#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 -1.23 -0.71 1.61 0.01 -1.26 -5.11 113.70 107.01 2yu7 s SER 2 Ca 0.00 1.15 -0.22 0.00 1.31 0.00 0.00 55.95 58.19 2yu7 s SER 2 Cb 0.00 2.18 0.08 0.00 0.21 0.00 0.00 66.02 68.49 2yu7 s SER 2 CO 0.00 -0.23 1.02 -0.55 0.41 0.00 0.00 173.24 173.89 2yu7 s SER 3 N 2.86 6.25 0.00 2.44 0.15 -1.26 -4.85 113.70 119.30 2yu7 s SER 3 Ca 0.08 -1.13 0.00 0.00 0.70 0.00 0.00 55.95 55.60 2yu7 s SER 3 Cb -0.13 -2.43 0.00 0.00 -1.71 0.00 0.00 66.02 61.75 2yu7 s SER 3 CO -0.20 -1.41 0.00 0.61 1.20 0.00 0.00 173.24 173.44 2yu7 n GLY 4 N 5.41 0.38 3.49 9.45 0.00 -1.26 -5.16 105.19 117.51 2yu7 n GLY 4 Ca 0.02 0.63 -0.34 0.00 0.00 0.00 0.00 46.02 46.32 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 0.00 -1.06 -3.85 1.61 3.41 -1.26 -5.03 113.62 107.45 2yu7 n SER 5 Ca 0.00 0.49 -0.12 0.00 -0.26 0.00 0.00 58.87 58.98 2yu7 n SER 5 Cb 0.00 -1.28 -0.11 0.00 -0.26 0.00 0.00 64.21 62.56 2yu7 n SER 5 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 2yu7 s SER 6 N -1.81 -0.06 0.00 4.04 0.01 -1.26 -5.16 113.70 109.46 2yu7 s SER 6 Ca 0.64 0.04 0.00 0.00 1.31 0.00 0.00 55.95 57.94 2yu7 s SER 6 Cb -0.28 0.26 0.00 0.00 0.21 0.00 0.00 66.02 66.21 2yu7 s SER 6 CO 0.60 -0.22 0.00 0.61 0.41 0.00 0.00 173.24 174.64 2yu7 n GLY 7 N 2.19 0.85 0.27 3.44 0.00 -1.26 -4.78 105.19 105.91 2yu7 n GLY 7 Ca -0.18 -0.16 0.12 0.00 0.00 0.00 0.00 46.02 45.80 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 -3.57 117.44 116.20 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 -0.09 -0.03 0.00 -1.36 0.00 0.00 31.31 29.83 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 -2.58 2.83 -0.06 -2.67 5.04 -1.26 -3.54 117.35 115.11 2yu7 s TYR 9 Ca 0.20 0.88 -0.05 0.00 -2.44 0.00 0.00 57.07 55.67 2yu7 s TYR 9 Cb 0.19 -3.60 -0.02 0.00 0.35 0.00 0.00 41.96 38.88 2yu7 s TYR 9 CO 0.58 -2.19 -0.09 0.72 -1.34 0.00 0.00 175.55 173.23 2yu7 n HIS 10 N 5.76 0.37 0.00 4.97 8.25 -0.85 -4.33 115.22 129.39 2yu7 n HIS 10 Ca 0.13 0.16 0.00 0.00 -0.26 0.00 0.00 57.72 57.75 2yu7 n HIS 10 Cb 0.44 -0.45 0.00 0.00 1.12 0.00 0.00 29.99 31.10 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 1.67 2.69 2.90 -1.41 0.00 -1.26 -4.97 105.19 104.80 2yu7 n GLY 11 Ca -0.04 -0.77 -0.27 0.00 0.00 0.00 0.00 46.02 44.94 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 1.56 -0.29 1.61 2.46 -1.26 -3.07 115.29 116.30 2yu7 s HIS 12 Ca 0.00 -0.88 -0.24 0.00 0.47 0.00 0.00 55.06 54.41 2yu7 s HIS 12 Cb 0.00 -1.26 0.16 0.00 -0.13 0.00 0.00 32.58 31.35 2yu7 s HIS 12 CO 0.00 -0.56 1.21 1.41 -2.47 0.00 0.00 174.74 174.34 2yu7 s MET 13 N 1.68 0.28 0.13 2.88 0.00 -1.26 -4.98 119.30 118.03 2yu7 s MET 13 Ca 0.03 0.36 0.06 0.00 0.00 0.00 0.00 55.69 56.13 2yu7 s MET 13 Cb -0.14 0.13 -0.04 0.00 0.00 0.00 0.00 34.83 34.78 2yu7 s MET 