#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2yu7 s SER 2 N 0.00 6.68 0.12 1.61 0.01 -1.26 -5.04 113.70 115.82 2yu7 s SER 2 Ca 0.00 2.33 -0.18 0.00 1.31 0.00 0.00 55.95 59.41 2yu7 s SER 2 Cb 0.00 -2.62 0.04 0.00 0.21 0.00 0.00 66.02 63.66 2yu7 s SER 2 CO 0.00 -0.56 0.45 -0.94 0.41 0.00 0.00 173.24 172.59 2yu7 s SER 3 N -1.09 -0.32 0.00 2.44 1.04 -1.26 -5.11 113.70 109.41 2yu7 s SER 3 Ca 0.55 -0.19 0.00 0.00 0.48 0.00 0.00 55.95 56.79 2yu7 s SER 3 Cb -0.31 0.49 0.00 0.00 0.10 0.00 0.00 66.02 66.31 2yu7 s SER 3 CO 0.39 -0.85 0.00 0.61 0.98 0.00 0.00 173.24 174.37 2yu7 n GLY 4 N -0.14 -0.56 2.54 7.32 0.00 -1.26 -5.05 105.19 108.05 2yu7 n GLY 4 Ca -0.17 0.13 -0.13 0.00 0.00 0.00 0.00 46.02 45.86 2yu7 n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2yu7 n SER 5 N -1.53 -4.22 -4.18 1.61 2.88 -1.26 -5.03 113.62 101.90 2yu7 n SER 5 Ca 0.00 -0.23 -0.25 0.00 -1.33 0.00 0.00 58.87 57.06 2yu7 n SER 5 Cb 0.00 -2.94 -0.15 0.00 -0.75 0.00 0.00 64.21 60.37 2yu7 n SER 5 CO 0.00 0.00 0.00 -0.55 -1.23 0.00 0.00 175.04 173.26 2yu7 s SER 6 N -3.01 2.12 0.00 -3.46 0.15 -1.26 -5.14 113.70 103.10 2yu7 s SER 6 Ca 0.24 -0.33 0.00 0.00 0.70 0.00 0.00 55.95 56.57 2yu7 s SER 6 Cb -0.11 -0.24 0.00 0.00 -1.71 0.00 0.00 66.02 63.97 2yu7 s SER 6 CO 0.30 0.22 0.00 0.61 1.20 0.00 0.00 173.24 175.58 2yu7 n GLY 7 N 2.63 -1.86 0.00 9.45 0.00 -1.26 -4.83 105.19 109.32 2yu7 n GLY 7 Ca -0.15 -0.45 0.09 0.00 0.00 0.00 0.00 46.02 45.51 2yu7 n GLY 7 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 173.32 170.65 2yu7 n TRP 8 N 0.00 0.00 -2.19 1.61 4.27 -1.26 -4.09 117.44 115.78 2yu7 n TRP 8 Ca 0.00 0.00 -0.40 0.00 -3.89 0.00 0.00 57.50 53.21 2yu7 n TRP 8 Cb 0.00 -0.01 -0.02 0.00 -1.36 0.00 0.00 31.31 29.92 2yu7 n TRP 8 CO 0.00 0.00 0.00 -0.47 -2.29 0.00 0.00 177.69 174.93 2yu7 s TYR 9 N -2.74 3.06 0.00 -2.67 5.04 -1.26 -3.06 117.35 115.73 2yu7 s TYR 9 Ca 0.06 1.49 0.00 0.00 -2.44 0.00 0.00 57.07 56.18 2yu7 s TYR 9 Cb 0.14 -3.55 0.00 0.00 0.35 0.00 0.00 41.96 38.89 2yu7 s TYR 9 CO 0.75 -1.61 0.00 0.72 -1.34 0.00 0.00 175.55 174.07 2yu7 n HIS 10 N 0.50 0.00 0.00 4.97 8.25 -0.54 -4.94 115.22 123.46 2yu7 n HIS 10 Ca 0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.48 2yu7 n HIS 10 Cb 0.44 0.02 0.00 0.00 1.12 0.00 0.00 29.99 31.56 2yu7 n HIS 10 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2yu7 n GLY 11 N 3.50 0.18 3.28 -1.41 0.00 -1.24 -4.98 105.19 104.51 2yu7 n GLY 11 Ca 0.00 -1.15 -0.38 0.00 0.00 0.00 0.00 46.02 44.49 2yu7 n GLY 11 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2yu7 n HIS 12 N 6.05 2.72 -3.35 1.61 8.25 -1.26 0.17 115.22 129.41 2yu7 n HIS 12 Ca 0.00 -1.97 -0.43 0.00 -0.26 0.00 0.00 57.72 55.07 2yu7 n HIS 12 Cb 0.00 -2.23 -0.09 0.00 1.12 0.00 0.00 29.99 28.79 2yu7 n HIS 12 CO 0.00 0.00 0.00 1.41 0.64 0.00 0.00 176.34 178.39 2yu7 s MET 13 N 5.17 3.19 0.50 -0.41 0.00 -1.25 -4.87 119.30 121.63 2yu7 s MET 13 Ca 0.59 -0.70 -0.21 0.00 0.00 0.00 0.00 55.69 55.37 2yu7 s MET 13 Cb 0.08 -3.93 -0.06 0.00 0.00 0.00 0.00 34.83 30.91 2yu7 s MET 13 CO 0.09 -0.78 1.18 -1.12 0.00 0.00 0.00 175.02 174.40 2yu7 s SER 14 N 1.78 5.85 0.39 1.11 0.01 -1.26 -4.63 113.70 116.96 2yu7 s SER 14 Ca 0.12 2.34 0.21 0.00 1.31 0.00 0.00 55.95 59.92 2yu7 s SER 14 Cb -0.17 -2.60 1.21 0.00 0.21 0.00 0.00 66.02 64.67 2yu7 s SER 14 CO 0.13 -1.14 1.68 1.23 0.41 0.00 0.00 173.24 175.55 2yu7 h GLY 15 N 1.65 1.57 1.71 3.44 0.00 -1.97 0.73 103.07 110.20 2yu7 h GLY 15 Ca -0.50 -0.19 -0.06 0.00 0.00 0.00 0.00 47.33 46.58 2yu7 h GLY 15 CO 0.58 -0.37 -0.15 -1.33 0.00 0.00 0.00 176.54 175.28 2yu7 h GLY 16 N 0.26 0.38 1.14 4.60 0.00 -2.00 -2.10 103.07 105.35 2yu7 h GLY 16 Ca 0.73 -0.25 -0.33 0.00 0.00 0.00 0.00 47.33 47.47 2yu7 h GLY 16 CO -0.46 0.23 -1.50 -1.61 0.00 0.00 0.00 176.54 173.21 2yu7 h GLN 17 N 0.33 0.50 0.35 4.80 4.15 