00 -1.26 -3.59 105.19 103.03 2yuy n GLY 51 Ca 0.01 -0.59 -0.04 0.00 0.00 0.00 0.00 46.02 45.40 2yuy n GLY 51 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2yuy h LYS 52 N 0.00 -0.27 -2.78 1.61 6.56 -2.00 -3.37 116.57 116.31 2yuy h LYS 52 Ca 0.00 0.02 -0.61 0.00 -1.06 0.00 0.00 60.65 59.00 2yuy h LYS 52 Cb 0.00 0.06 -0.40 0.00 -0.57 0.00 0.00 32.23 31.32 2yuy h LYS 52 CO 0.00 -0.18 -0.75 -1.14 -2.06 0.00 0.00 179.45 175.32 2yuy s GLN 53 N -3.34 1.75 0.00 3.15 0.74 -1.26 -4.78 119.66 115.92 2yuy s GLN 53 Ca -0.04 -2.75 0.00 0.00 0.05 0.00 0.00 55.36 52.61 2yuy s GLN 53 Cb 0.00 -2.52 0.00 0.00 1.10 0.00 0.00 33.01 31.59 2yuy s GLN 53 CO 0.12 -1.32 0.00 0.54 -0.55 0.00 0.00 175.29 174.08 2yuy n ARG 54 N 2.43 0.00 -2.57 1.67 1.74 -1.26 -5.08 116.66 113.59 2yuy n ARG 54 Ca 0.23 0.00 -0.04 0.00 -0.77 0.00 0.00 57.85 57.28 2yuy n ARG 54 Cb 0.40 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.85 2yuy n ARG 54 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 2yuy n ASN 55 N 0.00 -6.97 -4.37 0.55 3.02 -1.26 -4.37 115.26 101.86 2yuy n ASN 55 Ca 0.00 0.79 -0.40 0.00 -0.03 0.00 0.00 54.58 54.94 2yuy n ASN 55 Cb 0.00 -4.63 0.01 0.00 -0.61 0.00 0.00 39.78 34.56 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 0.09 0.29 -2.56 3.52 3.00 -1.24 -3.80 116.66 115.96 2yuy n ARG 56 Ca 0.05 0.11 -0.03 0.00 -0.00 0.00 0.00 57.85 57.98 2yuy n ARG 56 Cb 0.21 -1.32 0.00 0.00 0.00 0.00 0.00 32.46 31.35 2yuy n ARG 56 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.63 178.91 2yuy n LEU 57 N 1.61 -5.97 -1.44 6.15 4.32 -1.26 -4.84 117.00 115.57 2yuy n LEU 57 Ca 0.11 0.19 0.12 0.00 -0.02 0.00 0.00 56.01 56.40 2yuy n LEU 57 Cb 0.44 -2.73 -0.06 0.00 -1.62 0.00 0.00 43.42 39.44 2yuy n LEU 57 CO 0.54 -1.31 -0.56 -0.62 -1.22 0.00 0.00 177.39 174.21 2yuy n GLU 58 N -0.91 -3.34 0.09 3.23 1.02 -1.25 -4.81 120.64 114.67 2yuy n GLU 58 Ca 0.05 2.69 -0.05 0.00 -0.02 0.00 0.00 57.16 59.83 2yuy n GLU 58 Cb 0.41 -3.73 -0.02 0.00 -0.02 0.00 0.00 31.44 28.08 2yuy n GLU 58 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 2yuy h PRO 59 N -0.97 -0.30 -5.54 3.49 0.13 -1.76 -3.44 132.00 123.61 2yuy h PRO 59 Ca -0.13 0.02 -0.21 0.00 -0.87 0.00 0.00 66.00 64.81 2yuy h PRO 59 Cb 1.18 0.07 0.01 0.00 0.13 0.00 0.00 31.00 32.39 2yuy h PRO 59 CO 0.05 -0.20 -0.92 0.00 -0.23 0.00 0.00 178.00 176.70 2yuy n MET 60 N -4.69 -1.07 0.00 0.86 0.00 -1.26 -4.91 117.12 