13 CO -0.08 -0.04 0.01 -1.54 0.00 0.00 0.00 175.02 173.38 2yu7 s SER 14 N 0.29 4.97 0.28 1.11 1.04 -1.26 -4.65 113.70 115.47 2yu7 s SER 14 Ca 0.03 -0.26 0.02 0.00 0.48 0.00 0.00 55.95 56.22 2yu7 s SER 14 Cb -0.05 -1.15 0.71 0.00 0.10 0.00 0.00 66.02 65.63 2yu7 s SER 14 CO -0.11 0.13 1.42 0.61 0.98 0.00 0.00 173.24 176.27 2yu7 n GLY 15 N 0.19 -1.22 0.35 7.32 0.00 -1.26 0.16 105.19 110.74 2yu7 n GLY 15 Ca -0.10 0.88 0.02 0.00 0.00 0.00 0.00 46.02 46.83 2yu7 n GLY 15 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2yu7 h GLY 16 N 0.00 1.08 1.57 -0.02 0.00 -2.00 -1.29 103.07 102.41 2yu7 h GLY 16 Ca 0.56 -0.38 -0.23 0.00 0.00 0.00 0.00 47.33 47.28 2yu7 h GLY 16 CO -0.85 0.34 -0.98 -1.61 0.00 0.00 0.00 176.54 173.45 2yu7 h GLN 17 N 0.97 0.37 0.38 4.80 4.15 0.12 -3.28 115.11 122.62 2yu7 h GLN 17 Ca 0.30 -0.43 -0.02 0.00 0.77 0.00 0.00 58.65 59.27 2yu7 h GLN 17 Cb 0.01 0.13 0.00 0.00 0.21 0.00 0.00 27.48 27.83 2yu7 h GLN 17 CO -0.08 1.11 -0.18 0.00 -1.93 0.00 0.00 178.83 177.74 2yu7 h ALA 18 N 0.74 -0.93 -1.59 3.38 0.00 -0.37 -1.05 119.26 119.45 2yu7 h ALA 18 Ca -0.08 -0.11 0.50 0.00 0.00 0.00 0.00 54.91 55.22 2yu7 h ALA 18 Cb 1.62 0.20 -0.11 0.00 0.00 0.00 0.00 17.79 19.50 2yu7 h ALA 18 CO 0.17 -0.89 1.08 0.39 0.00 0.00 0.00 179.25 180.00 2yu7 n GLU 19 N -3.67 -0.02 -0.03 0.00 1.02 -0.54 0.96 120.64 118.36 2yu7 n GLU 19 Ca -0.06 1.15 -0.15 0.00 -0.02 0.00 0.00 57.16 58.07 2yu7 n GLU 19 Cb 0.20 -2.41 -0.12 0.00 -0.02 0.00 0.00 31.44 29.09 2yu7 n GLU 19 CO 0.00 0.00 0.00 1.15 1.18 0.00 0.00 177.13 179.46 2yu7 h THR 20 N 0.00 1.62 0.66 2.62 2.02 -1.58 -2.71 112.91 115.54 2yu7 h THR 20 Ca 0.88 -2.13 -0.03 0.00 0.77 0.00 0.00 66.41 65.90 2yu7 h THR 20 Cb 3.14 3.01 0.01 0.00 -1.74 0.00 0.00 68.15 72.57 2yu7 h THR 20 CO -0.27 0.57 -0.32 -0.07 0.37 0.00 0.00 175.52 175.81 2yu7 h LEU 21 N -0.65 -0.76 -0.33 2.58 3.38 0.20 0.25 115.31 119.98 2yu7 h LEU 21 Ca -0.04 0.00 0.07 0.00 0.09 0.00 0.00 57.88 58.01 2yu7 h LEU 21 Cb 1.07 0.20 -0.07 0.00 0.09 0.00 0.00 40.66 41.95 2yu7 h LEU 21 CO 0.05 -0.49 -0.11 -0.07 0.09 0.00 0.00 178.44 177.91 2yu7 h LEU 22 N -0.97 -0.38 -1.29 1.67 3.38 -0.92 -0.67 115.31 116.13 2yu7 h LEU 22 Ca -0.09 0.11 -0.04 0.00 0.09 0.00 0.00 57.88 57.95 2yu7 h LEU 22 Cb 0.71 0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.67 2yu7 h LEU 22 CO 0.15 -0.14 0.06 1.56 0.09 0.00 0.00 178.44 180.16 2yu7 h GLN 23 N -0.04 0.54 -0.28 1.13 4.20 -1.43 -2.79 115.11 116.44 2yu7 h GLN 23 Ca 0.16 -0.10 0.02 0.00 0.06 0.00 0.00 58.65 58.80 2yu7 h GLN 23 Cb 0.29 -0.09 -0.02 0.00 0.30 0.00 0.00 27.48 27.95 2yu7 h GLN 23 CO -0.36 0.52 0.12 0.00 -0.67 0.00 0.00 178.83 178.44 2yu7 h ALA 24 N 1.54 0.33 -0.09 3.87 0.00 0.10 -2.86 119.26 122.15 2yu7 h ALA 24 Ca 0.12 0.02 0.02 0.00 0.00 0.00 0.00 54.91 55.07 2yu7 