#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 6.74 -0.56 1.61 0.15 -1.26 -4.86 113.70 115.52 2yu7 s SER 2 Ca 0.00 -2.34 -0.02 0.00 0.70 0.00 0.00 55.95 54.29 2yu7 s SER 2 Cb 0.00 -2.36 0.38 0.00 -1.71 0.00 0.00 66.02 62.33 2yu7 s SER 2 CO 0.00 -0.91 2.03 -0.24 1.20 0.00 0.00 173.24 175.32 2yu7 n SER 3 N 5.86 7.33 0.00 5.45 2.88 -1.26 -4.92 113.62 128.96 2yu7 n SER 3 Ca 0.24 -3.57 0.00 0.00 -1.33 0.00 0.00 58.87 54.21 2yu7 n SER 3 Cb 0.48 -1.00 0.00 0.00 -0.75 0.00 0.00 64.21 62.93 2yu7 n SER 3 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2yu7 n GLY 4 N -0.55 -0.18 2.84 0.46 0.00 -1.26 -5.04 105.19 101.46 2yu7 n GLY 4 Ca 0.53 -1.12 -0.29 0.00 0.00 0.00 0.00 46.02 45.15 2yu7 n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yu7 s SER 5 N -1.24 3.26 0.19 1.61 0.01 -1.26 -5.02 113.70 111.26 2yu7 s SER 5 Ca 0.00 -0.93 -0.12 0.00 1.31 0.00 0.00 55.95 56.21 2yu7 s SER 5 Cb 0.00 -0.87 0.24 0.00 0.21 0.00 0.00 66.02 65.59 2yu7 s SER 5 CO 0.00 -0.26 1.21 -0.24 0.41 0.00 0.00 173.24 174.36 2yu7 n SER 6 N 4.87 -0.44 0.00 2.44 2.88 -1.26 -4.87 113.62 117.24 2yu7 n SER 6 Ca -0.11 1.36 0.00 0.00 -1.33 0.00 0.00 58.87 58.79 2yu7 n SER 6 Cb 0.46 -0.34 0.00 0.00 -0.75 0.00 0.00 64.21 63.58 2yu7 n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2yu7 n GLY 7 N -1.40 0.93 1.02 0.46 0.00 -1.26 -4.15 105.19 100.79 2yu7 n GLY 7 Ca 0.09 -1.25 0.10 0.00 0.00 0.00 0.00 46.02 44.96 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 0.68 -3.11 1.61 4.27 -1.26 -4.06 117.44 115.57 2yu7 n TRP 8 Ca 0.00 -0.34 -0.40 0.00 -3.89 0.00 0.00 57.50 52.87 2yu7 n TRP 8 Cb 0.00 0.00 -0.05 0.00 -1.36 0.00 0.00 31.31 29.90 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 -1.32 3.50 0.00 -2.67 5.04 -1.26 -2.71 117.35 117.94 2yu7 s TYR 9 Ca 0.38 1.09 0.00 0.00 -2.44 0.00 0.00 57.07 56.10 2yu7 s TYR 9 Cb 0.20 -2.77 0.00 0.00 0.35 0.00 0.00 41.96 39.74 2yu7 s TYR 9 CO 0.27 0.02 0.00 0.72 -1.34 0.00 0.00 175.55 175.21 2yu7 n HIS 10 N 4.17 0.00 0.00 4.97 8.25 -0.81 -4.23 115.22 127.58 2yu7 n HIS 10 Ca -0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.44 2yu7 n HIS 10 Cb 0.51 -0.06 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 2.06 -0.03 3.54 -1.41 0.00 -1.26 -4.95 105.19 103.14 2yu7 n GLY 11 Ca 0.00 -0.35 -0.42 0.00 0.00 0.00 0.00 46.02 45.25 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 3.12 -0.18 1.61 2.46 -1.26 -0.94 115.29 120.09 2yu7 s HIS 12 Ca 0.00 0.11 -0.29 0.00 0.47 0.00 0.00 55.06 55.35 2yu7 s HIS 12 Cb 0.00 -3.19 0.12 0.00 -0.13 0.00 0.00 32.58 29.37 2yu7 s HIS 12 CO 0.00 -0.73 0.96 1.41 -2.47 0.00 0.00 174.74 173.91 2yu7 s MET 13 N 2.69 0.64 0.05 2.88 0.00 -1.26 -5.02 119.30 119.28 2yu7 s MET 13 Ca 0.22 0.31 0.02 0.00 0.00 0.00 0.00 55.69 56.25 2yu7 s MET 13 Cb -0.15 0.30 -0.04 0.00 0.00 0.00 0.00 34.83 34.95 2yu7 s MET 13 CO 0.16 -0.17 0.08 -1.54 0.00 0.00 0.00 175.02 173.56 2yu7 s SER 14 N -0.70 5.59 0.52 1.11 1.04 -1.26 -4.71 113.70 115.29 2yu7 s SER 14 Ca -0.01 0.05 0.44 0.00 0.48 0.00 0.00 55.95 56.90 2yu7 s SER 14 Cb -0.02 -1.54 1.65 0.00 0.10 0.00 0.00 66.02 66.21 2yu7 s SER 14 CO 0.00 0.20 1.59 1.23 0.98 0.00 0.00 173.24 177.25 2yu7 h GLY 15 N 3.55 0.48 0.74 7.32 0.00 -1.98 0.72 103.07 113.91 2yu7 h GLY 15 Ca -0.47 -0.03 0.06 0.00 0.00 0.00 0.00 47.33 46.88 2yu7 h GLY 15 CO 0.65 -0.17 0.60 -1.33 0.00 0.00 0.00 176.54 176.29 2yu7 h GLY 16 N 0.01 1.42 1.32 4.60 0.00 -2.01 -1.05 103.07 107.35 2yu7 h GLY 16 Ca 0.91 -0.44 -0.28 0.00 0.00 0.00 0.00 47.33 47.52 2yu7 h GLY 16 CO -0.17 0.31 -1.48 -1.61 0.00 0.00 0.00 176.54 173.60 2yu7 h GLN 17 N 1.09 0.09 0.03 4.80 5.75 0.05 -3.35 115.11 123.56 2yu7 h GLN 17 Ca 0.40 -0.15 -0.00 0.00 -0.15 0.00 0.00 58.65 58.76 2yu7 h GLN 17 Cb 0.16 