#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 3.64 -0.18 1.61 0.15 -1.26 -5.00 113.70 112.65 2yu7 s SER 2 Ca 0.00 -0.50 -0.14 0.00 0.70 0.00 0.00 55.95 56.01 2yu7 s SER 2 Cb 0.00 -1.57 -0.07 0.00 -1.71 0.00 0.00 66.02 62.67 2yu7 s SER 2 CO 0.00 0.05 -0.30 -1.20 1.20 0.00 0.00 173.24 172.99 2yu7 n SER 3 N 4.29 1.75 -2.74 5.45 7.64 -1.26 -5.04 113.62 123.72 2yu7 n SER 3 Ca -0.19 0.30 -0.11 0.00 1.01 0.00 0.00 58.87 59.87 2yu7 n SER 3 Cb 0.51 -0.69 0.08 0.00 -1.01 0.00 0.00 64.21 63.11 2yu7 n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2yu7 n GLY 4 N 1.66 -1.33 0.08 0.23 0.00 -1.26 -5.06 105.19 99.50 2yu7 n GLY 4 Ca -0.27 -1.68 -0.08 0.00 0.00 0.00 0.00 46.02 44.00 2yu7 n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2yu7 n SER 5 N -3.35 1.70 -4.15 1.61 3.41 -1.26 -5.00 113.62 106.58 2yu7 n SER 5 Ca 0.06 0.32 -0.35 0.00 -0.26 0.00 0.00 58.87 58.64 2yu7 n SER 5 Cb 0.22 -0.72 0.07 0.00 -0.26 0.00 0.00 64.21 63.52 2yu7 n SER 5 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 2yu7 n SER 6 N -4.24 -4.49 0.00 4.04 3.41 -1.26 -4.84 113.62 106.24 2yu7 n SER 6 Ca -0.12 0.21 0.00 0.00 -0.26 0.00 0.00 58.87 58.71 2yu7 n SER 6 Cb 0.44 -0.90 0.00 0.00 -0.26 0.00 0.00 64.21 63.48 2yu7 n SER 6 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2yu7 n GLY 7 N 2.79 0.06 0.60 5.00 0.00 -1.26 -4.95 105.19 107.43 2yu7 n GLY 7 Ca 0.01 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.16 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 -2.29 1.61 4.27 -1.26 -3.05 117.44 116.72 2yu7 n TRP 8 Ca 0.00 0.00 -0.42 0.00 -3.89 0.00 0.00 57.50 53.19 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 -2.05 2.24 -0.34 -2.67 5.04 -1.26 -2.75 117.35 115.55 2yu7 s TYR 9 Ca 0.33 0.62 -0.01 0.00 -2.44 0.00 0.00 57.07 55.58 2yu7 s TYR 9 Cb 0.20 -4.30 0.26 0.00 0.35 0.00 0.00 41.96 38.48 2yu7 s TYR 9 CO 0.35 -2.14 1.94 0.72 -1.34 0.00 0.00 175.55 175.08 2yu7 n HIS 10 N 9.48 1.73 0.00 4.97 8.25 0.85 -4.58 115.22 135.91 2yu7 n HIS 10 Ca 0.17 -1.95 0.00 0.00 -0.26 0.00 0.00 57.72 55.67 2yu7 n HIS 10 Cb 0.48 -0.95 0.00 0.00 1.12 0.00 0.00 29.99 30.64 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 0.10 1.10 3.73 -1.41 0.00 -1.26 -4.09 105.19 103.36 2yu7 n GLY 11 Ca 0.34 0.52 -0.35 0.00 0.00 0.00 0.00 46.02 46.52 2yu7 n GLY 11 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2yu7 s HIS 12 N 0.00 3.31 -0.29 1.61 2.46 -1.26 -1.42 115.29 119.70 2yu7 s HIS 12 Ca 0.00 0.26 -0.23 0.00 0.47 0.00 0.00 55.06 55.55 2yu7 s HIS 12 Cb 0.00 -1.90 0.17 0.00 -0.13 0.00 0.00 32.58 30.72 2yu7 s HIS 12 CO 0.00 0.47 1.27 1.41 -2.47 0.00 0.00 174.74 175.42 2yu7 s MET 13 N -0.63 0.22 0.13 2.88 0.00 -1.26 -4.88 119.30 115.76 2yu7 s MET 13 Ca 0.11 0.27 -0.04 0.00 0.00 0.00 0.00 55.69 56.04 2yu7 s MET 13 Cb -0.12 0.10 -0.05 0.00 0.00 0.00 0.00 34.83 34.75 2yu7 s MET 13 CO 0.02 -0.03 0.35 0.45 0.00 0.00 0.00 175.02 175.82 2yu7 s SER 14 N 0.29 6.47 0.36 1.11 0.15 -1.26 -4.41 113.70 116.42 2yu7 s SER 14 Ca 0.03 0.55 0.14 0.00 0.70 0.00 0.00 55.95 57.37 2yu7 s SER 14 Cb -0.05 -2.07 0.76 0.00 -1.71 0.00 0.00 66.02 62.95 2yu7 s SER 14 CO -0.12 0.07 1.33 1.23 1.20 0.00 0.00 173.24 176.95 2yu7 h GLY 15 N 2.84 0.00 1.43 9.45 0.00 -2.00 0.15 103.07 114.94 2yu7 h GLY 15 Ca -0.46 0.00 -0.29 0.00 0.00 0.00 0.00 47.33 46.59 2yu7 h GLY 15 CO 0.73 0.00 -1.24 -1.33 0.00 0.00 0.00 176.54 174.70 2yu7 h GLY 16 N 0.00 0.51 1.17 4.60 0.00 -2.01 -3.19 103.07 104.15 2yu7 h GLY 16 Ca 0.00 -1.15 -0.28 0.00 0.00 0.00 0.00 47.33 45.89 2yu7 h GLY 16 CO 0.00 1.01 -1.16 -1.61 0.00 0.00 0.00 176.54 174.79 2yu7 h GLN 17 N 0.18 0.61 0.31 4.80 4.15 -1.10 -3.30 115.11 120.75 2yu7 h GLN 17 Ca -0.17 -0.79 -0.00 0.00 0.77 0.00 0.00 58.65 58.46 2yu7 h GLN 17 Cb 1.93 0.26 -0.02 