h ALA 24 Cb 0.25 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.99 2yu7 h ALA 24 CO 0.00 -0.27 -0.05 -0.22 0.00 0.00 0.00 179.25 178.71 2yu7 h LYS 25 N 0.27 -0.04 -0.68 0.00 1.63 -1.10 -3.47 116.57 113.17 2yu7 h LYS 25 Ca 0.12 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.92 2yu7 h LYS 25 Cb 0.05 0.01 0.00 0.00 -0.60 0.00 0.00 32.23 31.69 2yu7 h LYS 25 CO -0.09 -0.03 0.00 0.41 -3.45 0.00 0.00 179.45 176.29 2yu7 n GLY 26 N -1.17 0.95 3.01 5.01 0.00 -1.08 -5.08 105.19 106.83 2yu7 n GLY 26 Ca -0.05 -0.53 -0.29 0.00 0.00 0.00 0.00 46.02 45.15 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 -3.75 2.17 0.50 1.61 0.41 -1.26 -5.13 118.70 113.26 2yu7 s GLU 27 Ca 0.00 -0.51 -0.21 0.00 -0.41 0.00 0.00 54.97 53.83 2yu7 s GLU 27 Cb 0.00 -1.99 -0.07 0.00 -1.78 0.00 0.00 34.13 30.29 2yu7 s GLU 27 CO 0.00 -0.21 1.15 -1.25 -0.49 0.00 0.00 175.26 174.45 2yu7 s PRO 28 N 1.43 3.55 -0.95 0.39 0.04 -1.26 -3.59 135.00 134.62 2yu7 s PRO 28 Ca 0.03 1.69 -0.06 0.00 0.04 0.00 0.00 61.00 62.70 2yu7 s PRO 28 Cb -0.13 -2.20 0.01 0.00 0.04 0.00 0.00 34.50 32.22 2yu7 s PRO 28 CO -0.09 -0.70 0.79 0.91 0.04 0.00 0.00 177.00 177.95 2yu7 n TRP 29 N -0.91 -1.95 -3.66 0.56 5.03 0.12 -4.73 117.44 111.90 2yu7 n TRP 29 Ca 0.10 0.68 -0.39 0.00 3.03 0.00 0.00 57.50 60.92 2yu7 n TRP 29 Cb 0.50 -3.77 -0.12 0.00 -1.03 0.00 0.00 31.31 26.89 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 -3.20 4.51 0.11 -0.99 2.01 -1.18 -1.64 115.64 115.26 2yu7 s THR 30 Ca 0.39 -0.56 0.04 0.00 0.31 0.00 0.00 61.69 61.87 2yu7 s THR 30 Cb -0.17 -3.35 -0.04 0.00 0.01 0.00 0.00 72.50 68.95 2yu7 s THR 30 CO 0.49 -0.00 0.10 0.72 -0.69 0.00 0.00 174.62 175.24 2yu7 s PHE 31 N 1.58 3.17 -0.14 4.92 -0.71 -0.85 -0.21 117.98 125.74 2yu7 s PHE 31 Ca 0.04 0.04 -0.07 0.00 -1.04 0.00 0.00 56.93 55.89 2yu7 s PHE 31 Cb -0.18 -1.58 0.05 0.00 -1.21 0.00 0.00 43.02 40.11 2yu7 s PHE 31 CO 0.06 0.52 0.34 -0.48 -1.34 0.00 0.00 175.22 174.31 2yu7 s LEU 32 N -2.68 0.11 -0.02 -1.99 0.05 0.38 -0.35 118.68 114.19 2yu7 s LEU 32 Ca 0.30 0.73 -0.14 0.00 0.05 0.00 0.00 54.13 55.06 2yu7 s LEU 32 Cb -0.11 1.07 -0.05 0.00 -2.05 0.00 0.00 46.19 45.04 2yu7 s LEU 32 CO 0.23 -0.18 0.39 -0.69 -0.55 0.00 0.00 176.35 175.54 2yu7 s VAL 33 N 1.38 5.07 0.24 1.48 1.01 -1.23 -2.58 120.40 125.77 2yu7 s VAL 33 Ca -0.09 0.79 -0.12 0.00 0.00 0.00 0.00 61.98 62.57 2yu7 s VAL 33 Cb -0.09 -3.69 -0.01 0.00 0.00 0.00 0.00 36.38 32.59 2yu7 s VAL 33 CO -0.11 0.57 0.43 0.00 0.00 0.00 0.00 175.10 175.99 2yu7 s ARG 34 N -0.98 1.49 0.33 2.72 1.70 -1.18 -2.02 118.95 121.01 2yu7 s ARG 34 Ca 0.23 -1.28 -0.15 0.00 -0.47 0.00 0.00 55.73 54.07 2yu7 s ARG 34 Cb -0.16 0.45 -0.09 0.00 -0.57 0.00 0.00 34.95 34.58 2yu7 s ARG 34 CO 0.12 -0.60 0.74 -1.21 -1.08 0.00 0.00 175.30 173.27 2yu7 s GLU 35 N -4.03 