0.06 -0.00 0.00 1.07 0.00 0.00 27.48 28.76 2yu7 h GLN 17 CO -0.17 0.85 -0.02 0.00 -2.65 0.00 0.00 178.83 176.84 2yu7 h ALA 18 N 0.80 -0.04 -0.64 3.38 0.00 -0.97 -2.44 119.26 119.36 2yu7 h ALA 18 Ca -0.20 -0.01 0.13 0.00 0.00 0.00 0.00 54.91 54.83 2yu7 h ALA 18 Cb 1.95 0.02 -0.10 0.00 0.00 0.00 0.00 17.79 19.67 2yu7 h ALA 18 CO 0.12 -0.53 0.11 0.93 0.00 0.00 0.00 179.25 179.88 2yu7 h GLU 19 N -0.05 0.22 -0.93 0.00 5.08 -1.35 0.31 114.58 117.85 2yu7 h GLU 19 Ca -0.00 -0.01 0.03 0.00 -1.00 0.00 0.00 59.36 58.38 2yu7 h GLU 19 Cb 0.04 -0.05 -0.05 0.00 0.50 0.00 0.00 28.75 29.19 2yu7 h GLU 19 CO -0.00 0.15 0.61 1.15 -1.00 0.00 0.00 179.01 179.92 2yu7 h THR 20 N 0.23 1.18 0.09 1.13 2.02 -1.63 -1.36 112.91 114.57 2yu7 h THR 20 Ca 0.34 -0.41 -0.00 0.00 0.77 0.00 0.00 66.41 67.11 2yu7 h THR 20 Cb 0.54 -0.12 0.00 0.00 -1.74 0.00 0.00 68.15 66.83 2yu7 h THR 20 CO -0.46 0.22 -0.04 -0.07 0.37 0.00 0.00 175.52 175.54 2yu7 h LEU 21 N 1.20 -0.10 -0.99 2.58 3.38 -0.48 -1.15 115.31 119.75 2yu7 h LEU 21 Ca 0.36 0.00 0.28 0.00 0.09 0.00 0.00 57.88 58.62 2yu7 h LEU 21 Cb -0.03 0.03 -0.18 0.00 0.09 0.00 0.00 40.66 40.57 2yu7 h LEU 21 CO -0.10 0.03 0.06 0.18 0.09 0.00 0.00 178.44 178.69 2yu7 n LEU 22 N -2.86 -0.08 0.11 1.67 4.77 0.87 0.21 117.00 121.68 2yu7 n LEU 22 Ca -0.01 1.67 -0.04 0.00 -0.03 0.00 0.00 56.01 57.60 2yu7 n LEU 22 Cb 0.05 -0.63 0.13 0.00 -2.33 0.00 0.00 43.42 40.64 2yu7 n LEU 22 CO 0.03 -1.71 0.47 1.56 -1.33 0.00 0.00 177.39 176.41 2yu7 h GLN 23 N 0.00 0.13 -0.40 3.23 4.20 -1.35 -3.16 115.11 117.76 2yu7 h GLN 23 Ca 0.62 -0.09 0.05 0.00 0.06 0.00 0.00 58.65 59.28 2yu7 h GLN 23 Cb 1.31 0.02 -0.05 0.00 0.30 0.00 0.00 27.48 29.06 2yu7 h GLN 23 CO -0.92 0.72 0.12 0.00 -0.67 0.00 0.00 178.83 178.08 2yu7 h ALA 24 N 1.26 0.45 -0.49 3.87 0.00 0.39 -2.41 119.26 122.33 2yu7 h ALA 24 Ca -0.01 0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 2yu7 h ALA 24 Cb 1.13 0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.95 2yu7 h ALA 24 CO 0.09 -0.27 0.23 -0.22 0.00 0.00 0.00 179.25 179.07 2yu7 h LYS 25 N 0.27 0.71 0.00 0.00 3.64 -1.38 -3.47 116.57 116.34 2yu7 h LYS 25 Ca 0.19 -0.11 0.00 0.00 -1.27 0.00 0.00 60.65 59.46 2yu7 h LYS 25 Cb 0.19 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 31.88 2yu7 h LYS 25 CO -0.21 0.60 0.00 0.41 -2.27 0.00 0.00 179.45 177.99 2yu7 n GLY 26 N -0.88 0.61 3.41 5.01 0.00 -0.91 -5.05 105.19 107.38 2yu7 n GLY 26 Ca 0.02 -0.78 -0.38 0.00 0.00 0.00 0.00 46.02 44.87 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 -2.89 3.31 0.50 1.61 2.02 -1.26 -5.09 118.70 116.90 2yu7 s GLU 27 Ca 0.00 -0.73 -0.21 0.00 0.02 0.00 0.00 54.97 54.05 2yu7 s GLU 27 Cb 0.00 -3.48 -0.07 0.00 0.10 0.00 0.00 34.13 30.68 2yu7 s GLU 27 CO 0.00 -0.39 1.15 -1.25 0.02 0.00 0.00 175.26 174.78 2yu7 s PRO 28 N 1.58 3.58 -1.12 0.39 0.04 -1.26 -3.37 135.00 134.83 2yu7 s PRO 28 Ca 0.04 1.69 -0.01 0.00 0.04 0.00 0.00 61.00 62.77 2yu7 s PRO 28 Cb -0.17 -2.22 0.00 0.00 0.04 0.00 0.00 34.50 32.15 2yu7 s PRO 28 CO 0.05 -0.68 0.12 0.91 0.04 0.00 0.00 177.00 177.44 2yu7 n TRP 29 N -0.86 -0.84 -3.25 0.56 5.03 0.33 -4.73 117.44 113.68 2yu7 n TRP 29 Ca 0.09 0.10 -0.41 0.00 3.03 0.00 0.00 57.50 60.32 2yu7 n TRP 29 Cb 0.49 -3.05 -0.08 0.00 -1.03 0.00 0.00 31.31 27.64 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 -2.76 5.04 0.15 -0.99 2.01 -1.12 -1.49 115.64 116.48 2yu7 s THR 30 Ca 0.06 0.47 0.05 0.00 0.31 0.00 0.00 61.69 62.58 2yu7 s THR 30 Cb -0.03 -3.91 -0.04 0.00 0.01 0.00 0.00 72.50 68.53 2yu7 s THR 30 CO 0.07 -0.12 0.13 0.72 -0.69 0.00 0.00 174.62 174.74 2yu7 s PHE 31 N 2.35 3.17 -0.18 4.92 -0.71 -0.50 0.12 117.98 127.16 2yu7 s PHE 31 Ca 0.19 0.00 -0.19 0.00 -1.04 0.00 0.00 56.93 55.89 2yu7 s PHE 31 Cb -0.15 -1.54 0.05 0.00 -1.21 0.00 0.00 43.02 40.17 2yu7 s PHE 31 CO 0.12 0.52 0.53 -0.48 -1.34 0.00 0.00 175.22 174.57 2yu7 s LEU 32 N -2.99 -0.01 -0.10 -1.99 0.05 0.93 -0.00 118.68 114.56 2yu7 s LEU 32 Ca 0.31 0.99 -0.00 0.00 0.05 0.00 0.00 54.13 55.48 2yu7 s LEU 32 Cb -0.10 1.83 -0.03 0.00 -2.05 0.00 0.00 46.19 45.84 2yu7 s LEU 32 CO 0.23 -0.22 -0.08 -0.69 -0.55 0.00 0.00 176.35 175.04 2yu7 s VAL 33 N 0.11 3.55 0.30 1.48 1.01 -1.10 -1.63 120.40 124.12 2yu7 s VAL 33 Ca -0.01 -0.51 -0.04 0.00 0.00 0.00 0.00 61.98 61.41 2yu7 s VAL 33 Cb -0.04 -2.48 -0.01 0.00 0.00 0.00 0.00 36.38 33.86 2yu7 s VAL 33 CO 0.01 0.56 0.42 0.00 0.00 0.00 0.00 175.10 176.09 2yu7 s ARG 34 N -0.28 1.73 0.42 2.72 1.70 -1.12 -1.93 118.95 122.19 2yu7 s ARG 34 Ca 0.03 -1.63 -0.17 0.00 -0.47 0.00 0.00 55.73 53.50 2yu7 s ARG 34 Cb -0.13 0.42 -0.09 0.00 -0.57 0.00 0.00 34.95 34.59 2yu7 s ARG 34 CO 0.03 -0.70 0.87 -1.21 -1.08 0.00 0.00 175.30 173.21 2yu7 s GLU 35 N -3.44 4.03 0.82 3.89 0.41 -0.12 -1.45 118.70 122.84 2yu7 s GLU 35 Ca 0.30 0.86 -0.09 0.00 -0.41 0.00 0.00 54.97 55.63 2yu7 s GLU 35 Cb 0.01 -2.27 0.14 0.00 -1.78 0.00 0.00 34.13 30.23 2yu7 s GLU 35 CO 0.17 -0.04 1.14 -1.12 -0.49 0.00 0.00 175.26 174.92 2yu7 s SER 36 N -2.58 3.93 0.07 -0.19 0.01 -1.06 -4.39 113.70 109.48 2yu7 s SER 36 Ca 0.57 0.09 0.00 0.00 1.31 0.00 0.00 55.95 57.92 2yu7 s SER 36 Cb -0.10 -0.38 0.00 0.00 0.21 0.00 0.00 66.02 65.75 2yu7 s SER 36 CO 0.22 -2.18 0.00 0.18 0.41 0.00 0.00 173.24 171.87 2yu7 n LEU 37 N -3.25 0.79 -0.27 2.44 4.77 -1.26 -4.80 117.00 115.43 2yu7 n LEU 37 Ca 0.14 0.10 0.05 0.00 -0.03 0.00 0.00 56.01 56.27 2yu7 n LEU 37 Cb 0.60 -0.24 0.19 0.00 -2.33 0.00 0.00 43.42 41.65 2yu7 n LEU 37 CO 0.46 -0.69 1.05 0.28 -1.33 0.00 0.00 177.39 177.17 2yu7 h SER 38 N 0.00 0.39 -3.50 -1.43 0.02 -2.01 -3.37 113.55 103.64 2yu7 h SER 38 Ca 0.00 0.10 -0.66 0.00 -0.84 0.00 0.00 61.79 60.39 2yu7 h SER 38 Cb 0.00 0.05 -0.27 0.00 0.14 0.00 0.00 62.40 62.32 2yu7 h SER 38 CO 0.00 0.16 -0.69 -1.10 -1.14 0.00 0.00 176.83 174.06 2yu7 s GLN 39 N -6.01 3.29 -0.09 3.45 -1.52 -1.26 -5.08 119.66 112.45 2yu7 s GLN 39 Ca -0.12 -0.69 -0.30 0.00 -1.95 0.00 0.00 55.36 52.30 2yu7 s GLN 39 Cb 0.21 -3.14 -0.04 0.00 -0.22 0.00 0.00 33.01 29.81 2yu7 s GLN 39 CO 0.77 -0.28 1.52 -1.25 -0.25 0.00 0.00 175.29 175.80 2yu7 s PRO 40 N 1.49 4.20 0.00 2.91 0.04 -1.26 -3.24 135.00 139.14 2yu7 s PRO 40 Ca 0.04 2.01 0.00 0.00 0.04 0.00 0.00 61.00 63.10 2yu7 s PRO 40 Cb -0.15 -3.91 0.00 0.00 0.04 0.00 0.00 34.50 30.48 2yu7 s PRO 40 CO -0.01 -0.80 0.00 0.41 0.04 0.00 0.00 177.00 176.64 2yu7 n GLY 41 N 3.96 3.10 3.01 0.56 0.00 -1.26 -5.06 105.19 109.50 2yu7 n GLY 41 Ca 0.16 -0.88 -0.18 0.00 0.00 0.00 0.00 46.02 45.12 2yu7 n GLY 41 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2yu7 n ASP 42 N 1.09 -2.97 -4.18 1.61 9.92 -1.20 -4.77 116.55 116.05 2yu7 n ASP 42 Ca 0.00 -0.37 -0.11 0.00 -0.53 0.00 0.00 54.79 53.78 2yu7 n ASP 42 Cb 0.00 -0.76 -0.10 0.00 -0.64 0.00 0.00 41.12 39.62 2yu7 n ASP 42 CO 0.00 0.00 0.00 -0.36 0.13 0.00 0.00 177.20 176.97 2yu7 s PHE 43 N -2.07 0.94 -0.13 1.24 0.40 -0.83 -2.56 117.98 114.96 2yu7 s PHE 43 Ca 0.36 -1.08 0.00 0.00 -0.60 0.00 0.00 56.93 55.61 2yu7 s PHE 43 Cb -0.06 -0.55 0.02 0.00 0.51 0.00 0.00 43.02 42.94 2yu7 s PHE 43 CO 0.34 -0.33 -0.12 0.08 0.70 0.00 0.00 175.22 175.89 2yu7 s VAL 44 N -3.82 1.39 -0.53 -0.44 1.01 -0.53 -0.35 120.40 117.14 2yu7 s VAL 44 Ca 0.19 -0.52 -0.18 0.00 0.00 0.00 0.00 61.98 61.47 2yu7 s VAL 44 Cb 0.07 -1.33 0.08 0.00 0.00 0.00 0.00 36.38 35.19 2yu7 s VAL 44 CO -0.00 0.43 0.60 -0.22 0.00 0.00 0.00 175.10 175.91 2yu7 s LEU 45 N 1.52 5.25 -0.17 3.92 1.98 -1.02 -2.80 118.68 127.36 2yu7 s LEU 45 Ca 0.04 -1.17 -0.08 0.00 -2.89 0.00 0.00 