0.04 -3.20 115.11 122.08 2yu7 h GLN 17 Ca 0.06 -0.85 -0.02 0.00 0.77 0.00 0.00 58.65 58.61 2yu7 h GLN 17 Cb 0.46 0.32 0.00 0.00 0.21 0.00 0.00 27.48 28.47 2yu7 h GLN 17 CO 0.03 1.41 -0.17 0.00 -1.93 0.00 0.00 178.83 178.17 2yu7 h ALA 18 N 0.13 -1.11 -1.11 3.38 0.00 -0.94 0.25 119.26 119.87 2yu7 h ALA 18 Ca -0.27 -0.10 0.32 0.00 0.00 0.00 0.00 54.91 54.86 2yu7 h ALA 18 Cb 2.12 0.18 -0.12 0.00 0.00 0.00 0.00 17.79 19.98 2yu7 h ALA 18 CO 0.25 -1.07 0.70 0.93 0.00 0.00 0.00 179.25 180.05 2yu7 h GLU 19 N -0.47 0.30 -0.04 0.00 5.08 -1.57 0.12 114.58 118.00 2yu7 h GLU 19 Ca -0.05 -0.02 -0.02 0.00 -1.00 0.00 0.00 59.36 58.28 2yu7 h GLU 19 Cb 0.36 -0.07 -0.00 0.00 0.50 0.00 0.00 28.75 29.54 2yu7 h GLU 19 CO 0.08 0.20 -0.05 1.15 -1.00 0.00 0.00 179.01 179.38 2yu7 h THR 20 N 0.31 1.41 0.00 1.13 2.02 -1.50 -2.75 112.91 113.52 2yu7 h THR 20 Ca 0.69 -1.29 0.00 0.00 0.77 0.00 0.00 66.41 66.57 2yu7 h THR 20 Cb 1.81 2.19 0.00 0.00 -1.74 0.00 0.00 68.15 70.42 2yu7 h THR 20 CO -0.40 0.35 0.00 0.18 0.37 0.00 0.00 175.52 176.02 2yu7 n LEU 21 N -4.75 0.00 -0.33 2.58 4.77 0.85 0.41 117.00 120.54 2yu7 n LEU 21 Ca -0.08 0.95 0.25 0.00 -0.03 0.00 0.00 56.01 57.10 2yu7 n LEU 21 Cb 0.30 -0.45 0.47 0.00 -2.33 0.00 0.00 43.42 41.41 2yu7 n LEU 21 CO 0.35 -0.45 0.96 -0.07 -1.33 0.00 0.00 177.39 176.85 2yu7 h LEU 22 N 0.00 -0.00 -0.44 2.23 3.38 -1.30 1.35 115.31 120.54 2yu7 h LEU 22 Ca 0.00 0.27 -0.17 0.00 0.09 0.00 0.00 57.88 58.07 2yu7 h LEU 22 Cb 0.00 0.36 -0.00 0.00 0.09 0.00 0.00 40.66 41.10 2yu7 h LEU 22 CO 0.00 -0.40 -0.51 1.56 0.09 0.00 0.00 178.44 179.17 2yu7 h GLN 23 N 0.01 0.72 -0.43 1.13 4.20 -1.35 -3.00 115.11 116.40 2yu7 h GLN 23 Ca 0.75 -0.44 0.07 0.00 0.06 0.00 0.00 58.65 59.09 2yu7 h GLN 23 Cb 1.84 0.04 -0.06 0.00 0.30 0.00 0.00 27.48 29.61 2yu7 h GLN 23 CO -0.83 1.06 0.09 0.00 -0.67 0.00 0.00 178.83 178.47 2yu7 h ALA 24 N 0.86 0.47 -0.30 3.87 0.00 0.68 -2.36 119.26 122.47 2yu7 h ALA 24 Ca 0.02 0.09 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 2yu7 h ALA 24 Cb 1.08 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.97 2yu7 h ALA 24 CO 0.11 -0.31 0.17 -0.22 0.00 0.00 0.00 179.25 178.99 2yu7 h LYS 25 N 0.22 0.42 -1.10 0.00 3.64 -1.36 -3.48 116.57 114.91 2yu7 h LYS 25 Ca 0.21 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.54 2yu7 h LYS 25 Cb 0.26 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 31.99 2yu7 h LYS 25 CO -0.27 0.35 0.00 0.41 -2.27 0.00 0.00 179.45 177.67 2yu7 n GLY 26 N -0.97 0.89 3.10 5.01 0.00 -0.89 -5.06 105.19 107.27 2yu7 n GLY 26 Ca -0.02 -0.63 -0.32 0.00 0.00 0.00 0.00 46.02 45.05 2yu7 n GLY 26 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2yu7 s GLU 27 N -4.69 2.83 0.43 1.61 0.41 -1.26 -5.12 118.70 112.92 2yu7 s GLU 27 Ca 0.00 -0.77 -0.24 0.00 -0.41 0.00 0.00 54.97 53.55 2yu7 s GLU 27 Cb 0.00 -2.45 -0.08 0.00 -1.78 0.00 0.00 34.13 29.83 2yu7 s GLU 27 CO 0.00 -0.19 1.17 -1.25 -0.49 0.00 0.00 175.26 174.50 2yu7 s PRO 28 N 1.28 3.88 -0.89 0.39 0.04 -1.26 -3.47 135.00 134.97 2yu7 s PRO 28 Ca 0.04 1.82 -0.04 0.00 0.04 0.00 0.00 61.00 62.86 2yu7 s PRO 28 Cb -0.13 -2.53 0.00 0.00 0.04 0.00 0.00 34.50 31.88 2yu7 s PRO 28 CO -0.11 -0.46 0.54 0.91 0.04 0.00 0.00 177.00 177.91 2yu7 n TRP 29 N -0.24 -1.47 -3.58 0.56 5.03 0.17 -4.78 117.44 113.14 2yu7 n TRP 29 Ca 0.06 0.46 -0.40 0.00 3.03 0.00 0.00 57.50 60.65 2yu7 n TRP 29 Cb 0.47 -3.29 -0.11 0.00 -1.03 0.00 0.00 31.31 27.35 2yu7 n TRP 29 CO 0.00 0.00 0.00 0.99 -0.03 0.00 0.00 177.69 178.65 2yu7 s THR 30 N -3.05 4.82 0.12 -0.99 2.01 -1.16 -1.79 115.64 115.58 2yu7 s THR 30 Ca 0.27 -0.57 0.04 0.00 0.31 0.00 0.00 61.69 61.74 2yu7 s THR 30 Cb -0.12 -3.57 -0.04 0.00 0.01 0.00 0.00 72.50 68.78 2yu7 s THR 30 CO 0.33 -0.10 0.09 0.72 -0.69 0.00 0.00 174.62 174.97 2yu7 s PHE 31 N 1.62 3.15 -0.14 4.92 -0.71 -0.74 -0.44 117.98 125.64 