3.98 0.73 3.89 2.02 -1.17 -2.32 118.70 121.81 2yu7 s GLU 35 Ca 0.24 0.66 -0.13 0.00 0.02 0.00 0.00 54.97 55.75 2yu7 s GLU 35 Cb 0.00 -2.42 0.04 0.00 0.10 0.00 0.00 34.13 31.85 2yu7 s GLU 35 CO 0.09 0.14 1.13 -1.12 0.02 0.00 0.00 175.26 175.51 2yu7 s SER 36 N -2.35 4.49 -0.19 -0.19 0.01 -0.53 -4.52 113.70 110.43 2yu7 s SER 36 Ca 0.54 2.05 0.04 0.00 1.31 0.00 0.00 55.95 59.89 2yu7 s SER 36 Cb -0.10 -2.55 -0.14 0.00 0.21 0.00 0.00 66.02 63.43 2yu7 s SER 36 CO 0.18 -2.05 -0.12 0.18 0.41 0.00 0.00 173.24 171.84 2yu7 n LEU 37 N -2.99 2.29 -0.12 2.44 7.99 -1.26 -4.77 117.00 120.58 2yu7 n LEU 37 Ca 0.11 -0.08 -0.25 0.00 -0.01 0.00 0.00 56.01 55.78 2yu7 n LEU 37 Cb 0.52 -0.45 -0.09 0.00 -0.11 0.00 0.00 43.42 43.29 2yu7 n LEU 37 CO 0.49 0.73 -1.07 -1.20 -1.51 0.00 0.00 177.39 174.84 2yu7 n SER 38 N -2.96 1.92 -4.67 -1.43 7.64 -1.26 -4.90 113.62 107.95 2yu7 n SER 38 Ca -0.33 0.38 -0.43 0.00 1.01 0.00 0.00 58.87 59.50 2yu7 n SER 38 Cb 0.90 -0.86 -0.02 0.00 -1.01 0.00 0.00 64.21 63.22 2yu7 n SER 38 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 2yu7 s GLN 39 N -2.49 4.34 -0.08 1.43 1.11 -1.26 -4.99 119.66 117.71 2yu7 s GLN 39 Ca -0.34 1.42 -0.30 0.00 0.01 0.00 0.00 55.36 56.15 2yu7 s GLN 39 Cb 0.11 -3.60 -0.04 0.00 -1.01 0.00 0.00 33.01 28.47 2yu7 s GLN 39 CO 0.50 -0.48 1.51 -1.25 0.01 0.00 0.00 175.29 175.58 2yu7 s PRO 40 N 2.62 4.21 0.00 2.91 0.04 -1.26 -3.27 135.00 140.24 2yu7 s PRO 40 Ca 0.48 2.01 0.00 0.00 0.04 0.00 0.00 61.00 63.52 2yu7 s PRO 40 Cb -0.18 -3.88 0.00 0.00 0.04 0.00 0.00 34.50 30.48 2yu7 s PRO 40 CO 0.13 -0.78 0.00 0.41 0.04 0.00 0.00 177.00 176.80 2yu7 n GLY 41 N 3.93 2.07 3.24 0.56 0.00 -1.26 -5.01 105.19 108.73 2yu7 n GLY 41 Ca 0.16 -0.41 -0.33 0.00 0.00 0.00 0.00 46.02 45.43 2yu7 n GLY 41 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2yu7 n ASP 42 N 1.76 -2.47 -4.19 1.61 2.03 -1.20 -4.73 116.55 109.36 2yu7 n ASP 42 Ca 0.00 -0.10 -0.11 0.00 0.52 0.00 0.00 54.79 55.10 2yu7 n ASP 42 Cb 0.00 -0.90 -0.10 0.00 -0.72 0.00 0.00 41.12 39.40 2yu7 n ASP 42 CO 0.00 0.00 0.00 -0.36 -1.92 0.00 0.00 177.20 174.92 2yu7 s PHE 43 N -2.21 0.99 -0.06 -0.67 0.40 -1.14 -1.45 117.98 113.84 2yu7 s PHE 43 Ca 0.53 -0.99 0.04 0.00 -0.60 0.00 0.00 56.93 55.91 2yu7 s PHE 43 Cb -0.09 -0.57 0.00 0.00 0.51 0.00 0.00 43.02 42.87 2yu7 s PHE 43 CO 0.66 -0.21 -0.17 0.08 0.70 0.00 0.00 175.22 176.28 2yu7 s VAL 44 N -3.68 1.44 -0.26 -0.44 1.01 -0.98 -0.78 120.40 116.72 2yu7 s VAL 44 Ca 0.17 -0.69 -0.09 0.00 0.00 0.00 0.00 61.98 61.37 2yu7 s VAL 44 Cb 0.06 -1.26 -0.04 0.00 0.00 0.00 0.00 36.38 35.14 2yu7 s VAL 44 CO -0.01 0.42 0.12 -0.22 0.00 0.00 0.00 175.10 175.41 2yu7 s LEU 45 N 0.28 3.70 -0.08 3.92 1.98 -0.28 -3.08 118.68 125.12 2yu7 s LEU 45 Ca -0.10 -0.11 0.02 0.00 -2.89 0.00 0.00 54.13 51.06 2yu7 s LEU 45 