54.13 50.03 2yu7 s LEU 45 Cb -0.13 -2.35 -0.04 0.00 0.66 0.00 0.00 46.19 44.32 2yu7 s LEU 45 CO -0.09 -0.91 0.11 -0.44 -1.89 0.00 0.00 176.35 173.13 2yu7 s SER 46 N 2.98 6.07 -0.01 3.68 0.01 -0.65 -0.53 113.70 125.25 2yu7 s SER 46 Ca 0.12 0.25 0.01 0.00 1.31 0.00 0.00 55.95 57.64 2yu7 s SER 46 Cb -0.22 -2.02 0.01 0.00 0.21 0.00 0.00 66.02 63.99 2yu7 s SER 46 CO 0.09 0.25 -0.03 -0.69 0.41 0.00 0.00 173.24 173.27 2yu7 s VAL 47 N -0.06 0.28 -0.24 3.43 1.01 -0.75 -0.05 120.40 124.02 2yu7 s VAL 47 Ca 0.09 -0.10 -0.15 0.00 0.00 0.00 0.00 61.98 61.81 2yu7 s VAL 47 Cb -0.12 -0.27 -0.04 0.00 0.00 0.00 0.00 36.38 35.95 2yu7 s VAL 47 CO 0.00 0.10 0.38 -0.22 0.00 0.00 0.00 175.10 175.37 2yu7 s LEU 48 N 0.21 4.10 0.64 3.92 2.96 0.12 -1.31 118.68 129.31 2yu7 s LEU 48 Ca -0.02 0.40 -0.10 0.00 -0.22 0.00 0.00 54.13 54.19 2yu7 s LEU 48 Cb -0.05 -2.46 -0.01 0.00 0.50 0.00 0.00 46.19 44.17 2yu7 s LEU 48 CO -0.00 -0.13 1.02 -0.94 -1.32 0.00 0.00 176.35 174.98 2yu7 s SER 49 N 1.32 5.87 -0.07 3.68 1.04 -0.43 0.12 113.70 125.23 2yu7 s SER 49 Ca 0.17 1.19 0.08 0.00 0.48 0.00 0.00 55.95 57.87 2yu7 s SER 49 Cb -0.15 -2.16 0.35 0.00 0.10 0.00 0.00 66.02 64.15 2yu7 s SER 49 CO 0.09 -1.04 1.13 -0.67 0.98 0.00 0.00 173.24 173.73 2yu7 n ASP 50 N -2.79 2.66 -4.23 7.02 2.03 -1.26 -4.41 116.55 115.56 2yu7 n ASP 50 Ca 0.06 -2.27 -0.32 0.00 0.52 0.00 0.00 54.79 52.78 2yu7 n ASP 50 Cb 0.56 -0.45 -0.16 0.00 -0.72 0.00 0.00 41.12 40.34 2yu7 n ASP 50 CO 0.00 0.00 0.00 -1.10 -1.92 0.00 0.00 177.20 174.18 2yu7 s GLN 51 N -1.71 3.11 0.55 -0.67 -1.52 -1.26 -5.06 119.66 113.10 2yu7 s GLN 51 Ca 0.24 -0.83 -0.19 0.00 -1.95 0.00 0.00 55.36 52.63 2yu7 s GLN 51 Cb 0.16 -2.43 -0.05 0.00 -0.22 0.00 0.00 33.01 30.47 2yu7 s GLN 51 CO 0.10 0.11 1.13 -1.25 -0.25 0.00 0.00 175.29 175.13 2yu7 s PRO 52 N 0.55 3.32 0.14 2.91 0.04 -1.26 -2.13 135.00 138.56 2yu7 s PRO 52 Ca -0.13 1.60 -0.07 0.00 0.04 0.00 0.00 61.00 62.45 2yu7 s PRO 52 Cb -0.17 -2.00 -0.04 0.00 0.04 0.00 0.00 34.50 32.34 2yu7 s PRO 52 CO 0.04 -0.88 1.38 1.57 0.04 0.00 0.00 177.00 179.16 2yu7 h LYS 53 N 1.12 0.59 -2.76 4.56 2.10 -1.78 -3.40 116.57 117.00 2yu7 h LYS 53 Ca -0.50 -0.48 -0.60 0.00 -2.00 0.00 0.00 60.65 57.08 2yu7 h LYS 53 Cb 1.26 0.10 -0.40 0.00 -0.90 0.00 0.00 32.23 32.29 2yu7 h LYS 53 CO 0.57 1.10 -0.80 0.00 -2.00 0.00 0.00 179.45 178.32 2yu7 s ALA 54 N -3.70 1.78 0.00 0.07 0.00 -1.26 -5.07 121.76 113.57 2yu7 s ALA 54 Ca -0.08 -2.45 0.00 0.00 0.00 0.00 0.00 51.96 49.43 2yu7 s ALA 54 Cb 0.10 -1.77 0.00 0.00 0.00 0.00 0.00 23.12 21.45 2yu7 s ALA 54 CO 0.87 -2.06 0.00 0.41 0.00 0.00 0.00 175.76 174.98 2yu7 n GLY 55 N 3.44 0.27 3.75 0.00 0.00 -1.26 -3.85 105.19 107.54 2yu7 n GLY 55 Ca 0.14 -0.57 -0.41 0.00 0.00 0.00 0.00 46.02 45.18 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 4.43 0.00 1.61 0.04 -1.26 -3.37 135.00 136.44 2yu7 s PRO 56 Ca 0.00 2.05 0.00 0.00 0.04 0.00 0.00 61.00 63.09 2yu7 s PRO 56 Cb 0.00 -3.16 0.00 0.00 0.04 0.00 0.00 34.50 31.38 2yu7 s PRO 56 CO 0.00 -0.15 0.00 0.41 0.04 0.00 0.00 177.00 177.30 2yu7 n GLY 57 N 1.71 1.76 3.87 0.56 0.00 -1.26 -5.08 105.19 106.75 2yu7 n GLY 57 Ca 0.03 -0.01 -0.31 0.00 0.00 0.00 0.00 46.02 45.73 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 0.03 6.54 0.46 1.61 1.04 -1.22 -5.05 113.70 117.11 2yu7 s SER 58 Ca 0.00 1.24 -0.23 0.00 0.48 0.00 0.00 55.95 57.44 2yu7 s SER 58 Cb 0.00 -2.37 -0.07 0.00 0.10 0.00 0.00 66.02 63.68 2yu7 s SER 58 CO 0.00 -0.45 1.17 -2.16 0.98 0.00 0.00 173.24 172.77 2yu7 s PRO 59 N -3.93 3.76 0.38 4.02 0.04 -1.26 -4.61 135.00 133.40 2yu7 s PRO 59 Ca 0.53 1.78 -0.27 0.00 0.04 0.00 0.00 61.00 63.07 2yu7 s PRO 59 Cb -0.10 -2.41 -0.11 0.00 0.04 0.00 0.00 34.50 31.92 2yu7 s PRO 59 CO 0.32 -0.55 1.40 