106.05 2yuy n MET 60 Ca -0.04 0.95 0.00 0.00 0.00 0.00 0.00 57.70 58.61 2yuy n MET 60 Cb 0.12 -1.31 0.00 0.00 0.00 0.00 0.00 33.22 32.04 2yuy n MET 60 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 175.97 172.50 2yuy n ASP 61 N 0.51 0.00 0.00 3.17 2.03 -1.26 -4.21 116.55 116.79 2yuy n ASP 61 Ca -0.05 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.26 2yuy n ASP 61 Cb 0.50 0.00 0.00 0.00 -0.72 0.00 0.00 41.12 40.90 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 0.00 0.00 -1.72 5.18 -1.04 -1.26 -5.08 114.28 110.36 2yuy n THR 62 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 2yuy n THR 62 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 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 0.00-10.06 -4.14 12.58 -0.00 -1.26 -3.60 119.36 112.88 2yuy n ILE 63 Ca 0.00 2.33 -0.24 0.00 -0.00 0.00 0.00 62.75 64.84 2yuy n ILE 63 Cb 0.00 -4.73 -0.07 0.00 -0.00 0.00 0.00 39.64 34.84 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 -0.38 2.65 -0.32 1.39 0.08 -1.25 -1.38 117.98 118.77 2yuy s PHE 64 Ca 0.00 -0.44 -0.16 0.00 0.12 0.00 0.00 56.93 56.44 2yuy s PHE 64 Cb 0.00 -1.69 -0.02 0.00 -0.57 0.00 0.00 43.02 40.74 2yuy s PHE 64 CO 0.00 0.32 0.43 0.08 -0.10 0.00 0.00 175.22 175.95 2yuy s VAL 65 N -2.49 5.11 -0.07 -0.44 1.01 0.17 -3.16 120.40 120.54 2yuy s VAL 65 Ca 0.38 0.31 -0.20 0.00 0.00 0.00 0.00 61.98 62.47 2yuy s VAL 65 Cb -0.01 -3.85 -0.15 0.00 0.00 0.00 0.00 36.38 32.37 2yuy s VAL 65 CO 0.22 -0.07 0.78 0.50 0.00 0.00 0.00 175.10 176.53 2yuy h LYS 66 N 8.38 -0.17 -3.91 2.72 3.11 -1.70 -2.86 116.57 122.13 2yuy h LYS 66 Ca -0.29 0.01 -0.13 0.00 -2.81 0.00 0.00 60.65 57.43 2yuy h LYS 66 Cb 1.14 0.04 -0.10 0.00 -1.00 0.00 0.00 32.23 32.31 2yuy h LYS 66 CO 0.71 0.28 -0.23 -0.65 -2.81 0.00 0.00 179.45 176.75 2yuy s GLN 67 N -3.12 1.53 -0.20 1.90 -0.21 -1.26 -4.75 119.66 113.55 2yuy s GLN 67 Ca -0.12 -1.40 -0.01 0.00 0.02 0.00 0.00 55.36 53.84 2yuy s GLN 67 Cb 0.00 0.42 0.06 0.00 1.00 0.00 0.00 33.01 34.49 2yuy s GLN 67 CO 0.45 -0.61 -0.00 0.08 -2.12 0.00 0.00 175.29 173.09 2yuy s VAL 68 N -3.91 0.91 -0.07 1.09 1.01 -1.26 -2.47 120.40 115.71 2yuy s VAL 68 Ca 0.27 -0.77 -0.40 0.00 0.00 0.00 0.00 61.98 61.08 2yuy s VAL 68 Cb 0.01 -1.30 -0.18 0.00 0.00 0.00 0.00 36.38 34.91 2yuy s VAL 68 CO 0.11 -0.13 1.32 1.17 0.00 0.00 0.00 175.10 177.57 2yuy n LYS 69 N 4.91 0.57 -2.57 2.72 4.81 -1.25 -4.79 118.16 