Cb -0.14 -2.01 -0.02 0.00 0.66 0.00 0.00 46.19 44.68 2yu7 s LEU 45 CO 0.04 -0.03 -0.14 -0.44 -1.89 0.00 0.00 176.35 173.89 2yu7 s SER 46 N 1.61 3.99 -0.01 3.68 0.01 -1.07 -0.07 113.70 121.83 2yu7 s SER 46 Ca 0.06 -0.26 -0.00 0.00 1.31 0.00 0.00 55.95 57.06 2yu7 s SER 46 Cb -0.15 -1.16 0.02 0.00 0.21 0.00 0.00 66.02 64.93 2yu7 s SER 46 CO 0.06 0.27 0.03 -0.69 0.41 0.00 0.00 173.24 173.32 2yu7 s VAL 47 N -0.27 -0.03 -0.28 3.43 1.01 -0.82 -0.47 120.40 122.97 2yu7 s VAL 47 Ca 0.02 0.12 -0.21 0.00 0.00 0.00 0.00 61.98 61.91 2yu7 s VAL 47 Cb -0.13 -0.06 -0.01 0.00 0.00 0.00 0.00 36.38 36.18 2yu7 s VAL 47 CO 0.03 0.05 0.68 -0.22 0.00 0.00 0.00 175.10 175.64 2yu7 s LEU 48 N 0.62 4.09 0.36 3.92 2.96 0.71 -1.20 118.68 130.14 2yu7 s LEU 48 Ca -0.05 0.64 -0.18 0.00 -0.22 0.00 0.00 54.13 54.33 2yu7 s LEU 48 Cb -0.07 -2.92 -0.10 0.00 0.50 0.00 0.00 46.19 43.60 2yu7 s LEU 48 CO -0.02 -0.47 0.82 -0.94 -1.32 0.00 0.00 176.35 174.42 2yu7 s SER 49 N 1.54 6.87 0.00 3.68 1.04 0.83 0.13 113.70 127.78 2yu7 s SER 49 Ca 0.28 1.46 0.16 0.00 0.48 0.00 0.00 55.95 58.33 2yu7 s SER 49 Cb -0.15 -2.44 0.98 0.00 0.10 0.00 0.00 66.02 64.51 2yu7 s SER 49 CO 0.10 -0.25 1.43 -0.90 0.98 0.00 0.00 173.24 174.61 2yu7 n ASP 50 N -0.39 0.00 -4.60 7.02 5.75 -1.26 -4.03 116.55 119.03 2yu7 n ASP 50 Ca 0.05 -0.85 -0.38 0.00 -0.01 0.00 0.00 54.79 53.60 2yu7 n ASP 50 Cb 0.53 0.00 -0.10 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 3.98 0.77 0.11 -1.52 -1.26 -5.00 119.66 114.75 2yu7 s GLN 51 Ca 0.25 -0.19 -0.10 0.00 -1.95 0.00 0.00 55.36 53.36 2yu7 s GLN 51 Cb 0.11 -3.65 0.06 0.00 -0.22 0.00 0.00 33.01 29.31 2yu7 s GLN 51 CO 0.19 -0.19 1.09 -1.25 -0.25 0.00 0.00 175.29 174.88 2yu7 s PRO 52 N 1.79 2.25 0.11 2.91 0.04 -1.26 -1.07 135.00 139.76 2yu7 s PRO 52 Ca 0.10 1.17 -0.15 0.00 0.04 0.00 0.00 61.00 62.16 2yu7 s PRO 52 Cb -0.16 -1.90 -0.04 0.00 0.04 0.00 0.00 34.50 32.44 2yu7 s PRO 52 CO 0.10 -1.65 1.52 0.87 0.04 0.00 0.00 177.00 177.88 2yu7 h LYS 53 N -1.13 0.69 0.00 4.56 1.57 -1.05 -3.43 116.57 117.77 2yu7 h LYS 53 Ca -0.43 -0.26 0.00 0.00 -1.87 0.00 0.00 60.65 58.08 2yu7 h LYS 53 Cb 1.23 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 33.50 2yu7 h LYS 53 CO 0.51 0.84 0.00 0.00 -0.57 0.00 0.00 179.45 180.24 2yu7 n ALA 54 N -2.43 3.00 0.00 3.86 0.00 -1.26 -5.07 120.51 118.61 2yu7 n ALA 54 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.42 2yu7 n ALA 54 Cb 0.34 0.14 0.00 0.00 0.00 0.00 0.00 19.45 19.93 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 3.05 2.17 3.58 0.00 0.00 -1.26 -5.01 105.19 107.71 2yu7 n GLY 55 Ca 0.00 -0.27 -0.28 0.00 0.00 0.00 0.00 46.02 45.47 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 2.50 -0.77 1.61 0.04 -1.26 -3.66 135.00 133.46 2yu7 s PRO 56 Ca 0.00 -1.14 -0.04 0.00 0.04 0.00 0.00 61.00 