0.00 0.21 0.00 0.00 27.48 29.85 2yu7 h GLN 17 CO 0.22 1.35 -0.42 0.00 -1.93 0.00 0.00 178.83 178.06 2yu7 h ALA 18 N 0.29 -1.03 -0.96 3.38 0.00 -1.58 0.16 119.26 119.51 2yu7 h ALA 18 Ca -0.17 -0.13 0.31 0.00 0.00 0.00 0.00 54.91 54.91 2yu7 h ALA 18 Cb 1.84 0.70 -0.17 0.00 0.00 0.00 0.00 17.79 20.16 2yu7 h ALA 18 CO 0.22 -1.08 0.28 0.93 0.00 0.00 0.00 179.25 179.61 2yu7 h GLU 19 N -0.75 0.09 -0.31 0.00 5.08 -1.69 0.72 114.58 117.71 2yu7 h GLU 19 Ca -0.04 -0.01 -0.15 0.00 -1.00 0.00 0.00 59.36 58.17 2yu7 h GLU 19 Cb 0.68 -0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.91 2yu7 h GLU 19 CO -0.11 0.06 -0.38 1.15 -1.00 0.00 0.00 179.01 178.72 2yu7 h THR 20 N 0.09 1.29 0.25 1.13 2.02 -1.48 -2.60 112.91 113.61 2yu7 h THR 20 Ca 0.67 -1.56 -0.01 0.00 0.77 0.00 0.00 66.41 66.28 2yu7 h THR 20 Cb 1.53 1.55 0.00 0.00 -1.74 0.00 0.00 68.15 69.50 2yu7 h THR 20 CO -0.78 0.51 -0.12 -0.07 0.37 0.00 0.00 175.52 175.43 2yu7 h LEU 21 N 0.58 -0.28 -0.88 2.58 3.38 0.31 -1.00 115.31 120.01 2yu7 h LEU 21 Ca 0.04 0.01 0.20 0.00 0.09 0.00 0.00 57.88 58.22 2yu7 h LEU 21 Cb 0.97 0.07 -0.16 0.00 0.09 0.00 0.00 40.66 41.63 2yu7 h LEU 21 CO 0.09 -0.12 -0.12 -0.07 0.09 0.00 0.00 178.44 178.31 2yu7 h LEU 22 N -0.49 -0.65 -1.54 1.67 3.38 -0.36 1.50 115.31 118.82 2yu7 h LEU 22 Ca -0.03 0.25 -0.05 0.00 0.09 0.00 0.00 57.88 58.14 2yu7 h LEU 22 Cb 0.26 0.49 -0.01 0.00 0.09 0.00 0.00 40.66 41.49 2yu7 h LEU 22 CO 0.06 -0.28 -0.22 1.56 0.09 0.00 0.00 178.44 179.64 2yu7 h GLN 23 N 0.02 0.00 -0.05 1.13 4.20 -1.53 -2.92 115.11 115.96 2yu7 h GLN 23 Ca 0.46 0.00 0.01 0.00 0.06 0.00 0.00 58.65 59.18 2yu7 h GLN 23 Cb 0.79 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.55 2yu7 h GLN 23 CO -0.86 0.22 -0.02 0.00 -0.67 0.00 0.00 178.83 177.50 2yu7 h ALA 24 N 1.78 0.03 -0.41 3.87 0.00 0.35 -2.90 119.26 121.98 2yu7 h ALA 24 Ca -0.00 0.02 -0.07 0.00 0.00 0.00 0.00 54.91 54.86 2yu7 h ALA 24 Cb 0.52 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.35 2yu7 h ALA 24 CO 0.03 -0.50 -0.00 -0.22 0.00 0.00 0.00 179.25 178.56 2yu7 h LYS 25 N -0.02 0.72 -0.49 0.00 3.64 -1.36 -3.48 116.57 115.60 2yu7 h LYS 25 Ca 0.03 -0.23 0.00 0.00 -1.27 0.00 0.00 60.65 59.18 2yu7 h LYS 25 Cb 0.06 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 2yu7 h LYS 25 CO -0.07 0.81 0.00 0.41 -2.27 0.00 0.00 179.45 178.33 2yu7 n GLY 26 N -0.36 0.75 3.26 5.01 0.00 -1.10 -5.06 105.19 107.69 2yu7 n GLY 26 Ca -0.01 -0.72 -0.35 0.00 0.00 0.00 0.00 46.02 44.95 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 -4.20 3.24 0.55 1.61 0.41 -1.26 -5.10 118.70 113.95 2yu7 s GLU 27 Ca 0.00 -0.71 -0.19 0.00 -0.41 0.00 0.00 54.97 53.66 2yu7 s GLU 27 Cb 0.00 -2.91 -0.05 0.00 -1.78 0.00 0.00 34.13 29.38 2yu7 s GLU 27 CO 0.00 -0.22 1.13 -1.25 -0.49 0.00 0.00 175.26 174.42 2yu7 s PRO 28 N 1.42 3.31 -0.99 0.39 0.04 -1.26 -3.49 135.00 134.43 2yu7 s PRO 28 Ca 0.05 1.59 -0.01 0.00 0.04 0.00 0.00 61.00 62.67 2yu7 s PRO 28 Cb -0.14 -2.00 0.00 0.00 0.04 0.00 0.00 34.50 32.40 2yu7 s PRO 28 CO -0.06 -0.88 0.10 0.91 0.04 0.00 0.00 177.00 177.12 2yu7 n TRP 29 N -1.39 -0.74 -3.39 0.56 5.03 0.11 -4.75 117.44 112.87 2yu7 n TRP 29 Ca 0.11 0.09 -0.42 0.00 3.03 0.00 0.00 57.50 60.32 2yu7 n TRP 29 Cb 0.51 -2.80 -0.09 0.00 -1.03 0.00 0.00 31.31 27.89 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 -2.69 5.16 0.13 -0.99 2.01 -1.20 -1.47 115.64 116.61 2yu7 s THR 30 Ca 0.05 -0.19 0.04 0.00 0.31 0.00 0.00 61.69 61.91 2yu7 s THR 30 Cb -0.02 -3.89 -0.04 0.00 0.01 0.00 0.00 72.50 68.55 2yu7 s THR 30 CO 0.06 -0.22 0.12 0.72 -0.69 0.00 0.00 174.62 174.62 2yu7 s PHE 31 N 1.99 3.18 -0.19 4.92 -0.71 -0.72 -0.03 117.98 126.42 2yu7 s PHE 31 Ca 0.10 0.02 -0.12 0.00 -1.04 0.00 0.00 56.93 55.90 2yu7 s PHE 31 Cb -0.17 -1.56 0.06 0.00 -1.21 0.00 0.00 43.02 40.14 2yu7 s PHE 31 CO 0.12 0.52 0.47 -0.48 -1.34 0.00 0.00 175.22 174.51 2yu7 s LEU 32 N -2.85 -0.20 -0.11 -1.99 0.05 0.61 -0.63 118.68 113.56 2yu7 s LEU 32 Ca 0.30 1.01 -0.14 0.00 0.05 0.00 0.00 54.13 55.35 2yu7 s LEU 32 Cb -0.11 1.57 -0.05 0.00 -2.05 0.00 0.00 46.19 45.56 2yu7 s LEU 32 CO 0.23 -0.20 0.34 -0.69 -0.55 0.00 0.00 176.35 175.49 2yu7 s VAL 33 N 1.26 5.24 0.11 1.48 1.01 -1.11 -2.04 120.40 126.35 2yu7 s VAL 33 Ca -0.08 0.67 -0.04 0.00 0.00 0.00 0.00 61.98 62.53 2yu7 s VAL 33 Cb -0.07 -3.67 -0.03 0.00 0.00 0.00 0.00 36.38 32.61 2yu7 s VAL 33 CO -0.12 0.43 0.11 0.00 0.00 0.00 0.00 175.10 175.52 2yu7 s ARG 34 N 0.07 0.89 0.14 2.72 1.70 -1.04 -0.11 118.95 123.31 2yu7 s ARG 34 Ca 0.20 -1.24 -0.30 0.00 -0.47 0.00 0.00 55.73 53.92 2yu7 s ARG 34 Cb -0.14 0.28 -0.06 0.00 -0.57 0.00 0.00 34.95 34.46 2yu7 s ARG 34 CO 0.07 -0.26 0.99 -1.21 -1.08 0.00 0.00 175.30 173.81 2yu7 s GLU 35 N -3.97 4.69 0.74 3.89 2.02 -0.51 -1.30 118.70 124.27 2yu7 s GLU 35 Ca 0.15 1.52 -0.15 0.00 0.02 0.00 0.00 54.97 56.51 2yu7 s GLU 35 Cb 0.06 -3.35 0.04 0.00 0.10 0.00 0.00 34.13 30.99 2yu7 s GLU 35 CO -0.04 0.21 1.20 0.45 0.02 0.00 0.00 175.26 177.09 2yu7 s SER 36 N -0.12 4.16 -0.15 -0.19 0.15 -0.64 -4.25 113.70 112.65 2yu7 s SER 36 Ca 0.47 2.32 -0.13 0.00 0.70 0.00 0.00 55.95 59.30 2yu7 s SER 36 Cb -0.25 -2.58 -0.06 0.00 -1.71 0.00 0.00 66.02 61.41 2yu7 s SER 36 CO 0.31 -2.28 -0.28 0.18 1.20 0.00 0.00 173.24 172.37 2yu7 n LEU 37 N -2.82 1.70 0.07 3.45 7.99 -1.26 -4.72 117.00 121.41 2yu7 n LEU 37 Ca 0.13 0.28 -0.13 0.00 -0.01 0.00 0.00 56.01 56.29 2yu7 n LEU 37 Cb 0.50 -0.66 -0.08 0.00 -0.11 0.00 0.00 43.42 43.08 2yu7 n LEU 37 CO 0.48 -0.11 0.71 -1.28 -1.51 0.00 0.00 177.39 175.68 2yu7 h SER 38 N -0.79 -0.12 -3.33 -1.43 0.87 -1.99 -3.39 113.55 103.37 2yu7 h SER 38 Ca -0.18 -0.20 -0.67 0.00 -1.23 0.00 0.00 61.79 59.52 2yu7 h SER 38 Cb 1.02 0.03 -0.17 0.00 -0.44 0.00 0.00 62.40 62.84 2yu7 h SER 38 CO -0.11 0.13 0.14 -1.10 -0.53 0.00 0.00 176.83 175.36 2yu7 s GLN 39 N -5.23 3.19 -0.11 2.24 -1.52 -1.26 -5.03 119.66 111.94 2yu7 s GLN 39 Ca -0.15 -0.67 -0.29 0.00 -1.95 0.00 0.00 55.36 52.30 2yu7 s GLN 39 Cb 0.04 -4.05 -0.04 0.00 -0.22 0.00 0.00 33.01 28.73 2yu7 s GLN 39 CO 0.64 -1.21 1.54 -1.25 -0.25 0.00 0.00 175.29 174.76 2yu7 s PRO 40 N 2.87 4.13 0.00 2.91 0.04 -1.26 -2.98 135.00 140.70 2yu7 s PRO 40 Ca 0.19 1.95 0.00 0.00 0.04 0.00 0.00 61.00 63.18 2yu7 s PRO 40 Cb -0.17 -3.93 0.00 0.00 0.04 0.00 0.00 34.50 30.44 2yu7 s PRO 40 CO 0.15 -0.88 0.00 0.41 0.04 0.00 0.00 177.00 176.71 2yu7 n GLY 41 N 4.07 2.76 3.86 0.56 0.00 -1.26 -5.07 105.19 110.11 2yu7 n GLY 41 Ca 0.17 -0.82 -0.29 0.00 0.00 0.00 0.00 46.02 45.08 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 -0.03 3.83 0.23 1.61 1.01 -1.16 -4.84 116.67 117.34 2yu7 s ASP 42 Ca 0.00 0.73 0.05 0.00 0.71 0.00 0.00 52.55 54.05 2yu7 s ASP 42 Cb 0.00 -1.16 -0.05 0.00 1.01 0.00 0.00 42.92 42.72 2yu7 s ASP 42 CO 0.00 -2.32 -0.06 -0.36 0.21 0.00 0.00 175.17 172.64 2yu7 s PHE 43 N -3.53 1.69 -0.04 4.23 0.40 -0.80 -1.62 117.98 118.30 2yu7 s PHE 43 Ca 0.65 -0.77 0.06 0.00 -0.60 0.00 0.00 56.93 56.27 2yu7 s PHE 43 Cb -0.11 -0.93 -0.01 0.00 0.51 0.00 0.00 43.02 42.48 2yu7 s PHE 43 CO 0.51 0.15 -0.23 0.08 0.70 0.00 0.00 175.22 176.43 2yu7 s VAL 44 N -3.19 1.86 -0.45 -0.44 1.01 -0.42 0.27 120.40 119.04 2yu7 s VAL 44 Ca 0.26 -0.97 -0.10 0.00 0.00 0.00 0.00 61.98 61.17 2yu7 s VAL 44 Cb 0.04 -1.57 0.10 0.00 0.00 0.00 0.00 36.38 34.95 2yu7 s VAL 44 CO 0.09 0.52 0.31 -0.22 0.00 0.00 0.00 175.10 175.80 2yu7 s LEU 45 N -0.26 5.43 -0.02 3.92 1.98 0.19 -2.50 118.68 127.43 2yu7 s LEU 45 Ca 0.01 -1.67 -0.14 0.00 -2.89 0.00 0.00 54.13 49.44 2yu7 s LEU 45 Cb -0.12 -2.01 -0.05 0.00 0.66 0.00 0.00 