2yu7 s PHE 31 Ca 0.04 0.03 -0.14 0.00 -1.04 0.00 0.00 56.93 55.82 2yu7 s PHE 31 Cb -0.18 -1.56 0.04 0.00 -1.21 0.00 0.00 43.02 40.10 2yu7 s PHE 31 CO 0.08 0.52 0.38 -0.48 -1.34 0.00 0.00 175.22 174.38 2yu7 s LEU 32 N -2.67 0.54 -0.14 -1.99 0.05 0.67 -0.83 118.68 114.32 2yu7 s LEU 32 Ca 0.30 0.73 -0.16 0.00 0.05 0.00 0.00 54.13 55.04 2yu7 s LEU 32 Cb -0.11 1.33 -0.04 0.00 -2.05 0.00 0.00 46.19 45.31 2yu7 s LEU 32 CO 0.22 -0.16 0.39 -0.69 -0.55 0.00 0.00 176.35 175.56 2yu7 s VAL 33 N 0.09 5.24 0.31 1.48 1.01 -1.17 -2.13 120.40 125.22 2yu7 s VAL 33 Ca -0.01 0.76 0.03 0.00 0.00 0.00 0.00 61.98 62.77 2yu7 s VAL 33 Cb -0.03 -3.73 -0.01 0.00 0.00 0.00 0.00 36.38 32.61 2yu7 s VAL 33 CO 0.01 0.35 0.12 -2.11 0.00 0.00 0.00 175.10 173.48 2yu7 n ARG 34 N 3.64 0.62 -4.02 2.72 1.85 -0.82 -1.47 116.66 119.17 2yu7 n ARG 34 Ca -0.09 -2.63 -0.31 0.00 -1.00 0.00 0.00 57.85 53.82 2yu7 n ARG 34 Cb 0.52 1.51 -0.16 0.00 -1.05 0.00 0.00 32.46 33.28 2yu7 n ARG 34 CO 0.00 0.00 0.00 -1.21 -0.01 0.00 0.00 177.63 176.41 2yu7 s GLU 35 N -3.17 2.17 0.33 2.89 0.41 0.45 -2.51 118.70 119.27 2yu7 s GLU 35 Ca 0.18 -0.98 -0.17 0.00 -0.41 0.00 0.00 54.97 53.59 2yu7 s GLU 35 Cb 0.01 -2.57 -0.12 0.00 -1.78 0.00 0.00 34.13 29.67 2yu7 s GLU 35 CO 0.12 -0.45 0.05 0.45 -0.49 0.00 0.00 175.26 174.95 2yu7 n SER 36 N 4.61 -2.34 -0.08 -0.19 2.88 0.09 -3.96 113.62 114.63 2yu7 n SER 36 Ca -0.15 0.63 -0.22 0.00 -1.33 0.00 0.00 58.87 57.80 2yu7 n SER 36 Cb 0.46 -0.70 -0.12 0.00 -0.75 0.00 0.00 64.21 63.10 2yu7 n SER 36 CO 0.00 0.00 0.00 0.18 -1.23 0.00 0.00 175.04 173.99 2yu7 n LEU 37 N 1.86 2.52 0.03 2.46 7.99 -1.26 -4.69 117.00 125.92 2yu7 n LEU 37 Ca 0.09 0.15 -0.02 0.00 -0.01 0.00 0.00 56.01 56.22 2yu7 n LEU 37 Cb 0.32 -0.98 -0.01 0.00 -0.11 0.00 0.00 43.42 42.65 2yu7 n LEU 37 CO 0.43 0.75 0.13 0.28 -1.51 0.00 0.00 177.39 177.47 2yu7 h SER 38 N -0.30 -0.10 -3.44 -1.43 0.02 -1.97 -3.43 113.55 102.90 2yu7 h SER 38 Ca -0.51 0.00 -0.57 0.00 -0.84 0.00 0.00 61.79 59.87 2yu7 h SER 38 Cb 1.81 0.03 -0.06 0.00 0.14 0.00 0.00 62.40 64.31 2yu7 h SER 38 CO -0.11 0.06 0.94 -1.10 -1.14 0.00 0.00 176.83 175.48 2yu7 s GLN 39 N -1.91 3.81 0.10 3.45 -1.52 -1.26 -4.99 119.66 117.34 2yu7 s GLN 39 Ca -0.02 0.87 -0.31 0.00 -1.95 0.00 0.00 55.36 53.96 2yu7 s GLN 39 Cb 0.00 -3.88 -0.07 0.00 -0.22 0.00 0.00 33.01 28.83 2yu7 s GLN 39 CO 0.05 -1.26 1.37 -1.25 -0.25 0.00 0.00 175.29 173.95 2yu7 s PRO 40 N 4.30 4.33 0.00 2.91 0.04 -1.26 -3.05 135.00 142.27 2yu7 s PRO 40 Ca 0.51 2.03 0.00 0.00 0.04 0.00 0.00 61.00 63.58 2yu7 s PRO 40 Cb -0.11 -3.29 0.00 0.00 0.04 0.00 0.00 34.50 31.14 2yu7 s PRO 40 CO 0.27 -0.43 0.00 0.41 0.04 0.00 0.00 177.00 177.29 2yu7 n GLY 41 N 3.47 2.97 3.77 0.56 0.00 -1.26 -5.04 105.19 109.67 2yu7 n GLY 41 Ca 0.11 -0.49 -0.40 0.00 0.00 0.00 0.00 46.02 45.25 2yu7 n GLY 41 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2yu7 s ASP 42 N 0.38 6.94 0.30 1.61 1.11 -1.17 -4.90 116.67 120.94 2yu7 s ASP 42 Ca 0.00 2.35 0.07 0.00 0.18 0.00 0.00 52.55 55.15 2yu7 s ASP 42 Cb 0.00 -2.62 -0.03 0.00 1.07 0.00 0.00 42.92 41.34 2yu7 s ASP 42 CO 0.00 -0.38 0.28 -0.36 1.18 0.00 0.00 175.17 175.89 2yu7 s PHE 43 N -1.26 3.03 -0.04 4.23 0.40 -1.18 -0.73 117.98 122.43 2yu7 s PHE 43 Ca 0.50 -0.21 0.02 0.00 -0.60 0.00 0.00 56.93 56.64 2yu7 s PHE 43 Cb -0.32 -1.66 0.01 0.00 0.51 0.00 0.00 43.02 41.55 2yu7 s PHE 43 CO 0.42 0.30 -0.10 0.08 0.70 0.00 0.00 175.22 176.62 2yu7 s VAL 44 N -2.21 0.87 -0.33 -0.44 1.01 -1.04 -0.13 120.40 118.12 2yu7 s VAL 44 Ca 0.38 -0.38 -0.11 0.00 0.00 0.00 0.00 61.98 61.87 2yu7 s VAL 44 Cb -0.07 -0.79 -0.00 0.00 0.00 0.00 0.00 36.38 35.52 2yu7 s VAL 44 CO 0.27 0.28 0.19 -0.22 0.00 0.00 0.00 175.10 175.61 2yu7 s LEU 45 N 0.36 4.33 -0.19 3.92 1.98 -0.01 -1.95 118.68 127.13 2yu7 s LEU 45 Ca -0.06 -0.58 -0.05 0.00 -2.89 0.00 0.00 54.13 50.55 