59.86 2yu7 s PRO 56 Cb 0.00 -5.24 0.00 0.00 0.04 0.00 0.00 34.50 29.31 2yu7 s PRO 56 CO 0.00 -3.96 0.67 0.41 0.04 0.00 0.00 177.00 174.16 2yu7 n GLY 57 N 5.84 0.04 3.65 0.56 0.00 -1.26 -5.04 105.19 108.99 2yu7 n GLY 57 Ca 0.45 -0.13 -0.30 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 -3.37 4.84 1.03 1.61 1.04 -1.24 -5.07 113.70 112.54 2yu7 s SER 58 Ca 0.24 -0.23 -0.13 0.00 0.48 0.00 0.00 55.95 56.31 2yu7 s SER 58 Cb -0.11 -1.09 0.21 0.00 0.10 0.00 0.00 66.02 65.12 2yu7 s SER 58 CO 0.43 0.18 1.10 -2.16 0.98 0.00 0.00 173.24 173.77 2yu7 s PRO 59 N -2.25 0.17 0.05 4.02 0.04 -1.26 -4.57 135.00 131.20 2yu7 s PRO 59 Ca 0.24 0.43 -0.22 0.00 0.04 0.00 0.00 61.00 61.49 2yu7 s PRO 59 Cb -0.11 -1.71 -0.06 0.00 0.04 0.00 0.00 34.50 32.65 2yu7 s PRO 59 CO 0.17 -2.89 0.67 -0.51 0.04 0.00 0.00 177.00 174.47 2yu7 s LEU 60 N -6.54 4.47 0.52 -3.56 1.02 -1.26 -0.52 118.68 112.82 2yu7 s LEU 60 Ca 0.66 1.33 -0.21 0.00 0.02 0.00 0.00 54.13 55.93 2yu7 s LEU 60 Cb -0.18 -3.06 -0.06 0.00 0.02 0.00 0.00 46.19 42.92 2yu7 s LEU 60 CO 0.57 0.12 1.23 -0.60 0.02 0.00 0.00 176.35 177.70 2yu7 s ARG 61 N -0.44 3.34 0.28 1.70 6.06 -0.23 -4.74 118.95 124.91 2yu7 s ARG 61 Ca 0.33 1.92 0.10 0.00 -2.50 0.00 0.00 55.73 55.59 2yu7 s ARG 61 Cb -0.20 -2.22 -0.05 0.00 0.06 0.00 0.00 34.95 32.55 2yu7 s ARG 61 CO 0.20 -0.93 -0.06 0.08 -2.50 0.00 0.00 175.30 172.09 2yu7 s VAL 62 N -1.49 3.09 -0.10 7.11 1.01 -1.26 -0.12 120.40 128.64 2yu7 s VAL 62 Ca 0.70 -2.06 -0.01 0.00 0.00 0.00 0.00 61.98 60.61 2yu7 s VAL 62 Cb -0.33 -2.68 0.03 0.00 0.00 0.00 0.00 36.38 33.40 2yu7 s VAL 62 CO 0.38 -0.37 -0.04 -0.89 0.00 0.00 0.00 175.10 174.18 2yu7 s THR 63 N -2.40 0.77 -0.41 3.92 2.01 -0.34 -4.94 115.64 114.25 2yu7 s THR 63 Ca 0.31 -0.14 -0.11 0.00 0.31 0.00 0.00 61.69 62.06 2yu7 s THR 63 Cb -0.05 -0.86 0.06 0.00 0.01 0.00 0.00 72.50 71.66 2yu7 s THR 63 CO 0.18 0.31 0.26 -1.00 -0.69 0.00 0.00 174.62 173.69 2yu7 s HIS 64 N 1.81 3.29 -0.27 4.92 3.76 -1.25 -1.94 115.29 125.60 2yu7 s HIS 64 Ca 0.05 -1.21 -0.09 0.00 -0.15 0.00 0.00 55.06 53.66 2yu7 s HIS 64 Cb -0.13 -2.80 -0.04 0.00 1.11 0.00 0.00 32.58 30.73 2yu7 s HIS 64 CO -0.07 -0.77 0.13 0.42 -0.85 0.00 0.00 174.74 173.60 2yu7 s ILE 65 N 1.51 4.74 0.01 0.60 1.01 0.89 -4.90 121.20 125.07 2yu7 s ILE 65 Ca 0.03 -0.05 -0.30 0.00 0.00 0.00 0.00 60.65 60.32 2yu7 s ILE 65 Cb -0.22 -3.25 -0.08 0.00 0.01 0.00 0.00 42.46 38.93 2yu7 s ILE 65 CO 0.05 0.28 1.78 -0.54 0.00 0.00 0.00 174.94 176.51 2yu7 s LYS 66 N 1.67 4.17 -0.51 2.79 1.02 -1.26 -1.13 119.74 126.50 2yu7 s LYS 66 Ca 0.07 2.40 -0.17 0.00 0.02 0.00 0.00 55.97 58.28 2yu7 s LYS 66 Cb -0.16 -3.96 0.08 0.00 -0.52 0.00 0.00 37.83 33.28 2yu7 s LYS 66 CO 0.07 -0.87 0.51 0.08 -0.92 0.00 0.00 175.35 174.23 2yu7 s VAL 67 N 3.86 5.07 0.16 3.17 1.01 0.04 -4.64 