122.55 2yuy n LYS 69 Ca -0.10 0.21 -0.41 0.00 -0.87 0.00 0.00 58.31 57.13 2yuy n LYS 69 Cb 0.46 -1.78 -0.03 0.00 0.02 0.00 0.00 35.03 33.70 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 1.02 3.57 0.00 1.64 2.56 -1.26 -3.21 118.70 123.02 2yuy s GLU 70 Ca 0.91 -1.10 0.00 0.00 0.00 0.00 0.00 54.97 54.78 2yuy s GLU 70 Cb -1.16 -5.28 0.00 0.00 2.00 0.00 0.00 34.13 29.69 2yuy s GLU 70 CO 0.58 -2.19 0.00 0.41 -0.56 0.00 0.00 175.26 173.50 2yuy n GLY 71 N 6.76 1.00 0.00 -1.50 0.00 -1.26 -5.14 105.19 105.04 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 0.00 6.63 0.15 -0.02 0.00 -1.20 -5.06 105.19 105.70 2yuy n GLY 72 Ca 0.00 -1.85 -0.07 0.00 0.00 0.00 0.00 46.02 44.10 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 -0.25 -0.04 1.61 0.13 -1.88 -3.22 132.00 128.35 2yuy h PRO 73 Ca 0.00 0.02 0.02 0.00 -0.87 0.00 0.00 66.00 65.17 2yuy h PRO 73 Cb 0.00 0.06 -0.05 0.00 0.13 0.00 0.00 31.00 31.13 2yuy h PRO 73 CO 0.00 0.01 -0.50 0.00 -0.23 0.00 0.00 178.00 177.28 2yuy h ALA 74 N -0.77 -0.90 -1.44 -0.56 0.00 -1.90 0.23 119.26 113.92 2yuy h ALA 74 Ca -0.03 -0.07 0.47 0.00 0.00 0.00 0.00 54.91 55.28 2yuy h ALA 74 Cb 0.38 0.94 -0.12 0.00 0.00 0.00 0.00 17.79 18.99 2yuy h ALA 74 CO 0.04 -1.06 0.96 0.34 0.00 0.00 0.00 179.25 179.53 2yuy n PHE 75 N -5.22 0.51 0.00 0.00 7.35 -1.26 -0.20 117.46 118.64 2yuy n PHE 75 Ca -0.06 0.51 -0.02 0.00 -0.76 0.00 0.00 57.45 57.12 2yuy n PHE 75 Cb 0.36 -0.95 -0.01 0.00 0.35 0.00 0.00 39.48 39.23 2yuy n PHE 75 CO 0.00 0.00 0.00 0.93 -0.76 0.00 0.00 176.76 176.93 2yuy h GLU 76 N 0.00 -0.11 -1.69 -4.13 4.39 -0.67 -3.28 114.58 109.10 2yuy h GLU 76 Ca 0.85 0.01 0.53 0.00 0.34 0.00 0.00 59.36 61.08 2yuy h GLU 76 Cb 2.90 0.03 -0.11 0.00 -0.10 0.00 0.00 28.75 31.47 2yuy h GLU 76 CO -0.34 -0.07 1.16 0.00 -1.16 0.00 0.00 179.01 178.60 2yuy h ALA 77 N -1.07 3.37 0.00 3.43 0.00 0.18 -3.42 119.26 121.74 2yuy h ALA 77 Ca -0.01 0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2yuy h ALA 77 Cb 0.09 0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.08 2yuy h ALA 77 CO 0.02 -2.00 0.00 0.41 0.00 0.00 0.00 179.25 177.68 2yuy n GLY 78 N -1.73 1.18 3.65 0.00 0.00 0.04 -4.84 105.19 103.48 2yuy n GLY 78 Ca 0.42 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 46.05 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 3.60 0.00 0.99 7.94 -0.82 -4.97 117.00 123.74 2yuy n LEU 79 Ca 0.00 0.98 0.00 0.00 -1.11 