2yu7 s LEU 45 Cb -0.11 -2.04 -0.03 0.00 0.66 0.00 0.00 46.19 44.67 2yu7 s LEU 45 CO 0.01 -0.24 0.00 -0.44 -1.89 0.00 0.00 176.35 173.80 2yu7 s SER 46 N 1.63 4.99 -0.03 3.68 0.01 -0.91 -0.18 113.70 122.90 2yu7 s SER 46 Ca 0.05 -0.12 0.02 0.00 1.31 0.00 0.00 55.95 57.20 2yu7 s SER 46 Cb -0.17 -1.84 0.01 0.00 0.21 0.00 0.00 66.02 64.22 2yu7 s SER 46 CO 0.07 0.11 -0.06 -0.69 0.41 0.00 0.00 173.24 173.09 2yu7 s VAL 47 N 0.71 0.57 -0.22 3.43 1.01 -1.04 -0.24 120.40 124.62 2yu7 s VAL 47 Ca 0.00 -0.20 -0.20 0.00 0.00 0.00 0.00 61.98 61.59 2yu7 s VAL 47 Cb -0.14 -0.55 -0.03 0.00 0.00 0.00 0.00 36.38 35.67 2yu7 s VAL 47 CO 0.02 0.21 0.59 -0.22 0.00 0.00 0.00 175.10 175.69 2yu7 s LEU 48 N 0.53 4.12 0.81 3.92 2.96 0.41 -1.67 118.68 129.76 2yu7 s LEU 48 Ca -0.07 0.73 -0.10 0.00 -0.22 0.00 0.00 54.13 54.46 2yu7 s LEU 48 Cb -0.11 -2.81 0.11 0.00 0.50 0.00 0.00 46.19 43.89 2yu7 s LEU 48 CO 0.00 -0.27 1.15 -0.94 -1.32 0.00 0.00 176.35 174.97 2yu7 s SER 49 N 1.28 4.19 0.00 3.68 1.04 -0.59 0.46 113.70 123.76 2yu7 s SER 49 Ca 0.26 0.42 0.19 0.00 0.48 0.00 0.00 55.95 57.30 2yu7 s SER 49 Cb -0.16 -0.83 0.53 0.00 0.10 0.00 0.00 66.02 65.66 2yu7 s SER 49 CO 0.10 -2.04 1.44 -0.90 0.98 0.00 0.00 173.24 172.81 2yu7 n ASP 50 N -3.27 3.08 -4.39 7.02 5.68 -1.26 -4.47 116.55 118.94 2yu7 n ASP 50 Ca 0.11 -1.98 -0.34 0.00 -0.50 0.00 0.00 54.79 52.08 2yu7 n ASP 50 Cb 0.60 -0.35 -0.14 0.00 -1.14 0.00 0.00 41.12 40.09 2yu7 n ASP 50 CO 0.00 0.00 0.00 -1.10 -1.33 0.00 0.00 177.20 174.77 2yu7 s GLN 51 N -1.29 3.47 0.63 0.11 -0.21 -1.26 -5.03 119.66 116.07 2yu7 s GLN 51 Ca 0.39 -0.62 -0.16 0.00 0.02 0.00 0.00 55.36 54.98 2yu7 s GLN 51 Cb 0.21 -2.80 -0.02 0.00 1.00 0.00 0.00 33.01 31.40 2yu7 s GLN 51 CO 0.27 0.13 1.12 -1.25 -2.12 0.00 0.00 175.29 173.44 2yu7 s PRO 52 N 0.61 2.96 0.11 2.91 0.04 -1.26 -1.23 135.00 139.13 2yu7 s PRO 52 Ca -0.05 1.46 0.03 0.00 0.04 0.00 0.00 61.00 62.47 2yu7 s PRO 52 Cb -0.15 -1.97 -0.22 0.00 0.04 0.00 0.00 34.50 32.20 2yu7 s PRO 52 CO 0.03 -1.13 1.24 1.57 0.04 0.00 0.00 177.00 178.74 2yu7 h LYS 53 N 0.37 0.11 -2.25 4.56 2.10 -1.75 -3.40 116.57 116.30 2yu7 h LYS 53 Ca -0.48 -0.18 -0.58 0.00 -2.00 0.00 0.00 60.65 57.42 2yu7 h LYS 53 Cb 1.25 0.06 -0.39 0.00 -0.90 0.00 0.00 32.23 32.25 2yu7 h LYS 53 CO 0.55 1.07 -0.94 0.00 -2.00 0.00 0.00 179.45 178.14 2yu7 n ALA 54 N -2.42 2.91 -0.40 0.07 0.00 -1.26 -5.07 120.51 114.33 2yu7 n ALA 54 Ca -0.03 -3.63 0.00 0.00 0.00 0.00 0.00 53.44 49.78 2yu7 n ALA 54 Cb 0.96 -0.83 0.00 0.00 0.00 0.00 0.00 19.45 19.58 2yu7 n ALA 54 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2yu7 n GLY 55 N 1.83 0.67 3.73 0.00 0.00 -1.26 -3.97 105.19 106.19 2yu7 n GLY 55 Ca 0.25 -0.86 -0.42 0.00 0.00 0.00 0.00 46.02 44.99 2yu7 n GLY 55 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2yu7 s PRO 56 N 0.00 4.38 0.00 1.61 0.04 -1.26 -3.20 135.00 136.57 2yu7 s PRO 56 Ca 0.00 2.04 0.00 0.00 0.04 0.00 0.00 61.00 63.08 2yu7 s PRO 56 Cb 0.00 -3.21 0.00 0.00 0.04 0.00 0.00 34.50 31.33 2yu7 s PRO 56 CO 0.00 -0.29 0.00 0.41 0.04 0.00 0.00 177.00 177.16 2yu7 n GLY 57 N 2.64 2.56 3.92 0.56 0.00 -1.26 -5.08 105.19 108.52 2yu7 n GLY 57 Ca 0.07 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.81 2yu7 n GLY 57 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2yu7 s SER 58 N -1.02 6.41 0.42 1.61 1.04 -1.19 -5.07 113.70 115.90 2yu7 s SER 58 Ca 0.00 0.57 -0.24 0.00 0.48 0.00 0.00 55.95 56.75 2yu7 s SER 58 Cb 0.00 -2.08 -0.08 0.00 0.10 0.00 0.00 66.02 63.96 2yu7 s SER 58 CO 0.00 -0.13 1.18 -2.16 0.98 0.00 0.00 173.24 173.11 2yu7 s PRO 59 N -3.47 3.94 0.54 4.02 0.04 -1.26 -4.59 135.00 134.21 2yu7 s PRO 59 Ca 0.41 1.85 -0.20 0.00 0.04 0.00 0.00 61.00 63.10 2yu7 s PRO 59 Cb -0.11 -2.59 -0.07 0.00 0.04 0.00 0.00 34.50 31.78 2yu7 s PRO 59 CO 0.30 -0.42 1.00 1.28 0.04 0.00 0.00 177.00 179.20 