46.19 44.67 2yu7 s LEU 45 CO 0.02 -0.62 0.38 -0.55 -1.89 0.00 0.00 176.35 173.69 2yu7 s SER 46 N 2.41 6.76 -0.08 3.68 0.15 -0.86 -1.08 113.70 124.67 2yu7 s SER 46 Ca 0.04 0.91 -0.05 0.00 0.70 0.00 0.00 55.95 57.55 2yu7 s SER 46 Cb -0.25 -2.23 0.04 0.00 -1.71 0.00 0.00 66.02 61.87 2yu7 s SER 46 CO 0.01 0.33 0.20 -0.69 1.20 0.00 0.00 173.24 174.29 2yu7 s VAL 47 N -1.03 -0.04 -0.21 4.45 1.01 -0.69 -0.29 120.40 123.60 2yu7 s VAL 47 Ca 0.23 0.13 -0.23 0.00 0.00 0.00 0.00 61.98 62.11 2yu7 s VAL 47 Cb -0.16 -0.31 -0.02 0.00 0.00 0.00 0.00 36.38 35.89 2yu7 s VAL 47 CO 0.12 0.05 0.72 -0.22 0.00 0.00 0.00 175.10 175.78 2yu7 s LEU 48 N 1.02 4.12 0.42 3.92 2.96 0.96 -1.45 118.68 130.64 2yu7 s LEU 48 Ca -0.08 0.94 -0.11 0.00 -0.22 0.00 0.00 54.13 54.67 2yu7 s LEU 48 Cb -0.09 -3.04 -0.06 0.00 0.50 0.00 0.00 46.19 43.50 2yu7 s LEU 48 CO -0.06 -0.37 0.80 -0.94 -1.32 0.00 0.00 176.35 174.45 2yu7 s SER 49 N 1.26 6.51 0.00 3.68 1.04 -0.12 0.09 113.70 126.16 2yu7 s SER 49 Ca 0.32 1.16 0.15 0.00 0.48 0.00 0.00 55.95 58.07 2yu7 s SER 49 Cb -0.16 -2.34 0.92 0.00 0.10 0.00 0.00 66.02 64.54 2yu7 s SER 49 CO 0.10 -0.44 1.58 -0.90 0.98 0.00 0.00 173.24 174.56 2yu7 n ASP 50 N -1.42 0.00 -4.53 7.02 5.75 -1.26 -4.18 116.55 117.93 2yu7 n ASP 50 Ca 0.03 -1.50 -0.37 0.00 -0.01 0.00 0.00 54.79 52.94 2yu7 n ASP 50 Cb 0.54 0.00 -0.12 0.00 -1.03 0.00 0.00 41.12 40.52 2yu7 n ASP 50 CO 0.00 0.00 0.00 -1.10 -0.11 0.00 0.00 177.20 175.99 2yu7 s GLN 51 N -2.00 3.83 0.63 0.11 -1.52 -1.26 -5.01 119.66 114.43 2yu7 s GLN 51 Ca 0.23 -0.39 -0.16 0.00 -1.95 0.00 0.00 55.36 53.09 2yu7 s GLN 51 Cb 0.11 -3.47 -0.02 0.00 -0.22 0.00 0.00 33.01 29.41 2yu7 s GLN 51 CO 0.18 -0.14 1.12 -1.25 -0.25 0.00 0.00 175.29 174.95 2yu7 s PRO 52 N 1.55 2.96 0.33 2.91 0.04 -1.26 -1.53 135.00 140.00 2yu7 s PRO 52 Ca 0.06 1.45 0.24 0.00 0.04 0.00 0.00 61.00 62.80 2yu7 s PRO 52 Cb -0.15 -1.97 0.56 0.00 0.04 0.00 0.00 34.50 32.98 2yu7 s PRO 52 CO 0.07 -1.13 1.68 1.57 0.04 0.00 0.00 177.00 179.23 2yu7 h LYS 53 N 0.36 0.00 -4.72 4.56 2.10 -1.70 -3.44 116.57 113.73 2yu7 h LYS 53 Ca -0.48 0.00 -0.25 0.00 -2.00 0.00 0.00 60.65 57.92 2yu7 h LYS 53 Cb 1.25 0.00 -0.15 0.00 -0.90 0.00 0.00 32.23 32.43 2yu7 h LYS 53 CO 0.55 0.00 -0.69 0.00 -2.00 0.00 0.00 179.45 177.31 2yu7 s ALA 54 N -3.16 1.12 0.05 0.07 0.00 -1.26 -5.08 121.76 113.51 2yu7 s ALA 54 Ca 0.09 -1.43 -0.36 0.00 0.00 0.00 0.00 51.96 50.25 2yu7 s ALA 54 Cb 0.08 0.27 -0.20 0.00 0.00 0.00 0.00 23.12 23.28 2yu7 s ALA 54 CO 0.64 -0.25 1.51 0.78 0.00 0.00 0.00 175.76 178.43 2yu7 h GLY 55 N 2.87 -1.37 -0.03 0.00 0.00 -1.98 -3.41 103.07 99.14 2yu7 h GLY 55 Ca -0.36 0.51 -0.01 0.00 0.00 0.00 0.00 47.33 47.47 2yu7 h GLY 55 CO 0.64 -0.50 0.00 -1.55 0.00 0.00 0.00 176.54 175.13 2yu7 n PRO 56 N -5.63 -1.10 -1.54 4.80 -0.04 -1.26 -4.75 135.00 125.49 2yu7 n PRO 56 Ca -0.16 -0.06 -0.16 0.00 -0.04 0.00 0.00 63.50 63.08 2yu7 n PRO 56 Cb 0.52 -0.06 -0.12 0.00 -0.04 0.00 0.00 33.50 33.80 2yu7 n PRO 56 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2yu7 n GLY 57 N 2.20 -0.26 3.35 0.55 0.00 -1.26 -4.87 105.19 104.90 2yu7 n GLY 57 Ca 0.01 0.21 -0.19 0.00 0.00 0.00 0.00 46.02 46.04 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 7.48 2.68 0.46 1.61 1.04 -1.26 -5.05 113.70 120.65 2yu7 s SER 58 Ca 1.04 -1.00 -0.23 0.00 0.48 0.00 0.00 55.95 56.24 2yu7 s SER 58 Cb -0.34 -0.15 -0.07 0.00 0.10 0.00 0.00 66.02 65.55 2yu7 s SER 58 CO 0.23 -0.13 1.17 -2.16 0.98 0.00 0.00 173.24 173.32 2yu7 s PRO 59 N -3.51 3.77 0.36 4.02 0.04 -1.26 -4.68 135.00 133.74 2yu7 s PRO 59 Ca 0.22 1.78 -0.28 0.00 0.04 0.00 0.00 61.00 62.76 2yu7 s PRO 59 Cb -0.02 -2.42 -0.10 0.00 0.04 0.00 0.00 34.50 32.00 2yu7 s PRO 59 CO 0.08 -0.54 1.33 -0.51 0.04 0.00 0.00 177.00 177.39 2yu7 s