0.00 0.00 56.01 55.88 2yuy n LEU 79 Cb 0.00 -1.42 0.00 0.00 0.53 0.00 0.00 43.42 42.53 2yuy n LEU 79 CO 0.00 -1.29 0.00 0.00 -1.11 0.00 0.00 177.39 174.99 2yuy s THR 81 N -1.24 4.85 0.00 0.00 -4.23 -1.26 -4.30 115.64 109.46 2yuy s THR 81 Ca 0.00 -0.02 0.00 0.00 -1.18 0.00 0.00 61.69 60.49 2yuy s THR 81 Cb 0.00 -3.15 0.00 0.00 1.34 0.00 0.00 72.50 70.69 2yuy s THR 81 CO 0.00 0.51 0.00 0.61 -0.54 0.00 0.00 174.62 175.20 2yuy n GLY 82 N 3.05 2.55 3.68 3.99 0.00 -1.08 -5.04 105.19 112.34 2yuy n GLY 82 Ca -0.17 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.54 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 -0.84 3.13 0.00 1.61 1.01 -1.26 -4.57 116.67 115.75 2yuy s ASP 83 Ca 0.00 2.04 0.03 0.00 0.71 0.00 0.00 52.55 55.33 2yuy s ASP 83 Cb 0.00 -2.52 -0.01 0.00 1.01 0.00 0.00 42.92 41.40 2yuy s ASP 83 CO 0.00 -2.95 -0.09 0.00 0.21 0.00 0.00 175.17 172.34 2yuy s ARG 84 N -4.70 0.69 -0.23 8.23 1.70 -1.26 0.44 118.95 123.82 2yuy s ARG 84 Ca 0.66 -0.40 -0.27 0.00 -0.47 0.00 0.00 55.73 55.24 2yuy s ARG 84 Cb -0.22 -0.65 0.00 0.00 -0.57 0.00 0.00 34.95 33.52 2yuy s ARG 84 CO 0.58 0.17 0.96 0.42 -1.08 0.00 0.00 175.30 176.36 2yuy s ILE 85 N -0.39 4.74 -0.16 4.99 1.09 -0.48 -3.98 121.20 127.00 2yuy s ILE 85 Ca 0.02 1.87 0.17 0.00 -1.10 0.00 0.00 60.65 61.60 2yuy s ILE 85 Cb -0.04 -4.24 -0.24 0.00 -1.06 0.00 0.00 42.46 36.88 2yuy s ILE 85 CO -0.00 -0.14 0.12 2.30 -0.10 0.00 0.00 174.94 177.12 2yuy n ILE 86 N 5.27 1.07 -4.16 2.92 -5.35 0.24 -4.54 119.36 114.80 2yuy n ILE 86 Ca 0.10 -0.72 -0.11 0.00 -0.27 0.00 0.00 62.75 61.74 2yuy n ILE 86 Cb 0.47 -0.43 -0.10 0.00 -1.74 0.00 0.00 39.64 37.83 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 -2.57 0.81 -0.24 6.28 1.02 -1.21 -4.24 119.74 119.60 2yuy s LYS 87 Ca -0.09 -1.26 -0.03 0.00 0.02 0.00 0.00 55.97 54.61 2yuy s LYS 87 Cb 0.06 -0.26 0.10 0.00 -0.52 0.00 0.00 37.83 37.21 2yuy s LYS 87 CO 0.75 0.00 0.20 0.08 -0.92 0.00 0.00 175.35 175.47 2yuy s VAL 88 N -3.27 -0.26 -1.52 3.17 1.01 -1.26 -2.72 120.40 115.54 2yuy s VAL 88 Ca 0.09 -0.35 -0.01 0.00 0.00 0.00 0.00 61.98 61.71 2yuy s VAL 88 Cb 0.03 -0.80 0.01 0.00 0.00 0.00 0.00 36.38 35.61 2yuy s VAL 88 CO -0.04 -0.39 0.14 0.59 0.00 0.00 0.00 175.10 175.40 2yuy n ASN 89 N 5.30 -5.30 -2.30 3.32 3.02 -0.57 -0.46 115.26 118.28 2yuy n ASN 89 Ca -0.05 -0.03 -0.16 0.00 -0.03 0.00 0.00 54.58 54.31 2yuy n ASN 89 Cb 0.47 -4.40 -0.02 0.00 -0.61 0.00 0.00 39.78 35.22 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 -1.06 -0.23 0.24 7.41 0.00 -1.26 -4.81 105.19 105.48 2yuy n GLY 90 Ca -0.18 0.00 0.13 0.00 0.00 0.00 0.00 46.02 45.97 2yuy n GLY 90 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 2yuy n GLU 91 N -2.79 0.88 -2.60 1.61 0.00 0.40 -5.01 120.64 113.12 2yuy n GLU 91 Ca -0.19 -0.49 -0.05 0.00 0.00 0.00 0.00 57.16 56.43 2yuy n GLU 91 Cb 0.63 -1.49 -0.04 0.00 0.00 0.00 0.00 31.44 30.54 2yuy n GLU 91 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.13 177.56 2yuy n SER 92 N -0.64 -1.72 -2.90 4.31 7.64 -1.26 -4.85 113.62 114.21 2yuy n SER 92 Ca 0.13 1.39 -0.39 0.00 1.01 0.00 0.00 58.87 61.01 2yuy n SER 92 Cb 0.34 -5.05 0.03 0.00 -1.01 0.00 0.00 64.21 58.52 2yuy n SER 92 CO 0.00 0.00 0.00 1.33 -3.01 0.00 0.00 175.04 173.36 2yuy n VAL 93 N 1.80 3.62 -0.05 0.44 0.24 -1.26 -4.60 118.33 118.52 2yuy n VAL 93 Ca -0.36 -4.22 -0.01 0.00 -2.04 0.00 0.00 64.34 57.72 2yuy n VAL 93 Cb 0.55 -1.28 -0.00 0.00 -1.47 0.00 0.00 33.84 31.65 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 2.00 0.00 -0.90 1.34 1.08 -1.86 -3.37 117.51 115.81 2yuy h ILE 94 Ca 0.56 -0.89 -0.59 0.00 -0.39 0.00 0.00 64.86 63.55 2yuy h ILE 94 Cb 0.08 0.00 -0.25 0.00 -3.07 0.00 0.00 36.82 33.59 2yuy h ILE 94 CO 1.39 0.00 0.76 0.61 -0.69 0.00 0.00 178.15 180.21 2yuy n GLY 95 N 1.78 5.37 3.42 5.37 0.00 -1.26 -4.46 105.19 115.41 2yuy n GLY 95 Ca -0.01 -1.99 -0.22 0.00 0.00 0.00 0.00 46.02 43.81 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 -3.27 1.54 0.47 1.61 1.02 -1.26 -5.01 119.74 114.84 2yuy s LYS 96 Ca 0.55 -1.73 0.06 0.00 0.02 0.00 0.00 55.97 54.88 2yuy s LYS 96 Cb 0.43 -1.39 -0.00 0.00 -0.52 0.00 0.00 37.83 36.35 2yuy s LYS 96 CO -0.03 0.19 0.32 -0.08 -0.92 0.00 0.00 175.35 174.84 2yuy s THR 97 N -2.80 2.09 0.14 2.17 -1.32 -1.26 -4.22 115.64 110.44 2yuy s THR 97 Ca 0.27 -1.53 -0.26 0.00 -1.21 0.00 0.00 61.69 58.97 2yuy s THR 97 Cb -0.01 -2.61 -0.00 0.00 -1.51 0.00 0.00 72.50 68.36 2yuy s THR 97 CO 0.11 0.00 1.60 0.22 -2.21 0.00 0.00 174.62 174.34 2yuy h TYR 98 N 1.03 -0.98 -0.62 9.09 3.20 -1.99 -0.74 116.97 125.97 2yuy h TYR 98 Ca -0.40 0.05 0.13 0.00 3.14 0.00 0.00 58.73 61.65 2yuy h TYR 98 Cb 1.28 0.46 -0.11 0.00 1.54 0.00 0.00 36.73 39.91 2yuy h TYR 98 CO 0.77 -0.41 -0.01 0.66 -1.64 0.00 0.00 178.16 177.53 2yuy h SER 99 N -0.37 -0.30 0.02 -2.11 4.64 -1.97 1.09 113.55 