1.28 0.04 0.00 0.00 177.00 179.49 2yu7 n LEU 60 N -0.48 4.39 -4.77 -3.56 4.32 -1.26 -2.87 117.00 112.76 2yu7 n LEU 60 Ca 0.07 1.20 -0.38 0.00 -0.02 0.00 0.00 56.01 56.89 2yu7 n LEU 60 Cb 0.48 -1.57 -0.03 0.00 -1.62 0.00 0.00 43.42 40.68 2yu7 n LEU 60 CO 0.48 -0.14 0.80 -0.60 -1.22 0.00 0.00 177.39 176.71 2yu7 s ARG 61 N -2.09 4.09 0.23 3.23 6.06 -0.91 -4.81 118.95 124.75 2yu7 s ARG 61 Ca 0.55 1.72 0.08 0.00 -2.50 0.00 0.00 55.73 55.59 2yu7 s ARG 61 Cb -0.50 -2.63 -0.04 0.00 0.06 0.00 0.00 34.95 31.84 2yu7 s ARG 61 CO 0.62 -0.26 0.05 0.08 -2.50 0.00 0.00 175.30 173.29 2yu7 s VAL 62 N -1.49 3.81 -0.07 7.11 1.01 -1.26 -1.32 120.40 128.18 2yu7 s VAL 62 Ca 0.57 -1.59 -0.01 0.00 0.00 0.00 0.00 61.98 60.96 2yu7 s VAL 62 Cb -0.28 -2.99 0.03 0.00 0.00 0.00 0.00 36.38 33.13 2yu7 s VAL 62 CO 0.35 -0.26 -0.02 -0.89 0.00 0.00 0.00 175.10 174.27 2yu7 s THR 63 N -2.04 0.53 -0.34 3.92 2.01 -0.43 -4.97 115.64 114.33 2yu7 s THR 63 Ca 0.30 -0.02 -0.12 0.00 0.31 0.00 0.00 61.69 62.17 2yu7 s THR 63 Cb -0.08 -0.63 -0.01 0.00 0.01 0.00 0.00 72.50 71.79 2yu7 s THR 63 CO 0.21 0.27 0.21 -1.00 -0.69 0.00 0.00 174.62 173.61 2yu7 s HIS 64 N 1.63 3.21 -0.52 4.92 3.76 -1.26 -1.81 115.29 125.23 2yu7 s HIS 64 Ca 0.00 -0.45 -0.11 0.00 -0.15 0.00 0.00 55.06 54.36 2yu7 s HIS 64 Cb -0.13 -2.43 0.13 0.00 1.11 0.00 0.00 32.58 31.26 2yu7 s HIS 64 CO -0.04 -0.44 0.41 0.42 -0.85 0.00 0.00 174.74 174.24 2yu7 s ILE 65 N 1.66 4.49 -0.35 0.60 1.01 0.31 -4.93 121.20 123.99 2yu7 s ILE 65 Ca 0.05 -1.82 -0.39 0.00 0.00 0.00 0.00 60.65 58.48 2yu7 s ILE 65 Cb -0.18 -3.93 -0.15 0.00 0.01 0.00 0.00 42.46 38.22 2yu7 s ILE 65 CO 0.08 -0.82 1.95 0.29 0.00 0.00 0.00 174.94 176.45 2yu7 n LYS 66 N 4.86 0.91 -3.34 2.79 5.02 -1.26 -2.43 118.16 124.71 2yu7 n LYS 66 Ca -0.07 0.30 -0.41 0.00 -2.02 0.00 0.00 58.31 56.11 2yu7 n LYS 66 Cb 0.41 -2.11 -0.09 0.00 -0.02 0.00 0.00 35.03 33.22 2yu7 n LYS 66 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2yu7 s VAL 67 N 5.20 5.11 -0.08 -0.18 1.01 0.53 -4.52 120.40 127.46 2yu7 s VAL 67 Ca 1.06 0.25 -0.21 0.00 0.00 0.00 0.00 61.98 63.08 2yu7 s VAL 67 Cb -1.08 -3.86 -0.04 0.00 0.00 0.00 0.00 36.38 31.40 2yu7 s VAL 67 CO 0.61 -0.10 0.59 -0.04 0.00 0.00 0.00 175.10 176.16 2yu7 s MET 68 N 2.17 4.38 -0.24 2.72 -1.94 0.21 -1.97 119.30 124.63 2yu7 s MET 68 Ca 0.15 0.68 -0.02 0.00 -1.71 0.00 0.00 55.69 54.79 2yu7 s MET 68 Cb -0.16 -3.43 0.02 0.00 2.01 0.00 0.00 34.83 33.27 2yu7 s MET 68 CO 0.12 0.13 -0.06 0.00 -0.01 0.00 0.00 175.02 175.21 2yu7 n GLU 70 N 4.69 2.20 -3.34 0.00 -0.58 -0.71 -4.79 120.64 118.12 2yu7 n GLU 70 Ca -0.17 -1.87 -0.11 0.00 -0.42 0.00 0.00 57.16 54.60 2yu7 n GLU 70 Cb 0.48 -2.03 0.01 0.00 -0.57 0.00 0.00 31.44 29.33 2yu7 n GLU 70 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2yu7 n GLY 71 N 1.25 -1.24 0.00 0.62 0.00 -1.26 -4.12 105.19 100.43 2yu7 n GLY 71 Ca 0.44 0.52 0.00 0.00 0.00 0.00 0.00 46.02 46.98 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 -1.71 1.11 3.61 -0.02 0.00 -1.26 -5.10 105.19 101.81 2yu7 n GLY 72 Ca -0.11 -0.11 -0.28 0.00 0.00 0.00 0.00 46.02 45.53 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 0.00 1.94 -0.01 1.61 3.00 -1.26 -4.54 118.95 119.69 2yu7 s ARG 73 Ca 0.00 -2.08 0.02 0.00 0.00 0.00 0.00 55.73 53.66 2yu7 s ARG 73 Cb 0.00 -1.64 -0.00 0.00 0.00 0.00 0.00 34.95 33.30 2yu7 s ARG 73 CO 0.00 -0.02 -0.06 0.71 0.00 0.00 0.00 175.30 175.93 2yu7 s TYR 74 N -2.70 0.52 0.03 -0.53 2.02 0.24 -1.73 117.35 115.20 2yu7 s TYR 74 Ca 0.35 -0.10 -0.06 0.00 -0.37 0.00 0.00 57.07 56.89 2yu7 s TYR 74 Cb 0.09 -0.35 -0.01 0.00 -0.40 0.00 0.00 41.96 41.29 2yu7 s TYR 74 CO 0.18 -0.02 0.11 -0.08 -1.57 0.00 0.00 175.55 174.17 2yu7 s THR 75 N -0.07 0.12 -0.16 -0.71 -1.32 0.85 -0.20 