2yu7 n LEU 60 N -0.12 3.44 -4.75 -3.56 4.32 -1.26 -2.65 117.00 112.42 2yu7 n LEU 60 Ca 0.05 0.89 -0.40 0.00 -0.02 0.00 0.00 56.01 56.53 2yu7 n LEU 60 Cb 0.47 -1.39 -0.05 0.00 -1.62 0.00 0.00 43.42 40.83 2yu7 n LEU 60 CO 0.50 -1.65 0.76 -0.60 -1.22 0.00 0.00 177.39 175.18 2yu7 s ARG 61 N -2.52 4.69 0.15 3.23 3.52 -0.36 -4.74 118.95 122.91 2yu7 s ARG 61 Ca 0.71 1.72 0.04 0.00 -0.13 0.00 0.00 55.73 58.08 2yu7 s ARG 61 Cb -0.46 -3.22 -0.04 0.00 -1.56 0.00 0.00 34.95 29.68 2yu7 s ARG 61 CO 0.51 0.27 0.14 0.08 -0.81 0.00 0.00 175.30 175.49 2yu7 s VAL 62 N -1.07 4.57 -0.17 7.11 1.01 -1.26 -1.54 120.40 129.05 2yu7 s VAL 62 Ca 0.44 -0.99 0.01 0.00 0.00 0.00 0.00 61.98 61.44 2yu7 s VAL 62 Cb -0.30 -3.31 0.03 0.00 0.00 0.00 0.00 36.38 32.79 2yu7 s VAL 62 CO 0.38 -0.07 -0.14 -0.89 0.00 0.00 0.00 175.10 174.38 2yu7 s THR 63 N -1.69 1.70 -0.59 3.92 2.01 -0.67 -4.97 115.64 115.35 2yu7 s THR 63 Ca 0.31 -0.80 -0.18 0.00 0.31 0.00 0.00 61.69 61.33 2yu7 s THR 63 Cb -0.11 -1.63 0.12 0.00 0.01 0.00 0.00 72.50 70.89 2yu7 s THR 63 CO 0.24 0.40 0.64 -1.00 -0.69 0.00 0.00 174.62 174.21 2yu7 s HIS 64 N 1.42 3.11 -0.60 4.92 3.76 -1.26 -2.51 115.29 124.13 2yu7 s HIS 64 Ca 0.03 -1.11 -0.11 0.00 -0.15 0.00 0.00 55.06 53.72 2yu7 s HIS 64 Cb -0.14 -3.94 0.15 0.00 1.11 0.00 0.00 32.58 29.76 2yu7 s HIS 64 CO -0.10 -1.20 0.50 0.42 -0.85 0.00 0.00 174.74 173.51 2yu7 s ILE 65 N 2.24 4.75 0.28 0.60 1.01 0.75 -4.89 121.20 125.94 2yu7 s ILE 65 Ca 0.09 -2.03 -0.30 0.00 0.00 0.00 0.00 60.65 58.41 2yu7 s ILE 65 Cb -0.25 -4.05 -0.11 0.00 0.01 0.00 0.00 42.46 38.05 2yu7 s ILE 65 CO 0.04 -0.88 1.62 -1.59 0.00 0.00 0.00 174.94 174.14 2yu7 s LYS 66 N 0.95 4.12 -0.23 2.79 -2.85 -1.26 -0.83 119.74 122.43 2yu7 s LYS 66 Ca 0.09 2.59 -0.07 0.00 -1.00 0.00 0.00 55.97 57.58 2yu7 s LYS 66 Cb -0.23 -3.03 -0.03 0.00 -2.06 0.00 0.00 37.83 32.48 2yu7 s LYS 66 CO -0.02 -0.66 0.07 0.08 0.10 0.00 0.00 175.35 174.92 2yu7 s VAL 67 N 0.18 4.48 -0.20 1.79 1.01 0.81 -4.82 120.40 123.65 2yu7 s VAL 67 Ca 0.65 -0.12 -0.24 0.00 0.00 0.00 0.00 61.98 62.27 2yu7 s VAL 67 Cb -0.48 -3.07 -0.01 0.00 0.00 0.00 0.00 36.38 32.81 2yu7 s VAL 67 CO 0.46 0.36 0.79 -0.04 0.00 0.00 0.00 175.10 176.67 2yu7 s MET 68 N 1.29 4.24 -0.14 2.72 -1.94 0.68 -3.09 119.30 123.07 2yu7 s MET 68 Ca 0.05 0.90 -0.22 0.00 -1.71 0.00 0.00 55.69 54.71 2yu7 s MET 68 Cb -0.15 -3.60 -0.03 0.00 2.01 0.00 0.00 34.83 33.07 2yu7 s MET 68 CO 0.04 -0.37 0.66 0.00 -0.01 0.00 0.00 175.02 175.34 2yu7 n GLU 70 N 4.44 2.79 -2.78 0.00 4.07 -0.66 -4.91 120.64 123.60 2yu7 n GLU 70 Ca -0.01 -4.63 -0.03 0.00 -0.06 0.00 0.00 57.16 52.43 2yu7 n GLU 70 Cb 0.50 -2.31 0.00 0.00 -0.06 0.00 0.00 31.44 29.57 2yu7 n GLU 70 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2yu7 n GLY 71 N 1.14 -3.29 3.00 8.31 0.00 -1.26 -3.37 105.19 109.71 2yu7 n GLY 71 Ca 0.28 0.71 0.00 0.00 0.00 0.00 0.00 46.02 47.01 2yu7 n GLY 71 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2yu7 n GLY 72 N 0.40 0.07 3.61 -0.02 0.00 -1.26 -4.93 105.19 103.07 2yu7 n GLY 72 Ca 0.04 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.78 2yu7 n GLY 72 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2yu7 s ARG 73 N -1.64 1.99 -0.06 1.61 0.52 -1.22 -4.50 118.95 115.66 2yu7 s ARG 73 Ca 0.00 -2.21 -0.05 0.00 -0.52 0.00 0.00 55.73 52.94 2yu7 s ARG 73 Cb 0.00 -1.12 0.02 0.00 0.52 0.00 0.00 34.95 34.36 2yu7 s ARG 73 CO 0.00 -0.34 0.16 0.71 0.02 0.00 0.00 175.30 175.86 2yu7 s TYR 74 N -3.03 -0.18 0.16 -0.53 2.02 -0.90 -1.66 117.35 113.22 2yu7 s TYR 74 Ca 0.20 0.45 -0.08 0.00 -0.37 0.00 0.00 57.07 57.28 2yu7 s TYR 74 Cb 0.04 0.05 -0.01 0.00 -0.40 0.00 0.00 41.96 41.64 2yu7 s TYR 74 CO 0.11 -0.10 0.25 -0.08 -1.57 0.00 0.00 175.55 174.16 2yu7 s THR 75 N 0.21 0.08 -0.22 -0.71 -1.32 0.12 -1.08 115.64 112.71 2yu7 s THR 75 Ca -0.01 -1.45 -0.04 0.00 -1.21 