114.55 2yuy h SER 99 Ca 0.12 0.16 -0.00 0.00 -0.47 0.00 0.00 61.79 61.59 2yuy h SER 99 Cb 0.56 0.28 -0.00 0.00 -0.31 0.00 0.00 62.40 62.93 2yuy h SER 99 CO -0.43 -0.12 -0.03 1.56 -0.87 0.00 0.00 176.83 176.94 2yuy h GLN 100 N 0.10 -0.05 -0.97 4.77 4.20 -1.56 0.58 115.11 122.18 2yuy h GLN 100 Ca 0.32 0.00 0.21 0.00 0.06 0.00 0.00 58.65 59.24 2yuy h GLN 100 Cb 0.52 0.01 -0.09 0.00 0.30 0.00 0.00 27.48 28.22 2yuy h GLN 100 CO -0.54 -0.03 0.62 -0.39 -0.67 0.00 0.00 178.83 177.81 2yuy h VAL 101 N -0.05 0.67 0.70 -0.54 -1.51 -0.83 0.17 116.25 114.85 2yuy h VAL 101 Ca -0.00 -0.20 -0.03 0.00 -1.23 0.00 0.00 66.70 65.24 2yuy h VAL 101 Cb 0.05 0.04 -0.01 0.00 -2.13 0.00 0.00 31.29 29.24 2yuy h VAL 101 CO -0.01 0.11 -0.49 0.40 -1.23 0.00 0.00 177.57 176.35 2yuy h ILE 102 N 0.58 0.00 -0.83 7.19 1.08 0.20 0.25 117.51 125.98 2yuy h ILE 102 Ca 0.54 0.00 0.13 0.00 -0.39 0.00 0.00 64.86 65.14 2yuy h ILE 102 Cb 1.09 0.00 -0.06 0.00 -3.07 0.00 0.00 36.82 34.78 2yuy h ILE 102 CO -0.29 0.00 0.54 0.00 -0.69 0.00 0.00 178.15 177.71 2yuy h ALA 103 N -1.12 1.88 -0.79 1.87 0.00 0.15 0.36 119.26 121.61 2yuy h ALA 103 Ca -0.09 0.00 0.03 0.00 0.00 0.00 0.00 54.91 54.85 2yuy h ALA 103 Cb 0.93 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.55 2yuy h ALA 103 CO 0.06 -0.09 0.52 -0.07 0.00 0.00 0.00 179.25 179.67 2yuy h LEU 104 N 0.63 0.86 -0.06 0.00 3.38 0.09 1.60 115.31 121.81 2yuy h LEU 104 Ca 0.40 -0.01 -0.18 0.00 0.09 0.00 0.00 57.88 58.18 2yuy h LEU 104 Cb 0.66 -0.20 0.01 0.00 0.09 0.00 0.00 40.66 41.22 2yuy h LEU 104 CO -0.16 0.60 -0.68 0.40 0.09 0.00 0.00 178.44 178.69 2yuy h ILE 105 N 1.00 1.35 0.00 1.22 2.04 0.16 1.09 117.51 124.38 2yuy h ILE 105 Ca 0.31 -2.00 -0.06 0.00 1.00 0.00 0.00 64.86 64.11 2yuy h ILE 105 Cb -0.01 2.30 -0.01 0.00 -0.74 0.00 0.00 36.82 38.37 2yuy h ILE 105 CO -0.08 0.60 -0.29 1.56 0.00 0.00 0.00 178.15 179.94 2yuy h GLN 106 N 0.18 0.00 -0.11 2.37 4.20 -0.06 -2.68 115.11 119.02 2yuy h GLN 106 Ca -0.07 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.62 2yuy h GLN 106 Cb 1.34 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 29.10 2yuy h GLN 106 CO 0.14 0.29 -0.12 0.09 -0.67 0.00 0.00 178.83 178.56 2yuy n ASN 107 N -3.59 2.55 0.00 1.46 3.02 0.54 -4.59 115.26 114.65 2yuy n ASN 107 Ca -0.01 -3.35 0.14 0.00 -0.03 0.00 0.00 54.58 51.33 2yuy n ASN 107 Cb 0.42 -0.51 0.82 0.00 -0.61 0.00 0.00 39.78 39.91 