115.64 114.14 2yu7 s THR 75 Ca 0.01 -0.96 -0.02 0.00 -1.21 0.00 0.00 61.69 59.52 2yu7 s THR 75 Cb -0.03 -0.74 0.05 0.00 -1.51 0.00 0.00 72.50 70.27 2yu7 s THR 75 CO -0.00 -0.53 -0.00 0.68 -2.21 0.00 0.00 174.62 172.55 2yu7 s VAL 76 N -2.22 0.73 -0.80 5.08 -7.23 -1.26 -0.62 120.40 114.08 2yu7 s VAL 76 Ca -0.08 -0.48 -0.08 0.00 -1.81 0.00 0.00 61.98 59.53 2yu7 s VAL 76 Cb -0.03 -1.05 0.01 0.00 0.56 0.00 0.00 36.38 35.87 2yu7 s VAL 76 CO -0.03 -0.00 0.16 0.61 -0.31 0.00 0.00 175.10 175.53 2yu7 n GLY 77 N 5.00 -0.23 0.00 2.32 0.00 -1.26 -4.80 105.19 106.21 2yu7 n GLY 77 Ca -0.10 0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.06 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 -1.78 0.34 0.19 -0.02 0.00 -1.26 -4.99 105.19 97.67 2yu7 n GLY 78 Ca -0.14 -0.90 0.14 0.00 0.00 0.00 0.00 46.02 45.12 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 -8.72 0.99 8.10 -2.01 -3.44 115.31 110.23 2yu7 h LEU 79 Ca 0.00 0.00 -0.62 0.00 0.11 0.00 0.00 57.88 57.37 2yu7 h LEU 79 Cb 0.00 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 40.21 2yu7 h LEU 79 CO 0.00 0.00 1.48 -0.62 -4.11 0.00 0.00 178.44 175.19 2yu7 n GLU 80 N -2.75 1.43 -3.97 0.17 -0.58 -1.26 -4.92 120.64 108.76 2yu7 n GLU 80 Ca 0.03 0.36 -0.33 0.00 -0.42 0.00 0.00 57.16 56.81 2yu7 n GLU 80 Cb 0.39 -2.85 -0.14 0.00 -0.57 0.00 0.00 31.44 28.27 2yu7 n GLU 80 CO 0.00 0.00 0.00 0.95 -0.48 0.00 0.00 177.13 177.60 2yu7 s THR 81 N 8.19 2.53 0.46 2.62 -4.23 -1.26 -4.07 115.64 119.89 2yu7 s THR 81 Ca 1.06 -2.13 -0.12 0.00 -1.18 0.00 0.00 61.69 59.32 2yu7 s THR 81 Cb -0.59 -2.76 -0.06 0.00 1.34 0.00 0.00 72.50 70.43 2yu7 s THR 81 CO 0.41 -0.51 0.86 -0.36 -0.54 0.00 0.00 174.62 174.48 2yu7 s PHE 82 N 1.00 3.49 0.17 3.99 0.40 0.72 -4.78 117.98 122.97 2yu7 s PHE 82 Ca 0.07 1.18 -0.11 0.00 -0.60 0.00 0.00 56.93 57.46 2yu7 s PHE 82 Cb -0.20 -2.56 0.05 0.00 0.51 0.00 0.00 43.02 40.82 2yu7 s PHE 82 CO -0.06 -0.25 1.65 -0.44 0.70 0.00 0.00 175.22 176.82 2yu7 h ASP 83 N 0.92 0.90 -5.36 1.36 5.19 -1.86 0.70 116.42 118.27 2yu7 h ASP 83 Ca -0.47 -0.26 -0.12 0.00 -0.62 0.00 0.00 57.03 55.56 2yu7 h ASP 83 Cb 1.19 -0.24 -0.11 0.00 0.18 0.00 0.00 39.33 40.35 2yu7 h ASP 83 CO 0.63 0.93 -0.30 -0.44 -3.12 0.00 0.00 179.24 176.94 2yu7 s SER 84 N -6.33 -0.00 0.46 6.45 0.01 -1.26 -4.22 113.70 108.82 2yu7 s SER 84 Ca -0.12 -1.08 0.15 0.00 1.31 0.00 0.00 55.95 56.21 2yu7 s SER 84 Cb 0.13 0.51 1.10 0.00 0.21 0.00 0.00 66.02 67.97 2yu7 s SER 84 CO 0.82 -1.02 2.03 -0.07 0.41 0.00 0.00 173.24 175.41 2yu7 h LEU 85 N 2.40 0.26 -1.11 2.44 -0.00 -1.96 -0.75 115.31 116.58 2yu7 h LEU 85 Ca -0.30 0.00 0.01 0.00 -0.00 0.00 0.00 57.88 57.60 2yu7 h LEU 85 Cb 1.25 -0.05 -0.05 0.00 -0.00 0.00 0.00 40.66 41.81 2yu7 h LEU 85 CO 0.42 0.17 0.60 0.74 -0.00 0.00 0.00 178.44 180.37 2yu7 h THR 86 N 0.29 1.22 0.14 0.22 2.02 -1.98 0.48 112.91 115.31 2yu7 h THR 86 Ca 0.20 -0.42 -0.29 0.00 0.77 0.00 0.00 66.41 66.67 2yu7 h THR 86 Cb 0.42 -0.10 0.01 0.00 -1.74 0.00 0.00 68.15 66.74 2yu7 h THR 86 CO -0.04 0.22 -1.38 0.44 0.37 0.00 0.00 175.52 175.13 2yu7 h ASP 87 N 1.22 0.47 0.38 4.18 3.32 -1.63 -1.20 116.42 123.16 2yu7 h ASP 87 Ca 0.33 -0.55 -0.13 0.00 0.02 0.00 0.00 57.03 56.71 2yu7 h ASP 87 Cb -0.13 -0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.26 2yu7 h ASP 87 CO -0.08 1.44 -0.54 0.25 -1.72 0.00 0.00 179.24 178.60 2yu7 h LEU 88 N 0.08 0.19 0.09 1.55 6.46 -0.83 -2.12 115.31 120.73 2yu7 h LEU 88 Ca -0.19 -0.10 -0.23 0.00 -0.12 0.00 0.00 57.88 57.24 2yu7 h LEU 88 Cb 2.02 -0.05 -0.00 0.00 -0.73 0.00 0.00 40.66 41.89 2yu7 h LEU 88 CO 0.20 0.69 -1.19 0.58 -0.62 0.00 0.00 178.44 178.10 2yu7 h VAL 89 N 0.13 1.14 -0.86 1.05 2.07 -0.13 -3.28 116.25 116.37 2yu7 h VAL 89 Ca 0.00 -2.38 0.04 0.00 