0.00 0.00 61.69 58.98 2yu7 s THR 75 Cb -0.02 -1.84 0.11 0.00 -1.51 0.00 0.00 72.50 69.24 2yu7 s THR 75 CO -0.01 -0.34 0.35 0.68 -2.21 0.00 0.00 174.62 173.10 2yu7 s VAL 76 N -3.97 -0.56 0.00 5.08 -7.23 -1.26 -0.23 120.40 112.23 2yu7 s VAL 76 Ca 0.17 -0.01 0.00 0.00 -1.81 0.00 0.00 61.98 60.34 2yu7 s VAL 76 Cb 0.04 -0.74 0.00 0.00 0.56 0.00 0.00 36.38 36.24 2yu7 s VAL 76 CO -0.00 -0.08 0.00 0.61 -0.31 0.00 0.00 175.10 175.32 2yu7 n GLY 77 N 5.36 1.13 0.49 2.32 0.00 -1.26 -4.84 105.19 108.39 2yu7 n GLY 77 Ca -0.05 -0.01 -0.02 0.00 0.00 0.00 0.00 46.02 45.94 2yu7 n GLY 77 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2yu7 n GLY 78 N 0.00 1.81 0.10 -0.02 0.00 -1.26 -5.03 105.19 100.78 2yu7 n GLY 78 Ca 0.00 -2.12 -0.01 0.00 0.00 0.00 0.00 46.02 43.89 2yu7 n GLY 78 CO 0.00 0.00 0.00 0.17 0.00 0.00 0.00 173.32 173.49 2yu7 h LEU 79 N 0.00 0.00 -5.66 0.99 8.10 -1.99 -3.47 115.31 113.28 2yu7 h LEU 79 Ca -0.03 0.00 -0.33 0.00 0.11 0.00 0.00 57.88 57.63 2yu7 h LEU 79 Cb 0.16 0.00 -0.07 0.00 -0.44 0.00 0.00 40.66 40.31 2yu7 h LEU 79 CO 0.05 0.62 1.30 -0.62 -4.11 0.00 0.00 178.44 175.68 2yu7 n GLU 80 N -2.99 0.00 -3.33 0.17 1.02 -1.26 -4.81 120.64 109.44 2yu7 n GLU 80 Ca -0.08 0.00 -0.46 0.00 -0.02 0.00 0.00 57.16 56.61 2yu7 n GLU 80 Cb 0.84 -0.97 -0.06 0.00 -0.02 0.00 0.00 31.44 31.24 2yu7 n GLU 80 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 2yu7 s THR 81 N 4.68 5.18 0.55 2.62 -4.23 -1.26 -4.21 115.64 118.98 2yu7 s THR 81 Ca 0.95 -1.42 -0.17 0.00 -1.18 0.00 0.00 61.69 59.87 2yu7 s THR 81 Cb -0.81 -4.28 -0.05 0.00 1.34 0.00 0.00 72.50 68.69 2yu7 s THR 81 CO 0.36 -0.81 1.05 -0.36 -0.54 0.00 0.00 174.62 174.32 2yu7 s PHE 82 N 1.60 3.00 0.32 3.99 0.40 -0.24 -4.74 117.98 122.31 2yu7 s PHE 82 Ca 0.03 1.53 0.01 0.00 -0.60 0.00 0.00 56.93 57.90 2yu7 s PHE 82 Cb -0.29 -3.02 0.54 0.00 0.51 0.00 0.00 43.02 40.76 2yu7 s PHE 82 CO 0.04 -1.00 1.96 0.22 0.70 0.00 0.00 175.22 177.14 2yu7 h ASP 83 N 0.85 0.86 -5.10 1.36 1.82 -1.89 -2.40 116.42 111.92 2yu7 h ASP 83 Ca -0.48 -0.01 0.04 0.00 -0.39 0.00 0.00 57.03 56.19 2yu7 h ASP 83 Cb 1.22 -0.20 -0.02 0.00 0.68 0.00 0.00 39.33 41.01 2yu7 h ASP 83 CO 0.58 0.60 0.34 -0.55 -1.61 0.00 0.00 179.24 178.60 2yu7 s SER 84 N -6.23 -0.04 0.38 2.28 0.15 -1.26 -4.39 113.70 104.58 2yu7 s SER 84 Ca -0.11 -0.94 0.05 0.00 0.70 0.00 0.00 55.95 55.66 2yu7 s SER 84 Cb 0.19 0.75 0.76 0.00 -1.71 0.00 0.00 66.02 66.00 2yu7 s SER 84 CO 0.79 -1.47 2.01 -0.07 1.20 0.00 0.00 173.24 175.70 2yu7 h LEU 85 N 2.00 0.60 -1.53 3.45 -0.00 -1.95 -0.31 115.31 117.58 2yu7 h LEU 85 Ca -0.29 -0.01 -0.03 0.00 -0.00 0.00 0.00 57.88 57.55 2yu7 h LEU 85 Cb 1.24 -0.14 -0.01 0.00 -0.00 0.00 0.00 40.66 41.75 2yu7 h LEU 85 CO 0.36 0.42 -0.00 0.74 -0.00 0.00 0.00 178.44 179.96 2yu7 h THR 86 N 0.70 1.13 0.14 0.22 2.02 -1.98 0.31 112.91 115.45 2yu7 h THR 86 Ca 0.23 -0.52 -0.24 0.00 0.77 0.00 0.00 66.41 66.64 2yu7 h THR 86 Cb 0.04 0.99 0.01 0.00 -1.74 0.00 0.00 68.15 67.45 2yu7 h THR 86 CO -0.06 0.17 -1.16 0.44 0.37 0.00 0.00 175.52 175.28 2yu7 h ASP 87 N 0.29 0.45 -0.62 4.18 3.32 -1.62 -2.21 116.42 120.21 2yu7 h ASP 87 Ca 0.07 -0.90 -0.09 0.00 0.02 0.00 0.00 57.03 56.13 2yu7 h ASP 87 Cb 0.21 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.59 2yu7 h ASP 87 CO 0.00 1.53 0.02 0.25 -1.72 0.00 0.00 179.24 179.33 2yu7 h LEU 88 N -0.30 1.05 0.12 1.55 6.46 -0.94 -2.33 115.31 120.93 2yu7 h LEU 88 Ca -0.23 -0.30 -0.01 0.00 -0.12 0.00 0.00 57.88 57.22 2yu7 h LEU 88 Cb 1.74 -0.28 0.00 0.00 -0.73 0.00 0.00 40.66 41.39 2yu7 h LEU 88 CO 0.11 1.09 -0.06 0.58 -0.62 0.00 0.00 178.44 179.55 2yu7 h VAL 89 N 0.98 1.00 -1.01 1.05 2.07 -0.53 -3.09 116.25 116.72 2yu7 h VAL 89 Ca 0.18 -1.25 0.26 0.00 0.82 0.00 0.00 66.70 66.71 2yu7 h VAL 89 Cb 0.54 1.69 -0.07 0.00 -1.52 0.00 0.00 31.29 31.92 2yu7 h VAL 89 CO 0.03 0.26 0.68 -0.33 0.02 0.00 0.00 177.57 178.23 2yu7 h GLU 90 N -0.83 0.29 -0.11 1.57 4.39 -1.43 0.66 114.58 119.12 2yu7 h GLU 90 Ca -0.02 -0.02 -0.11 0.00 0.34 0.00 0.00 59.36 59.55 2yu7 h GLU 90 Cb 0.56 -0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 29.13 2yu7 h GLU 90 CO 0.03 0.19 -0.42 1.25 -1.16 0.00 0.00 179.01 178.90 2yu7 h HIS 91 N 0.30 0.31 0.00 4.33 2.76 -1.44 -2.96 115.15 118.45 2yu7 h HIS 91 Ca 0.54 -0.09 -0.11 0.00 -2.20 0.00 0.00 60.37 58.52 2yu7 h HIS 91 Cb 1.55 -0.07 -0.02 0.00 1.55 0.00 0.00 27.41 30.43 2yu7 h HIS 91 CO -0.00 0.65 -1.01 0.74 -1.30 0.00 0.00 177.93 177.00 2yu7 h PHE 92 N 0.22 0.00 0.00 5.26 0.04 0.16 -2.83 116.94 119.79 2yu7 h PHE 92 Ca 0.02 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.78 2yu7 h PHE 92 Cb 0.84 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.99 2yu7 h PHE 92 CO 0.02 0.41 -0.06 0.87 -0.60 0.00 0.00 178.31 178.94 2yu7 h LYS 93 N 0.00 0.00 0.00 1.51 1.57 -0.05 1.83 116.57 121.43 2yu7 h LYS 93 Ca -0.08 0.00 -0.34 0.00 -1.87 0.00 0.00 60.65 58.36 2yu7 h LYS 93 Cb 1.38 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 33.63 2yu7 h LYS 93 CO 0.04 0.06 -2.28 0.36 -0.57 0.00 0.00 179.45 177.06 2yu7 n LYS 94 N -3.63 0.57 -0.11 3.15 2.85 -1.21 -4.70 118.16 115.08 2yu7 n LYS 94 Ca -0.02 0.13 -0.24 0.00 -1.05 0.00 0.00 58.31 57.12 2yu7 n LYS 94 Cb 0.17 -1.45 -0.11 0.00 -0.65 0.00 0.00 35.03 32.99 2yu7 n LYS 94 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 177.40 177.60 2yu7 n THR 95 N -3.15 1.55 0.00 0.58 -2.24 -1.07 -5.12 114.28 104.84 2yu7 n THR 95 Ca -0.40 -0.20 0.00 0.00 -2.27 0.00 0.00 64.05 61.18 2yu7 n THR 95 Cb 0.93 -1.95 0.00 0.00 -2.10 0.00 0.00 70.33 67.21 2yu7 n THR 95 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2yu7 n GLY 96 N 1.45 1.51 3.82 3.38 0.00 0.62 -5.01 105.19 110.96 2yu7 n GLY 96 Ca -0.40 -1.76 -0.38 0.00 0.00 0.00 0.00 46.02 43.48 2yu7 n GLY 96 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2yu7 s ILE 97 N -2.65 4.81 -0.28 -0.61 1.01 -0.26 -4.87 121.20 118.36 2yu7 s ILE 97 Ca 0.00 1.13 -0.03 0.00 0.00 0.00 0.00 60.65 61.75 2yu7 s ILE 97 Cb 0.00 -3.85 0.03 0.00 0.01 0.00 0.00 42.46 38.65 2yu7 s ILE 97 CO 0.00 0.56 -0.01 -0.70 0.00 0.00 0.00 174.94 174.79 2yu7 s GLU 98 N -1.10 2.71 0.42 2.79 2.12 -1.26 -0.33 118.70 124.04 2yu7 s GLU 98 Ca 0.28 -1.08 -0.25 0.00 0.36 0.00 0.00 54.97 54.28 2yu7 s GLU 98 Cb -0.19 -3.14 -0.08 0.00 0.26 0.00 0.00 34.13 30.97 2yu7 s GLU 98 CO 0.18 -0.50 1.23 -1.21 -0.54 0.00 0.00 175.26 174.42 2yu7 s GLU 99 N 1.33 3.94 0.37 4.30 2.02 0.93 -4.89 118.70 126.70 2yu7 s GLU 99 Ca -0.02 1.98 0.18 0.00 0.02 0.00 0.00 54.97 57.13 2yu7 s GLU 99 Cb -0.18 -2.66 1.15 0.00 0.10 0.00 0.00 34.13 32.53 2yu7 s GLU 99 CO -0.02 -0.46 1.68 0.00 0.02 0.00 0.00 175.26 176.48 2yu7 h ALA 100 N 2.54 2.15 -0.34 5.21 0.00 -1.99 0.38 119.26 127.20 2yu7 h ALA 100 Ca -0.49 0.15 -0.09 0.00 0.00 0.00 0.00 54.91 54.48 2yu7 h ALA 100 Cb 1.24 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 19.16 2yu7 h ALA 100 CO 0.62 -0.72 -0.13 0.77 0.00 0.00 0.00 179.25 179.79 2yu7 h SER 101 N 0.30 0.71 0.00 0.00 0.02 -2.05 -3.47 113.55 109.07 2yu7 h SER 101 Ca 0.72 -0.39 0.00 0.00 -0.84 0.00 0.00 61.79 61.28 2yu7 h SER 101 Cb 1.80 -0.20 0.00 0.00 0.14 0.00 0.00 62.40 64.14 2yu7 h SER 101 CO -0.51 0.94 0.00 0.61 -1.14 0.00 0.00 176.83 176.73 2yu7 n GLY 102 N -0.10 0.97 3.34 -3.77 0.00 0.13 -5.14 105.19 100.63 2yu7 n GLY 102 Ca -0.02 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.62 2yu7 n GLY 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2yu7 n ALA 103 N 0.00 -2.36 -3.95 4.61 0.00 -1.26 -4.45 120.51 113.10 2yu7 n ALA 103 Ca 0.00 -0.10 -0.30 0.00 0.00 0.00 0.00 53.44 53.04 2yu7 n ALA 103 Cb 0.00 -1.59 -0.16 0.00 0.00 0.00 0.00 19.45 17.70 2yu7 n ALA 103 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2yu7 