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 -1.13 0.00 0.00 6.41 7.64 0.38 -4.89 113.62 122.02 2yuy n SER 108 Ca 0.20 -0.88 0.00 0.00 1.01 0.00 0.00 58.87 59.21 2yuy n SER 108 Cb 0.76 0.00 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 -1.00 0.00 -0.31 6.43 2.03 -1.26 -4.25 116.55 118.19 2yuy n ASP 109 Ca 0.21 0.00 0.07 0.00 0.52 0.00 0.00 54.79 55.59 2yuy n ASP 109 Cb 0.09 0.00 0.16 0.00 -0.72 0.00 0.00 41.12 40.65 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 -1.00 -0.36 -2.99 5.18 -1.04 -1.26 -4.40 114.28 108.42 2yuy n THR 110 Ca 0.00 1.95 -0.18 0.00 -2.04 0.00 0.00 64.05 63.77 2yuy n THR 110 Cb 0.00 -2.73 0.03 0.00 -1.82 0.00 0.00 70.33 65.80 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 -6.01 2.73 -0.29 12.58 -4.23 -1.26 0.18 115.64 119.34 2yuy s THR 111 Ca -0.12 -0.97 -0.00 0.00 -1.18 0.00 0.00 61.69 59.41 2yuy s THR 111 Cb 0.24 -2.76 0.18 0.00 1.34 0.00 0.00 72.50 71.50 2yuy s THR 111 CO 0.67 0.00 0.56 -0.22 -0.54 0.00 0.00 174.62 175.09 2yuy s LEU 112 N -4.48 -1.31 0.06 4.79 1.98 0.16 -4.59 118.68 115.29 2yuy s LEU 112 Ca 0.57 0.66 -0.19 0.00 -2.89 0.00 0.00 54.13 52.28 2yuy s LEU 112 Cb -0.09 1.98 -0.06 0.00 0.66 0.00 0.00 46.19 48.68 2yuy s LEU 112 CO 0.35 -0.27 0.57 -0.70 -1.89 0.00 0.00 176.35 174.40 2yuy s GLU 113 N 2.80 4.21 0.42 1.98 2.12 -1.26 -0.61 118.70 128.35 2yuy s GLU 113 Ca 0.18 0.72 0.04 0.00 0.36 0.00 0.00 54.97 56.27 2yuy s GLU 113 Cb -0.14 -3.25 -0.02 0.00 0.26 0.00 0.00 34.13 30.97 2yuy s GLU 113 CO -0.21 0.61 0.12 -0.51 -0.54 0.00 0.00 175.26 174.72 2yuy s LEU 114 N -0.99 2.03 -0.20 2.70 1.43 0.17 -1.51 118.68 122.31 2yuy s LEU 114 Ca 0.29 -1.66 -0.09 0.00 -1.03 0.00 0.00 54.13 51.64 2yuy s LEU 114 Cb -0.19 -0.18 0.08 0.00 0.03 0.00 0.00 46.19 45.93 2yuy s LEU 114 CO 0.19 -0.91 0.45 -0.44 0.23 0.00 0.00 176.35 175.86 2yuy s SER 115 N -3.63 -0.48 0.49 2.29 0.01 -1.10 -2.29 113.70 109.00 2yuy s SER 115 Ca 0.22 1.03 0.01 0.00 1.31 0.00 0.00 55.95 58.53 2yuy s SER 115 Cb 0.03 1.15 -0.01 0.00 0.21 0.00 0.00 66.02 67.40 2yuy s SER 115 CO 0.13 -0.22 0.04 0.68 0.41 0.00 0.00 173.24 174.29 2yuy s VAL 116 N 2.02 0.95 -0.36 3.43 -7.23 -1.20 0.83 120.40 118.83 2yuy s VAL 116 Ca -0.06 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.11 2yuy s VAL 116 Cb -0.10 -2.14 0.12 0.00 0.56 0.00 0.00 36.38 34.82 2yuy s VAL 116 CO -0.14 0.00 0.17 -0.04 -0.31 0.00 0.00 175.10 174.78 2yuy s MET 117 