LEU 60 N -3.00 4.36 0.43 -3.56 1.02 -1.26 -2.14 118.68 114.52 2yu7 s LEU 60 Ca 0.63 2.72 -0.25 0.00 0.02 0.00 0.00 54.13 57.26 2yu7 s LEU 60 Cb -0.29 -3.72 -0.08 0.00 0.02 0.00 0.00 46.19 42.13 2yu7 s LEU 60 CO 0.35 -0.65 1.25 -0.60 0.02 0.00 0.00 176.35 176.71 2yu7 s ARG 61 N -1.94 3.87 0.12 1.70 6.06 -0.58 -4.80 118.95 123.38 2yu7 s ARG 61 Ca 0.51 2.00 0.06 0.00 -2.50 0.00 0.00 55.73 55.81 2yu7 s ARG 61 Cb -0.40 -2.62 -0.04 0.00 0.06 0.00 0.00 34.95 31.95 2yu7 s ARG 61 CO 0.53 -0.52 -0.02 0.08 -2.50 0.00 0.00 175.30 172.88 2yu7 s VAL 62 N -1.36 3.83 -0.09 7.11 1.01 -1.26 -0.94 120.40 128.70 2yu7 s VAL 62 Ca 0.59 -1.16 0.02 0.00 0.00 0.00 0.00 61.98 61.43 2yu7 s VAL 62 Cb -0.34 -2.85 0.01 0.00 0.00 0.00 0.00 36.38 33.20 2yu7 s VAL 62 CO 0.43 0.05 -0.14 -0.89 0.00 0.00 0.00 175.10 174.55 2yu7 s THR 63 N -1.42 1.37 -0.30 3.92 2.01 -0.53 -4.97 115.64 115.72 2yu7 s THR 63 Ca 0.26 -0.59 -0.07 0.00 0.31 0.00 0.00 61.69 61.59 2yu7 s THR 63 Cb -0.11 -1.25 0.01 0.00 0.01 0.00 0.00 72.50 71.17 2yu7 s THR 63 CO 0.18 0.41 0.10 -1.00 -0.69 0.00 0.00 174.62 173.62 2yu7 s HIS 64 N 0.79 3.16 -0.34 4.92 3.76 -1.26 -1.71 115.29 124.62 2yu7 s HIS 64 Ca -0.11 -0.95 -0.07 0.00 -0.15 0.00 0.00 55.06 53.78 2yu7 s HIS 64 Cb -0.16 -2.28 0.04 0.00 1.11 0.00 0.00 32.58 31.29 2yu7 s HIS 64 CO 0.02 -0.57 0.11 0.42 -0.85 0.00 0.00 174.74 173.86 2yu7 s ILE 65 N 1.51 3.81 -0.06 0.60 1.01 -0.24 -4.92 121.20 122.90 2yu7 s ILE 65 Ca 0.03 -1.11 -0.29 0.00 0.00 0.00 0.00 60.65 59.27 2yu7 s ILE 65 Cb -0.17 -3.15 -0.07 0.00 0.01 0.00 0.00 42.46 39.07 2yu7 s ILE 65 CO 0.03 -0.17 2.02 -0.54 0.00 0.00 0.00 174.94 176.28 2yu7 s LYS 66 N 1.41 3.80 -0.27 2.79 1.02 -1.26 -0.63 119.74 126.59 2yu7 s LYS 66 Ca -0.01 2.35 -0.11 0.00 0.02 0.00 0.00 55.97 58.22 2yu7 s LYS 66 Cb -0.19 -4.22 -0.05 0.00 -0.52 0.00 0.00 37.83 32.85 2yu7 s LYS 66 CO 0.03 -1.34 0.18 0.08 -0.92 0.00 0.00 175.35 173.37 2yu7 s VAL 67 N 5.73 5.23 -0.04 3.17 1.01 0.14 -4.74 120.40 130.89 2yu7 s VAL 67 Ca 0.91 0.14 -0.19 0.00 0.00 0.00 0.00 61.98 62.84 2yu7 s VAL 67 Cb -0.38 -3.48 -0.05 0.00 0.00 0.00 0.00 36.38 32.47 2yu7 s VAL 67 CO 0.38 0.27 0.53 -0.04 0.00 0.00 0.00 175.10 176.24 2yu7 s MET 68 N 1.65 4.27 -0.20 2.72 -1.94 0.63 -1.91 119.30 124.53 2yu7 s MET 68 Ca 0.07 0.59 0.01 0.00 -1.71 0.00 0.00 55.69 54.66 2yu7 s MET 68 Cb -0.16 -3.36 0.04 0.00 2.01 0.00 0.00 34.83 33.36 2yu7 s MET 68 CO 0.10 0.34 -0.14 0.00 -0.01 0.00 0.00 175.02 175.30 2yu7 n GLU 70 N 4.63 2.25 -3.18 0.00 1.02 -0.66 -4.83 120.64 119.86 2yu7 n GLU 70 Ca -0.17 -2.19 -0.11 0.00 -0.02 0.00 0.00 57.16 54.68 2yu7 n GLU 70 Cb 0.47 -2.00 0.01 0.00 -0.02 0.00 0.00 31.44 29.90 2yu7 n GLU 70 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2yu7 n GLY 71 N 0.63 -1.13 0.00 0.62 0.00 -1.26 -4.25 105.19 99.80 2yu7 n GLY 71 Ca 0.44 0.78 0.00 0.00 0.00 0.00 0.00 46.02 47.25 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 -1.19 1.61 3.52 -0.02 0.00 -1.26 -5.10 105.19 102.75 2yu7 n GLY 72 Ca -0.03 -0.33 -0.24 0.00 0.00 0.00 0.00 46.02 45.41 2yu7 n GLY 72 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2yu7 s ARG 73 N 0.00 1.77 0.02 1.61 1.70 -1.26 -4.36 118.95 118.43 2yu7 s ARG 73 Ca 0.00 -1.98 0.02 0.00 -0.47 0.00 0.00 55.73 53.30 2yu7 s ARG 73 Cb 0.00 -1.22 -0.02 0.00 -0.57 0.00 0.00 34.95 33.14 2yu7 s ARG 73 CO 0.00 -0.10 -0.07 0.71 -1.08 0.00 0.00 175.30 174.76 2yu7 s TYR 74 N -3.02 0.63 0.15 5.89 2.02 -0.89 -1.66 117.35 120.47 2yu7 s TYR 74 Ca 0.35 -0.33 -0.16 0.00 -0.37 0.00 0.00 57.07 56.56 2yu7 s TYR 74 Cb 0.08 -0.39 0.03 0.00 -0.40 0.00 0.00 41.96 41.29 2yu7 s TYR 74 CO 0.16 -0.05 0.42 -0.08 -1.57 0.00 0.00 175.55 174.44 2yu7 s THR 75 N -0.86 0.06 -0.19 -0.71 -1.32 0.12 -0.81 115.64 111.93 2yu7 s THR 75 Ca -0.05 -0.68 -0.04 0.00 -1.21 0.00 0.00 61.69 59.71 2yu7 s THR 75 Cb -0.07 -1.32 0.09 0.00 -1.51 0.00 0.00 72.50 69.69 2yu7 s THR 75 CO 0.00 -0.27 0.23 0.68 -2.21 0.00 0.00 174.62 173.06 2yu7 s VAL 76 N -3.83 -0.35 0.00 5.08 -7.23 -1.26 -0.27 120.40 112.54 2yu7 s VAL 76 Ca 0.05 -0.02 0.00 0.00 -1.81 0.00 0.00 61.98 60.20 2yu7 s VAL 76 Cb 0.01 -0.62 0.00 0.00 0.56 0.00 0.00 36.38 36.33 2yu7 s VAL 76 CO -0.09 -0.13 0.00 0.61 -0.31 0.00 0.00 175.10 175.18 2yu7 n GLY 77 N 5.33 1.13 0.96 2.32 0.00 -1.26 -4.84 105.19 108.82 2yu7 n GLY 77 Ca -0.05 -0.01 -0.05 0.00 0.00 0.00 0.00 46.02 45.91 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 1.50 0.15 -0.02 0.00 -1.26 -5.02 105.19 100.55 2yu7 n GLY 78 Ca 0.00 -2.09 0.08 0.00 0.00 0.00 0.00 46.02 44.01 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 -5.82 0.99 8.10 -1.99 -3.46 115.31 113.13 2yu7 h LEU 79 Ca -0.07 0.00 -0.31 0.00 0.11 0.00 0.00 57.88 57.61 2yu7 h LEU 79 Cb 0.30 0.00 -0.08 0.00 -0.44 0.00 0.00 40.66 40.45 2yu7 h LEU 79 CO 0.09 0.21 1.39 -1.84 -4.11 0.00 0.00 178.44 174.19 2yu7 n GLU 80 N -2.98 0.00 -3.45 0.17 0.28 -1.26 -4.81 120.64 108.58 2yu7 n GLU 80 Ca 0.00 0.00 -0.43 0.00 -0.16 0.00 0.00 57.16 56.57 2yu7 n GLU 80 Cb 0.63 -0.89 -0.07 0.00 1.43 0.00 0.00 31.44 32.54 2yu7 n GLU 80 CO 0.00 0.00 0.00 0.95 -0.16 0.00 0.00 177.13 177.92 2yu7 s THR 81 N 2.92 4.67 0.81 3.84 -4.23 -1.25 -3.96 115.64 118.44 2yu7 s THR 81 Ca 0.97 -1.58 -0.12 0.00 -1.18 0.00 0.00 61.69 59.79 2yu7 s THR 81 Cb -0.75 -4.00 0.08 0.00 1.34 0.00 0.00 72.50 69.17 2yu7 s THR 81 CO 0.39 -0.77 1.13 -0.36 -0.54 0.00 0.00 174.62 174.48 2yu7 s PHE 82 N 1.48 2.89 0.22 3.99 0.40 0.01 -4.72 117.98 122.24 2yu7 s PHE 82 Ca 0.04 0.93 0.00 0.00 -0.60 0.00 0.00 56.93 57.31 2yu7 s PHE 82 Cb -0.27 -3.30 0.19 0.00 0.51 0.00 0.00 43.02 40.15 2yu7 s PHE 82 CO 0.02 -1.81 1.54 -0.44 0.70 0.00 0.00 175.22 175.23 2yu7 h ASP 83 N -1.10 0.46 -2.74 1.36 3.32 -1.89 -2.38 116.42 113.45 2yu7 h ASP 83 Ca -0.47 -0.25 0.06 0.00 0.02 0.00 0.00 57.03 56.39 2yu7 h ASP 83 Cb 1.30 -0.13 -0.01 0.00 0.22 0.00 0.00 39.33 40.71 2yu7 h ASP 83 CO 0.63 0.92 0.41 -1.20 -1.72 0.00 0.00 179.24 178.29 2yu7 n SER 84 N -3.93 -2.01 -0.04 6.45 7.64 -1.26 -4.32 113.62 116.15 2yu7 n SER 84 Ca -0.03 -2.25 -0.01 0.00 1.01 0.00 0.00 58.87 57.59 2yu7 n SER 84 Cb 0.60 3.31 0.26 0.00 -1.01 0.00 0.00 64.21 67.37 2yu7 n SER 84 CO 0.00 0.00 0.00 -0.07 -3.01 0.00 0.00 175.04 171.96 2yu7 h LEU 85 N 0.00 0.58 -1.28 -3.43 -0.00 -1.95 -0.86 115.31 108.36 2yu7 h LEU 85 Ca -0.30 -0.11 0.03 0.00 -0.00 0.00 0.00 57.88 57.50 2yu7 h LEU 85 Cb 1.20 -0.15 -0.04 0.00 -0.00 0.00 0.00 40.66 41.66 2yu7 h LEU 85 CO 0.39 0.63 0.50 0.74 -0.00 0.00 0.00 178.44 180.69 2yu7 h THR 86 N 0.59 1.14 0.00 0.22 2.02 -1.97 0.44 112.91 115.35 2yu7 h THR 86 Ca 0.13 -0.33 -0.02 0.00 0.77 0.00 0.00 66.41 66.96 2yu7 h THR 86 Cb 0.32 0.10 -0.00 0.00 -1.74 0.00 0.00 68.15 66.84 2yu7 h THR 86 CO 0.01 0.17 -0.13 -0.78 0.37 0.00 0.00 175.52 175.16 2yu7 h ASP 87 N 0.95 0.00 -0.66 4.18 1.82 -1.85 -1.07 116.42 119.78 2yu7 h ASP 87 Ca 0.30 -0.69 0.05 0.00 -0.39 0.00 0.00 57.03 56.30 2yu7 h ASP 87 Cb 0.01 0.00 -0.04 0.00 0.68 0.00 0.00 39.33 39.98 2yu7 h ASP 87 CO -0.08 0.92 0.44 0.25 -1.61 0.00 0.00 179.24 179.16 2yu7 h LEU 88 N -1.00 0.61 0.08 2.28 6.46 -1.09 -1.56 115.31 121.08 2yu7 h LEU 88 Ca -0.03 -0.00 -0.10 0.00 -0.12 0.00 0.00 57.88 57.62 2yu7 h LEU 88 Cb 0.78 -0.13 0.01 0.00 -0.73 0.00 0.00 40.66 40.59 2yu7 h LEU 88 CO -0.02 0.40 -0.46 0.58 -0.62 0.00 0.00 178.44 178.32 2yu7 h VAL 89 N 0.70 1.63 -0.81 1.05 2.07 -0.24 -3.24 116.25 117.41 2yu7 h VAL 89 Ca 0.28 -2.45 0.16 0.00 0.82 0.00 0.00 66.70 65.51 2yu7 h VAL 89 Cb 0.21 3.28 -0.10 0.00 -1.52 0.00 0.00 31.29 33.16 2yu7 h VAL 89 CO -0.09 0.67 