0.82 0.00 0.00 66.70 65.18 2yu7 h VAL 89 Cb 0.99 2.76 -0.05 0.00 -1.52 0.00 0.00 31.29 33.47 2yu7 h VAL 89 CO 0.08 0.64 0.55 1.05 0.02 0.00 0.00 177.57 179.91 2yu7 h GLU 90 N -0.47 1.02 -0.77 1.57 -0.00 -1.27 0.22 114.58 114.88 2yu7 h GLU 90 Ca -0.26 -0.06 0.01 0.00 -0.00 0.00 0.00 59.36 59.05 2yu7 h GLU 90 Cb 1.61 -0.23 -0.04 0.00 -0.00 0.00 0.00 28.75 30.09 2yu7 h GLU 90 CO 0.03 0.67 0.51 1.25 -0.00 0.00 0.00 179.01 181.46 2yu7 h HIS 91 N 1.05 0.96 0.00 2.06 2.76 -1.53 -2.22 115.15 118.22 2yu7 h HIS 91 Ca 0.35 0.02 -0.15 0.00 -2.20 0.00 0.00 60.37 58.39 2yu7 h HIS 91 Cb 0.05 -0.32 -0.02 0.00 1.55 0.00 0.00 27.41 28.66 2yu7 h HIS 91 CO -0.02 0.59 -0.74 0.74 -1.30 0.00 0.00 177.93 177.20 2yu7 h PHE 92 N 1.03 0.00 -0.00 5.26 0.04 -1.44 -1.69 116.94 120.13 2yu7 h PHE 92 Ca 0.29 0.00 0.00 0.00 2.80 0.00 0.00 57.97 61.06 2yu7 h PHE 92 Cb -0.10 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.05 2yu7 h PHE 92 CO -0.02 0.74 0.01 0.87 -0.60 0.00 0.00 178.31 179.31 2yu7 h LYS 93 N 0.00 0.00 0.00 1.51 1.57 0.05 1.81 116.57 121.51 2yu7 h LYS 93 Ca -0.01 0.00 -0.36 0.00 -1.87 0.00 0.00 60.65 58.41 2yu7 h LYS 93 Cb 1.36 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 33.61 2yu7 h LYS 93 CO 0.10 0.00 -2.25 0.36 -0.57 0.00 0.00 179.45 177.09 2yu7 n LYS 94 N -3.51 0.50 -0.03 3.15 2.85 -1.13 -4.69 118.16 115.29 2yu7 n LYS 94 Ca -0.03 0.18 -0.20 0.00 -1.05 0.00 0.00 58.31 57.21 2yu7 n LYS 94 Cb 0.09 -1.34 -0.13 0.00 -0.65 0.00 0.00 35.03 32.99 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 -0.55 1.12 0.00 0.58 1.35 -1.20 -3.51 112.91 110.69 2yu7 h THR 95 Ca -0.54 -2.34 0.00 0.00 -0.55 0.00 0.00 66.41 62.98 2yu7 h THR 95 Cb 1.58 2.70 0.00 0.00 -1.73 0.00 0.00 68.15 70.70 2yu7 h THR 95 CO -0.26 0.60 0.00 0.61 -0.25 0.00 0.00 175.52 176.21 2yu7 n GLY 96 N 1.65 1.95 3.87 5.82 0.00 0.62 -5.01 105.19 114.08 2yu7 n GLY 96 Ca -0.24 -1.85 -0.37 0.00 0.00 0.00 0.00 46.02 43.55 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 -2.89 5.40 -0.22 -0.61 1.01 -0.62 -4.82 121.20 118.44 2yu7 s ILE 97 Ca 0.00 0.34 -0.01 0.00 0.00 0.00 0.00 60.65 60.99 2yu7 s ILE 97 Cb 0.00 -3.47 0.02 0.00 0.01 0.00 0.00 42.46 39.02 2yu7 s ILE 97 CO 0.00 0.61 -0.11 -0.70 0.00 0.00 0.00 174.94 174.74 2yu7 s GLU 98 N -1.06 2.91 0.41 2.79 2.12 -1.26 -0.34 118.70 124.28 2yu7 s GLU 98 Ca 0.17 -0.92 -0.24 0.00 0.36 0.00 0.00 54.97 54.35 2yu7 s GLU 98 Cb -0.13 -2.85 -0.08 0.00 0.26 0.00 0.00 34.13 31.32 2yu7 s GLU 98 CO 0.06 -0.33 1.10 -1.21 -0.54 0.00 0.00 175.26 174.35 2yu7 s GLU 99 N 1.32 4.04 0.50 4.30 2.02 0.54 -4.88 118.70 126.54 2yu7 s GLU 99 Ca 0.02 1.65 0.39 0.00 0.02 0.00 0.00 54.97 57.05 2yu7 s GLU 99 Cb -0.15 -2.54 1.57 0.00 0.10 0.00 0.00 34.13 33.11 2yu7 s GLU 99 CO -0.07 -0.28 1.63 0.00 0.02 0.00 0.00 175.26 176.56 2yu7 h ALA 100 N 2.42 3.26 -0.10 5.21 0.00 -1.99 1.01 119.26 129.07 2yu7 h ALA 100 Ca -0.49 0.02 -0.20 0.00 0.00 0.00 0.00 54.91 54.24 2yu7 h ALA 100 Cb 1.23 0.16 0.01 0.00 0.00 0.00 0.00 17.79 19.19 2yu7 h ALA 100 CO 0.62 -1.82 -0.70 1.03 0.00 0.00 0.00 179.25 178.38 2yu7 h SER 101 N 0.04 0.80 0.00 0.00 0.87 -2.04 -3.48 113.55 109.74 2yu7 h SER 101 Ca 0.83 -0.66 0.00 0.00 -1.23 0.00 0.00 61.79 60.73 2yu7 h SER 101 Cb 3.02 -0.24 0.00 0.00 -0.44 0.00 0.00 62.40 64.74 2yu7 h SER 101 CO -0.19 1.33 0.00 0.61 -0.53 0.00 0.00 176.83 178.05 2yu7 n GLY 102 N 0.78 1.16 3.43 5.77 0.00 0.35 -5.13 105.19 111.55 2yu7 n GLY 102 Ca -0.08 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.49 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 -2.02 -3.90 4.61 0.00 -1.26 -4.42 120.51 113.52 2yu7 n ALA 103 Ca 0.00 0.31 -0.33 0.00 0.00 0.00 0.00 53.44 53.42 2yu7 n ALA 103 Cb 0.00 -1.71 -0.14 0.00 0.00 0.00 0.00 19.45 17.60 