s PHE 104 N -1.89 2.26 -0.18 0.00 0.08 -1.26 -0.05 117.98 116.93 2yu7 s PHE 104 Ca 0.61 -1.54 -0.19 0.00 0.12 0.00 0.00 56.93 55.93 2yu7 s PHE 104 Cb -0.44 -1.55 -0.03 0.00 -0.57 0.00 0.00 43.02 40.42 2yu7 s PHE 104 CO 0.62 -0.73 0.52 0.08 -0.10 0.00 0.00 175.22 175.61 2yu7 s VAL 105 N 1.45 5.11 -0.17 -0.44 1.01 0.54 -4.93 120.40 122.98 2yu7 s VAL 105 Ca -0.02 0.97 -0.03 0.00 0.00 0.00 0.00 61.98 62.90 2yu7 s VAL 105 Cb -0.17 -3.85 -0.02 0.00 0.00 0.00 0.00 36.38 32.35 2yu7 s VAL 105 CO -0.07 0.20 -0.07 -0.31 0.00 0.00 0.00 175.10 174.85 2yu7 s TYR 106 N 1.47 2.93 -0.54 5.22 2.02 -1.26 -1.10 117.35 126.08 2yu7 s TYR 106 Ca 0.25 -0.67 -0.15 0.00 -0.37 0.00 0.00 57.07 56.13 2yu7 s TYR 106 Cb -0.15 -1.98 0.13 0.00 -0.40 0.00 0.00 41.96 39.56 2yu7 s TYR 106 CO 0.10 -0.30 0.49 -0.51 -1.57 0.00 0.00 175.55 173.76 2yu7 s LEU 107 N 0.80 6.14 -0.03 -1.29 1.43 -1.26 -4.43 118.68 120.04 2yu7 s LEU 107 Ca -0.02 -1.84 0.02 0.00 -1.03 0.00 0.00 54.13 51.25 2yu7 s LEU 107 Cb -0.15 -2.18 -0.03 0.00 0.03 0.00 0.00 46.19 43.87 2yu7 s LEU 107 CO 0.01 -0.82 -0.00 0.54 0.23 0.00 0.00 176.35 176.31 2yu7 n ARG 108 N 5.15 2.55 -3.53 1.70 1.74 -0.97 -4.49 116.66 118.80 2yu7 n ARG 108 Ca -0.12 0.00 -0.41 0.00 -0.77 0.00 0.00 57.85 56.55 2yu7 n ARG 108 Cb 0.40 -1.06 -0.07 0.00 -1.02 0.00 0.00 32.46 30.71 2yu7 n ARG 108 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 2yu7 s GLN 109 N -2.06 2.76 -1.17 5.56 -0.21 -0.74 -5.01 119.66 118.79 2yu7 s GLN 109 Ca -0.02 -2.08 -0.23 0.00 0.02 0.00 0.00 55.36 53.05 2yu7 s GLN 109 Cb 0.01 -4.01 -0.09 0.00 1.00 0.00 0.00 33.01 29.92 2yu7 s GLN 109 CO 0.09 -1.22 1.94 -1.25 -2.12 0.00 0.00 175.29 172.73 2yu7 s PRO 110 N 0.80 2.49 -0.48 2.91 0.04 -1.26 -1.80 135.00 137.70 2yu7 s PRO 110 Ca 0.11 -1.12 -0.34 0.00 0.04 0.00 0.00 61.00 59.68 2yu7 s PRO 110 Cb -0.22 -5.23 -0.16 0.00 0.04 0.00 0.00 34.50 28.93 2yu7 s PRO 110 CO -0.03 -3.96 1.82 0.98 0.04 0.00 0.00 177.00 175.85 2yu7 n TYR 111 N 14.40 0.86 0.00 0.56 9.36 -0.01 -4.50 117.16 137.83 2yu7 n TYR 111 Ca 0.45 0.57 0.00 0.00 3.32 0.00 0.00 57.90 62.24 2yu7 n TYR 111 Cb 0.47 -1.88 0.00 0.00 -0.63 0.00 0.00 39.34 37.30 2yu7 n TYR 111 CO 0.00 0.00 0.00 0.66 0.22 0.00 0.00 176.86 177.74 2yu7 n TYR 112 N 6.54 0.00 -4.36 2.98 4.01 -1.26 -4.33 117.16 120.73 2yu7 n TYR 112 Ca 0.46 0.00 -0.17 0.00 -0.16 0.00 0.00 57.90 58.04 2yu7 n TYR 112 Cb -0.02 -0.50 -0.04 0.00 -0.31 0.00 0.00 39.34 38.47 2yu7 n TYR 112 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 2yu7 n SER 113 N -2.00 1.91 -3.15 7.72 7.64 -1.26 -4.72 113.62 119.76 2yu7 n SER 113 Ca 0.00 -2.29 0.03 0.00 1.01 0.00 0.00 58.87 57.62 2yu7 n SER 113 Cb 0.00 0.42 -0.00 0.00 -1.01 0.00 0.00 64.21 63.62 2yu7 n SER 113 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2yu7 s GLY 114 N -2.55 -1.26 -0.90 0.23 0.00 -1.26 -5.05 107.32 96.52 2yu7 s GLY 114 Ca 0.06 0.80 -0.25 0.00 0.00 0.00 0.00 44.72 45.34 2yu7 s GLY 114 CO 0.05 3.75 1.95 2.56 0.00 0.00 0.00 173.10 181.41 2yu7 s PRO 115 N 2.38 2.54 0.85 2.90 0.04 -1.26 -4.95 135.00 137.51 2yu7 s PRO 115 Ca 0.14 -0.28 -0.17 0.00 0.04 0.00 0.00 61.00 60.74 2yu7 s PRO 115 Cb -0.06 -5.06 -0.11 0.00 0.04 0.00 0.00 34.50 29.31 2yu7 s PRO 115 CO -0.17 -3.39 -0.35 0.43 0.04 0.00 0.00 177.00 173.56 2yu7 n SER 116 N 14.03 -4.47 -3.97 6.66 7.64 -1.26 -4.97 113.62 127.28 2yu7 n SER 116 Ca 0.40 0.35 -0.31 0.00 1.01 0.00 0.00 58.87 60.33 2yu7 n SER 116 Cb 0.47 -0.89 -0.16 0.00 -1.01 0.00 0.00 64.21 62.63 2yu7 n SER 116 CO 0.00 0.00 0.00 -0.44 -3.01 0.00 0.00 175.04 171.59 2yu7 s SER 117 N -1.18 3.85 0.00 6.43 0.01 -1.26 -5.21 113.70 116.34 2yu7 s SER 117 Ca 0.49 -1.15 0.23 0.00 1.31 0.00 0.00 55.95 56.82 2yu7 s SER 117 Cb -0.27 -1.25 0.18 0.00 0.21 0.00 0.00 66.02 64.89 2yu7 s SER 117 CO 0.74 -0.21 1.22 0.61 0.41 0.00 0.00 173.24 176.02