0.35 -0.33 0.02 0.00 0.00 177.57 178.19 2yu7 h GLU 90 N -0.66 0.46 -0.48 1.57 5.08 -0.90 0.31 114.58 119.97 2yu7 h GLU 90 Ca -0.08 -0.03 0.01 0.00 -1.00 0.00 0.00 59.36 58.26 2yu7 h GLU 90 Cb 1.35 -0.10 -0.02 0.00 0.50 0.00 0.00 28.75 30.48 2yu7 h GLU 90 CO 0.08 0.30 0.32 1.25 -1.00 0.00 0.00 179.01 179.96 2yu7 h HIS 91 N 0.47 0.60 0.00 4.33 2.76 -1.41 -2.03 115.15 119.87 2yu7 h HIS 91 Ca 0.46 0.01 -0.07 0.00 -2.20 0.00 0.00 60.37 58.57 2yu7 h HIS 91 Cb 0.73 -0.20 -0.01 0.00 1.55 0.00 0.00 27.41 29.47 2yu7 h HIS 91 CO -0.15 0.38 -0.34 0.74 -1.30 0.00 0.00 177.93 177.26 2yu7 h PHE 92 N 0.65 0.00 0.00 5.26 0.04 -1.12 -0.61 116.94 121.16 2yu7 h PHE 92 Ca 0.18 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.93 2yu7 h PHE 92 Cb -0.07 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.08 2yu7 h PHE 92 CO -0.04 0.34 -0.08 0.87 -0.60 0.00 0.00 178.31 178.80 2yu7 h LYS 93 N 0.00 0.00 0.00 1.51 1.57 0.30 1.04 116.57 120.99 2yu7 h LYS 93 Ca -0.00 0.00 -0.35 0.00 -1.87 0.00 0.00 60.65 58.43 2yu7 h LYS 93 Cb 0.82 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 33.08 2yu7 h LYS 93 CO 0.04 0.08 -2.23 0.36 -0.57 0.00 0.00 179.45 177.14 2yu7 n LYS 94 N -3.79 0.50 -0.07 3.15 2.85 -1.07 -4.61 118.16 115.12 2yu7 n LYS 94 Ca -0.02 0.17 -0.18 0.00 -1.05 0.00 0.00 58.31 57.22 2yu7 n LYS 94 Cb 0.18 -1.36 -0.13 0.00 -0.65 0.00 0.00 35.03 33.07 2yu7 n LYS 94 CO 0.00 0.00 0.00 1.79 -0.05 0.00 0.00 177.40 179.14 2yu7 h THR 95 N -0.40 1.33 0.00 0.58 1.35 -1.10 -3.51 112.91 111.15 2yu7 h THR 95 Ca -0.52 -2.29 0.00 0.00 -0.55 0.00 0.00 66.41 63.05 2yu7 h THR 95 Cb 1.61 2.82 0.00 0.00 -1.73 0.00 0.00 68.15 70.85 2yu7 h THR 95 CO -0.21 0.50 0.00 0.61 -0.25 0.00 0.00 175.52 176.17 2yu7 n GLY 96 N 1.55 2.27 3.72 5.82 0.00 0.36 -5.00 105.19 113.91 2yu7 n GLY 96 Ca -0.21 -1.79 -0.38 0.00 0.00 0.00 0.00 46.02 43.63 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 -2.31 5.17 -0.27 -0.61 1.01 -0.56 -4.83 121.20 118.79 2yu7 s ILE 97 Ca 0.00 1.01 -0.11 0.00 0.00 0.00 0.00 60.65 61.56 2yu7 s ILE 97 Cb 0.00 -3.85 -0.05 0.00 0.01 0.00 0.00 42.46 38.58 2yu7 s ILE 97 CO 0.00 0.30 0.17 -0.70 0.00 0.00 0.00 174.94 174.72 2yu7 s GLU 98 N 0.73 3.94 0.19 2.79 2.12 -1.26 -0.15 118.70 127.07 2yu7 s GLU 98 Ca 0.27 -0.33 -0.25 0.00 0.36 0.00 0.00 54.97 55.03 2yu7 s GLU 98 Cb -0.15 -3.61 -0.08 0.00 0.26 0.00 0.00 34.13 30.55 2yu7 s GLU 98 CO 0.11 -0.14 0.80 -1.21 -0.54 0.00 0.00 175.26 174.28 2yu7 s GLU 99 N 1.63 4.55 0.34 4.30 2.02 0.33 -4.93 118.70 126.93 2yu7 s GLU 99 Ca 0.07 1.16 0.12 0.00 0.02 0.00 0.00 54.97 56.34 2yu7 s GLU 99 Cb -0.16 -3.17 1.05 0.00 0.10 0.00 0.00 34.13 31.95 2yu7 s GLU 99 CO 0.09 0.52 1.61 0.00 0.02 0.00 0.00 175.26 177.50 2yu7 h ALA 100 N 4.09 1.75 -0.98 5.21 0.00 -1.98 0.97 119.26 128.32 2yu7 h ALA 100 Ca -0.47 0.26 0.07 0.00 0.00 0.00 0.00 54.91 54.77 2yu7 h ALA 100 Cb 1.20 0.35 -0.07 0.00 0.00 0.00 0.00 17.79 19.28 2yu7 h ALA 100 CO 0.66 -0.71 0.63 1.03 0.00 0.00 0.00 179.25 180.87 2yu7 h SER 101 N 0.11 1.01 0.00 0.00 0.87 -2.04 -3.45 113.55 110.04 2yu7 h SER 101 Ca 0.72 0.01 0.00 0.00 -1.23 0.00 0.00 61.79 61.29 2yu7 h SER 101 Cb 1.71 -0.21 0.00 0.00 -0.44 0.00 0.00 62.40 63.46 2yu7 h SER 101 CO -0.75 0.64 0.00 0.61 -0.53 0.00 0.00 176.83 176.80 2yu7 n GLY 102 N -1.37 0.89 3.95 5.77 0.00 0.33 -5.15 105.19 109.61 2yu7 n GLY 102 Ca 0.15 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.94 2yu7 n GLY 102 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2yu7 s ALA 103 N -1.08 3.72 -0.17 4.61 0.00 -1.20 -4.85 121.76 122.80 2yu7 s ALA 103 Ca 0.00 -1.05 -0.02 0.00 0.00 0.00 0.00 51.96 50.89 2yu7 s ALA 103 Cb 0.00 -2.18 0.05 0.00 0.00 0.00 0.00 23.12 20.99 2yu7 s ALA 103 CO 0.00 -0.48 -0.01 -0.06 0.00 0.00 0.00 175.76 