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 -1.24 3.36 -0.10 0.00 0.08 -1.26 -0.34 117.98 118.49 2yu7 s PHE 104 Ca 0.62 -2.28 -0.24 0.00 0.12 0.00 0.00 56.93 55.15 2yu7 s PHE 104 Cb -0.76 -2.22 -0.03 0.00 -0.57 0.00 0.00 43.02 39.45 2yu7 s PHE 104 CO 0.58 -0.87 0.72 0.08 -0.10 0.00 0.00 175.22 175.63 2yu7 s VAL 105 N 1.12 5.01 -0.18 -0.44 1.01 0.54 -4.91 120.40 122.55 2yu7 s VAL 105 Ca -0.04 1.45 -0.03 0.00 0.00 0.00 0.00 61.98 63.37 2yu7 s VAL 105 Cb -0.20 -4.05 -0.01 0.00 0.00 0.00 0.00 36.38 32.12 2yu7 s VAL 105 CO -0.04 0.19 -0.06 -0.31 0.00 0.00 0.00 175.10 174.88 2yu7 s TYR 106 N 1.18 2.94 -0.35 5.22 2.02 -1.26 -1.59 117.35 125.51 2yu7 s TYR 106 Ca 0.37 -0.72 -0.10 0.00 -0.37 0.00 0.00 57.07 56.24 2yu7 s TYR 106 Cb -0.17 -2.01 0.01 0.00 -0.40 0.00 0.00 41.96 39.39 2yu7 s TYR 106 CO 0.16 -0.35 0.18 -0.51 -1.57 0.00 0.00 175.55 173.46 2yu7 s LEU 107 N 0.97 4.47 0.00 -1.29 1.02 -1.26 -4.36 118.68 118.23 2yu7 s LEU 107 Ca -0.00 -0.81 0.00 0.00 0.02 0.00 0.00 54.13 53.33 2yu7 s LEU 107 Cb -0.15 -2.01 0.00 0.00 0.02 0.00 0.00 46.19 44.05 2yu7 s LEU 107 CO 0.00 -0.31 0.00 0.54 0.02 0.00 0.00 176.35 176.60 2yu7 n ARG 108 N 4.99 1.87 -3.55 1.70 1.74 -0.56 -4.47 116.66 118.38 2yu7 n ARG 108 Ca -0.13 0.00 -0.41 0.00 -0.77 0.00 0.00 57.85 56.55 2yu7 n ARG 108 Cb 0.47 -0.75 -0.08 0.00 -1.02 0.00 0.00 32.46 31.08 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 -1.51 2.57 -0.87 5.56 -0.21 -0.91 -5.01 119.66 119.29 2yu7 s GLN 109 Ca 0.00 -1.90 -0.25 0.00 0.02 0.00 0.00 55.36 53.24 2yu7 s GLN 109 Cb 0.00 -3.94 -0.04 0.00 1.00 0.00 0.00 33.01 30.02 2yu7 s GLN 109 CO 0.00 -1.20 1.93 -1.25 -2.12 0.00 0.00 175.29 172.65 2yu7 s PRO 110 N 1.13 2.57 -0.21 2.91 0.04 -1.26 -1.41 135.00 138.77 2yu7 s PRO 110 Ca 0.08 -0.18 -0.39 0.00 0.04 0.00 0.00 61.00 60.54 2yu7 s PRO 110 Cb -0.24 -4.98 -0.15 0.00 0.04 0.00 0.00 34.50 29.16 2yu7 s PRO 110 CO -0.02 -3.29 1.69 0.98 0.04 0.00 0.00 177.00 176.40 2yu7 n TYR 111 N 13.81 2.00 -2.77 0.56 9.36 1.00 -4.71 117.16 136.40 2yu7 n TYR 111 Ca 0.38 0.51 -0.26 0.00 3.32 0.00 0.00 57.90 61.84 2yu7 n TYR 111 Cb 0.48 -2.46 0.00 0.00 -0.63 0.00 0.00 39.34 36.73 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 3.10 3.51 -0.47 2.98 2.02 -1.26 -4.36 117.35 122.87 2yu7 s TYR 112 Ca 0.96 0.68 -0.27 0.00 -0.37 0.00 0.00 57.07 58.07 2yu7 s TYR 112 Cb -1.02 -2.26 -0.04 0.00 -0.40 0.00 0.00 41.96 38.24 2yu7 s TYR 112 CO 0.62 -0.25 2.09 0.45 -1.57 0.00 0.00 175.55 176.89 2yu7 s SER 113 N -4.11 5.11 -0.57 2.29 0.15 -1.26 -4.83 113.70 110.48 2yu7 s SER 113 Ca 0.46 0.98 -0.37 0.00 0.70 0.00 0.00 55.95 57.72 2yu7 s SER 113 Cb -0.10 -2.52 -0.18 0.00 -1.71 0.00 0.00 66.02 61.51 2yu7 s SER 113 CO 0.43 -2.38 2.07 0.61 1.20 0.00 0.00 173.24 175.17 2yu7 n GLY 114 N 5.76 -0.22 0.00 9.45 0.00 -1.26 -4.73 105.19 114.19 2yu7 n GLY 114 Ca 0.28 1.03 0.07 0.00 0.00 0.00 0.00 46.02 47.39 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 7.04 0.17 -2.54 1.61 -0.04 -1.26 -4.87 135.00 135.12 2yu7 n PRO 115 Ca 0.53 0.17 -0.06 0.00 -0.04 0.00 0.00 63.50 64.09 2yu7 n PRO 115 Cb -0.02 -1.50 0.03 0.00 -0.04 0.00 0.00 33.50 31.97 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 -1.32 -2.29 -4.29 3.54 7.64 -1.26 -5.00 113.62 110.64 2yu7 n SER 116 Ca 0.06 -0.19 -0.45 0.00 1.01 0.00 0.00 58.87 59.30 2yu7 n SER 116 Cb 0.13 -1.98 -0.04 0.00 -1.01 0.00 0.00 64.21 61.31 2yu7 n SER 116 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 2yu7 s SER 117 N -3.37 6.46 0.00 6.43 1.04 -1.26 -5.34 113.70 117.66 2yu7 s SER 117 Ca 0.04 -2.65 0.00 0.00 0.48 0.00 0.00 55.95 53.82 2yu7 s SER 117 Cb -0.02 -2.15 0.00 0.00 0.10 0.00 0.00 66.02 63.96 2yu7 s SER 117 CO 0.23 -0.56 0.00 0.61 0.98 0.00 0.00 173.24 174.51