N -3.84 0.87 1.01 4.82 -1.94 -1.26 -2.67 119.30 116.30 2yuy s MET 117 Ca 0.08 -1.42 -0.17 0.00 -1.71 0.00 0.00 55.69 52.47 2yuy s MET 117 Cb 0.01 -1.97 0.24 0.00 2.01 0.00 0.00 34.83 35.12 2yuy s MET 117 CO 0.05 -1.09 1.11 -0.35 -0.01 0.00 0.00 175.02 174.73 2yuy n PRO 118 N 4.27 -2.08 0.00 2.03 -0.04 -1.26 -4.88 135.00 133.04 2yuy n PRO 118 Ca 0.04 -1.74 0.00 0.00 -0.04 0.00 0.00 63.50 61.76 2yuy n PRO 118 Cb 0.38 -1.38 0.00 0.00 -0.04 0.00 0.00 33.50 32.47 2yuy n PRO 118 CO 0.00 0.00 0.00 1.17 -0.04 0.00 0.00 175.50 176.63 2yuy n LYS 119 N -4.07 0.00 -3.75 0.54 4.81 -1.26 -5.08 118.16 109.35 2yuy n LYS 119 Ca 0.15 0.00 -0.30 0.00 -0.87 0.00 0.00 58.31 57.29 2yuy n LYS 119 Cb 0.53 0.00 -0.15 0.00 0.02 0.00 0.00 35.03 35.43 2yuy n LYS 119 CO 0.00 0.00 0.00 0.34 1.17 0.00 0.00 177.40 178.91 2yuy s ASP 120 N -0.63 4.06 0.04 3.14 2.15 -1.26 -5.11 116.67 119.06 2yuy s ASP 120 Ca 0.00 -1.69 -0.01 0.00 0.43 0.00 0.00 52.55 51.28 2yuy s ASP 120 Cb 0.00 -0.91 -0.03 0.00 -0.30 0.00 0.00 42.92 41.68 2yuy s ASP 120 CO 0.00 -0.41 -0.01 -0.44 -0.17 0.00 0.00 175.17 174.14 2yuy s SER 121 N 1.55 0.35 -0.12 -0.34 0.01 -1.26 -5.15 113.70 108.75 2yuy s SER 121 Ca 0.10 -0.75 -0.04 0.00 1.31 0.00 0.00 55.95 56.57 2yuy s SER 121 Cb -0.17 0.17 0.05 0.00 0.21 0.00 0.00 66.02 66.28 2yuy s SER 121 CO -0.24 -0.48 0.11 -0.83 0.41 0.00 0.00 173.24 172.22 2yuy s GLY 122 N -2.28 0.21 0.53 3.44 0.00 -1.26 -5.14 107.32 102.82 2yuy s GLY 122 Ca -0.03 0.08 -0.18 0.00 0.00 0.00 0.00 44.72 44.59 2yuy s GLY 122 CO -0.06 1.68 1.04 2.56 0.00 0.00 0.00 173.10 178.32 2yuy s PRO 123 N 2.20 3.60 0.03 2.90 0.04 -1.26 -4.82 135.00 137.70 2yuy s PRO 123 Ca 0.04 1.27 0.00 0.00 0.04 0.00 0.00 61.00 62.34 2yuy s PRO 123 Cb -0.14 -2.07 0.00 0.00 0.04 0.00 0.00 34.50 32.33 2yuy s PRO 123 CO -0.07 -0.58 0.00 0.45 0.04 0.00 0.00 177.00 176.84 2yuy n SER 124 N -1.47 -0.30 -2.50 6.66 2.88 -1.26 -5.12 113.62 112.52 2yuy n SER 124 Ca 0.09 0.38 -0.03 0.00 -1.33 0.00 0.00 58.87 57.98 2yuy n SER 124 Cb 0.53 0.60 -0.02 0.00 -0.75 0.00 0.00 64.21 64.56 2yuy n SER 124 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2yuy n SER 125 N -2.74 -4.68 0.00 -3.46 7.64 -1.26 -5.36 113.62 103.76 2yuy n SER 125 Ca 0.00 1.52 0.00 0.00 1.01 0.00 0.00 58.87 61.40 2yuy n SER 125 Cb 0.00 -4.70 0.00 0.00 -1.01 0.00 0.00 64.21 58.50 2yuy n SER 125 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64