175.22 2yu7 s PHE 104 N -2.63 1.30 -0.17 0.00 0.08 -1.26 -0.51 117.98 114.79 2yu7 s PHE 104 Ca 0.50 -0.89 -0.18 0.00 0.12 0.00 0.00 56.93 56.48 2yu7 s PHE 104 Cb -0.10 -1.13 -0.04 0.00 -0.57 0.00 0.00 43.02 41.18 2yu7 s PHE 104 CO 0.39 -0.58 0.48 0.08 -0.10 0.00 0.00 175.22 175.49 2yu7 s VAL 105 N 1.76 5.16 -0.19 -0.44 1.01 0.79 -4.90 120.40 123.59 2yu7 s VAL 105 Ca 0.00 0.91 -0.04 0.00 0.00 0.00 0.00 61.98 62.85 2yu7 s VAL 105 Cb -0.16 -3.81 -0.02 0.00 0.00 0.00 0.00 36.38 32.39 2yu7 s VAL 105 CO -0.07 0.25 -0.02 -0.31 0.00 0.00 0.00 175.10 174.95 2yu7 s TYR 106 N 1.14 3.01 -0.38 5.22 2.02 -1.26 -1.50 117.35 125.61 2yu7 s TYR 106 Ca 0.24 -0.51 -0.09 0.00 -0.37 0.00 0.00 57.07 56.34 2yu7 s TYR 106 Cb -0.15 -2.05 0.05 0.00 -0.40 0.00 0.00 41.96 39.41 2yu7 s TYR 106 CO 0.09 -0.24 0.19 -0.51 -1.57 0.00 0.00 175.55 173.51 2yu7 s LEU 107 N 0.91 4.72 0.00 -1.29 1.02 -1.26 -4.31 118.68 118.47 2yu7 s LEU 107 Ca 0.00 -1.21 0.00 0.00 0.02 0.00 0.00 54.13 52.94 2yu7 s LEU 107 Cb -0.14 -1.96 0.00 0.00 0.02 0.00 0.00 46.19 44.11 2yu7 s LEU 107 CO 0.02 -0.41 0.00 0.54 0.02 0.00 0.00 176.35 176.51 2yu7 n ARG 108 N 4.91 2.50 -3.50 1.70 1.74 -0.54 -4.49 116.66 118.98 2yu7 n ARG 108 Ca -0.11 0.00 -0.42 0.00 -0.77 0.00 0.00 57.85 56.54 2yu7 n ARG 108 Cb 0.45 -0.86 -0.06 0.00 -1.02 0.00 0.00 32.46 30.97 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 -1.71 2.89 -1.05 5.56 -0.21 -0.77 -5.01 119.66 119.35 2yu7 s GLN 109 Ca 0.00 -2.16 -0.24 0.00 0.02 0.00 0.00 55.36 52.99 2yu7 s GLN 109 Cb 0.00 -4.07 -0.07 0.00 1.00 0.00 0.00 33.01 29.87 2yu7 s GLN 109 CO 0.00 -1.23 1.94 -1.25 -2.12 0.00 0.00 175.29 172.62 2yu7 s PRO 110 N 0.68 2.53 -0.75 2.91 0.04 -1.26 -1.75 135.00 137.41 2yu7 s PRO 110 Ca 0.12 -0.77 -0.36 0.00 0.04 0.00 0.00 61.00 60.03 2yu7 s PRO 110 Cb -0.20 -5.16 -0.20 0.00 0.04 0.00 0.00 34.50 28.98 2yu7 s PRO 110 CO -0.03 -3.69 2.44 0.98 0.04 0.00 0.00 177.00 176.73 2yu7 n TYR 111 N 14.16 0.89 -1.24 0.56 9.36 0.20 -4.55 117.16 136.54 2yu7 n TYR 111 Ca 0.43 0.51 -0.30 0.00 3.32 0.00 0.00 57.90 61.85 2yu7 n TYR 111 Cb 0.47 -2.37 0.12 0.00 -0.63 0.00 0.00 39.34 36.93 2yu7 n TYR 111 CO 0.00 0.00 0.00 0.71 0.22 0.00 0.00 176.86 177.79 2yu7 s TYR 112 N 7.90 2.42 0.31 2.98 2.02 -1.26 -4.42 117.35 127.31 2yu7 s TYR 112 Ca 1.27 1.33 0.00 0.00 -0.37 0.00 0.00 57.07 59.30 2yu7 s TYR 112 Cb -1.28 -3.13 0.53 0.00 -0.40 0.00 0.00 41.96 37.69 2yu7 s TYR 112 CO 0.54 -2.19 1.94 0.77 -1.57 0.00 0.00 175.55 175.05 2yu7 h SER 113 N -1.40 0.88 -3.39 2.29 0.02 -1.79 -3.43 113.55 106.73 2yu7 h SER 113 Ca -0.48 -0.01 -0.57 0.00 -0.84 0.00 0.00 61.79 59.90 2yu7 h SER 113 Cb 1.27 -0.20 0.14 0.00 0.14 0.00 0.00 62.40 63.75 2yu7 h SER 113 CO 0.54 0.60 0.27 0.61 -1.14 0.00 0.00 176.83 177.70 2yu7 n GLY 114 N -1.41 0.02 0.00 -3.77 0.00 -1.26 -5.00 105.19 93.77 2yu7 n GLY 114 Ca 0.11 0.07 0.00 0.00 0.00 0.00 0.00 46.02 46.20 2yu7 n GLY 114 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2yu7 n PRO 115 N -0.27 -0.80 -0.01 1.61 -0.04 -1.26 -5.06 135.00 129.17 2yu7 n PRO 115 Ca 0.10 0.00 -0.04 0.00 -0.04 0.00 0.00 63.50 63.52 2yu7 n PRO 115 Cb 0.42 0.00 -0.01 0.00 -0.04 0.00 0.00 33.50 33.86 2yu7 n PRO 115 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2yu7 n SER 116 N -2.67 0.68 -4.90 3.54 7.64 -1.26 -5.06 113.62 111.59 2yu7 n SER 116 Ca 0.00 0.10 -0.29 0.00 1.01 0.00 0.00 58.87 59.69 2yu7 n SER 116 Cb 0.00 -0.24 0.06 0.00 -1.01 0.00 0.00 64.21 63.01 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 -5.65 5.19 0.00 6.43 0.01 -1.26 -5.09 113.70 113.33 2yu7 s SER 117 Ca -0.07 0.90 0.00 0.00 1.31 0.00 0.00 55.95 58.10 2yu7 s SER 117 Cb 0.02 -1.65 0.00 0.00 0.21 0.00 0.00 66.02 64.60 2yu7 s SER 117 CO 0.09 -1.45 0.00 0.61 0.41 0.00 0.00 173.24 172.90