120.40 129.07 2yu7 s VAL 67 Ca 0.80 -0.94 -0.30 0.00 0.00 0.00 0.00 61.98 61.54 2yu7 s VAL 67 Cb -0.39 -4.25 -0.08 0.00 0.00 0.00 0.00 36.38 31.67 2yu7 s VAL 67 CO 0.35 -0.75 1.23 -0.04 0.00 0.00 0.00 175.10 175.89 2yu7 s MET 68 N 2.06 4.45 -0.31 2.72 -1.94 -0.36 -2.90 119.30 123.02 2yu7 s MET 68 Ca 0.08 1.90 0.03 0.00 -1.71 0.00 0.00 55.69 55.99 2yu7 s MET 68 Cb -0.23 -3.25 0.09 0.00 2.01 0.00 0.00 34.83 33.44 2yu7 s MET 68 CO 0.08 -0.17 0.00 0.00 -0.01 0.00 0.00 175.02 174.91 2yu7 s GLU 70 N 1.05 3.16 1.74 0.00 2.02 -1.05 -4.86 118.70 120.76 2yu7 s GLU 70 Ca 0.04 -1.78 0.00 0.00 0.02 0.00 0.00 54.97 53.25 2yu7 s GLU 70 Cb -0.19 -4.35 0.00 0.00 0.10 0.00 0.00 34.13 29.69 2yu7 s GLU 70 CO -0.08 -1.40 0.00 0.41 0.02 0.00 0.00 175.26 174.21 2yu7 n GLY 71 N 4.99 1.80 1.06 -1.39 0.00 -1.26 -2.90 105.19 107.49 2yu7 n GLY 71 Ca -0.05 0.14 0.04 0.00 0.00 0.00 0.00 46.02 46.15 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 0.00 1.91 3.40 -0.02 0.00 -1.26 -5.09 105.19 104.13 2yu7 n GLY 72 Ca 0.00 -0.79 -0.20 0.00 0.00 0.00 0.00 46.02 45.02 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 -0.77 1.63 -0.01 1.61 3.00 -1.14 -4.61 118.95 118.66 2yu7 s ARG 73 Ca 0.28 -1.93 0.02 0.00 0.00 0.00 0.00 55.73 54.11 2yu7 s ARG 73 Cb 0.31 -0.49 -0.00 0.00 0.00 0.00 0.00 34.95 34.76 2yu7 s ARG 73 CO -0.11 -0.33 -0.07 0.71 0.00 0.00 0.00 175.30 175.50 2yu7 s TYR 74 N -3.47 0.65 0.03 -0.53 2.02 0.63 -2.51 117.35 114.17 2yu7 s TYR 74 Ca 0.34 -0.13 -0.02 0.00 -0.37 0.00 0.00 57.07 56.89 2yu7 s TYR 74 Cb 0.06 -0.43 -0.02 0.00 -0.40 0.00 0.00 41.96 41.17 2yu7 s TYR 74 CO 0.15 -0.03 0.02 -0.08 -1.57 0.00 0.00 175.55 174.05 2yu7 s THR 75 N -0.07 0.15 -0.14 -0.71 -1.32 0.30 0.14 115.64 114.00 2yu7 s THR 75 Ca 0.01 -1.21 -0.02 0.00 -1.21 0.00 0.00 61.69 59.26 2yu7 s THR 75 Cb -0.04 -0.84 0.04 0.00 -1.51 0.00 0.00 72.50 70.16 2yu7 s THR 75 CO -0.00 -0.67 0.01 0.68 -2.21 0.00 0.00 174.62 172.43 2yu7 s VAL 76 N -2.54 0.53 -0.97 5.08 -7.23 -1.26 -1.22 120.40 112.78 2yu7 s VAL 76 Ca -0.06 -0.26 -0.09 0.00 -1.81 0.00 0.00 61.98 59.76 2yu7 s VAL 76 Cb -0.02 -0.84 0.01 0.00 0.56 0.00 0.00 36.38 36.09 2yu7 s VAL 76 CO -0.05 0.04 0.17 0.61 -0.31 0.00 0.00 175.10 175.56 2yu7 n GLY 77 N 5.07 -0.25 0.00 2.32 0.00 -1.26 -4.77 105.19 106.30 2yu7 n GLY 77 Ca -0.09 0.16 0.00 0.00 0.00 0.00 0.00 46.02 46.09 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 -1.96 -1.81 0.08 -0.02 0.00 -1.26 -5.00 105.19 95.23 2yu7 n GLY 78 Ca -0.17 -1.12 -0.05 0.00 0.00 0.00 0.00 46.02 44.68 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 -8.00 0.99 8.10 -2.00 -3.45 115.31 110.95 2yu7 h LEU 79 Ca 0.00 0.00 -0.44 0.00 0.11 0.00 0.00 57.88 57.55 2yu7 h LEU 79 Cb 0.00 0.00 -0.10 0.00 -0.44 0.00 0.00 40.66 40.12 2yu7 h LEU 79 CO 0.00 0.89 1.87 -0.62 -4.11 0.00 0.00 178.44 176.47 2yu7 n GLU 80 N -3.32 0.00 -3.68 0.17 -0.58 -1.26 -4.83 120.64 107.14 2yu7 n GLU 80 Ca 0.00 -0.00 -0.38 0.00 -0.42 0.00 0.00 57.16 56.36 2yu7 n GLU 80 Cb 0.90 -1.30 -0.10 0.00 -0.57 0.00 0.00 31.44 30.36 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 5.34 3.70 0.58 2.62 -4.23 -1.26 -3.99 115.64 118.41 2yu7 s THR 81 Ca 1.34 -1.90 -0.09 0.00 -1.18 0.00 0.00 61.69 59.86 2yu7 s THR 81 Cb -1.09 -3.47 -0.03 0.00 1.34 0.00 0.00 72.50 69.24 2yu7 s THR 81 CO 0.52 -0.71 0.95 -0.36 -0.54 0.00 0.00 174.62 174.49 2yu7 s PHE 82 N 1.25 3.56 0.13 3.99 0.40 0.12 -4.74 117.98 122.69 2yu7 s PHE 82 Ca 0.07 1.09 -0.10 0.00 -0.60 0.00 0.00 56.93 57.38 2yu7 s PHE 82 Cb -0.24 -2.62 -0.08 0.00 0.51 0.00 0.00 43.02 40.59 2yu7 s PHE 82 CO -0.02 -0.61 1.38 -0.44 0.70 0.00 0.00 175.22 176.23 2yu7 h ASP 83 N -0.17 0.88 -5.23 1.36 3.32 -1.87 0.18 116.42 114.89 2yu7 h ASP 83 Ca -0.45 -0.52 -0.07 0.00 0.02 0.00 0.00 57.03 56.01 2yu7 h ASP 83 Cb 1.20 -0.26 -0.10 0.00 0.22 0.00 0.00 39.33 40.40 2yu7 h ASP 83 CO 0.62 1.31 -0.15 -0.44 -1.72 0.00 0.00 179.24 178.86 2yu7 s SER 84 N -7.02 -0.08 0.40 6.45 0.01 -1.26 -4.28 113.70 107.92 2yu7 s SER 84 Ca -0.10 -0.86 0.09 0.00 1.31 0.00 0.00 55.95 56.40 2yu7 s SER 84 Cb 0.10 0.55 0.88 0.00 0.21 0.00 0.00 66.02 67.76 2yu7 s SER 84 CO 0.89 -1.07 2.00 -0.07 0.41 0.00 0.00 173.24 175.40 2yu7 h LEU 85 N 2.32 0.50 -1.51 2.44 -0.00 -1.97 -0.35 115.31 116.73 2yu7 h LEU 85 Ca -0.28 0.00 0.14 0.00 -0.00 0.00 0.00 57.88 57.74 2yu7 h LEU 85 Cb 1.25 -0.11 -0.05 0.00 -0.00 0.00 0.00 40.66 41.75 2yu7 h LEU 85 CO 0.39 0.33 0.51 0.74 -0.00 0.00 0.00 178.44 180.41 2yu7 h THR 86 N 0.57 0.82 0.08 0.22 2.02 -1.98 0.30 112.91 114.94 2yu7 h THR 86 Ca 0.25 -0.17 -0.33 0.00 0.77 0.00 0.00 66.41 66.94 2yu7 h THR 86 Cb 0.26 0.29 -0.02 0.00 -1.74 0.00 0.00 68.15 66.94 2yu7 h THR 86 CO -0.07 0.09 -1.78 -0.67 0.37 0.00 0.00 175.52 173.45 2yu7 n ASP 87 N -4.49 2.04 -0.16 4.18 2.03 -0.47 -2.50 116.55 117.17 2yu7 n ASP 87 Ca 0.14 0.27 0.05 0.00 0.52 0.00 0.00 54.79 55.77 2yu7 n ASP 87 Cb 0.49 -0.89 0.34 0.00 -0.72 0.00 0.00 41.12 40.34 2yu7 n ASP 87 CO 0.00 0.00 0.00 0.25 -1.92 0.00 0.00 177.20 175.53 2yu7 h LEU 88 N -0.29 0.68 0.00 -2.67 6.46 -0.74 -0.70 115.31 118.05 2yu7 h LEU 88 Ca -0.41 -0.01 -0.06 0.00 -0.12 0.00 0.00 57.88 57.29 2yu7 h LEU 88 Cb 1.79 -0.16 -0.01 0.00 -0.73 0.00 0.00 40.66 41.56 2yu7 h LEU 88 CO -0.02 0.46 -0.34 0.58 -0.62 0.00 0.00 178.44 178.51 2yu7 h VAL 89 N 0.79 1.40 -0.76 1.05 2.07 -0.57 -3.24 116.25 116.98 2yu7 h VAL 89 Ca 0.27 -2.17 0.22 0.00 0.82 0.00 0.00 66.70 65.84 2yu7 h VAL 89 Cb 0.11 2.76 -0.03 0.00 -1.52 0.00 0.00 31.29 32.61 2yu7 h VAL 89 CO -0.08 0.47 0.55 -0.33 0.02 0.00 0.00 177.57 178.20 2yu7 h GLU 90 N -1.00 0.00 -0.06 1.57 4.39 -1.37 0.46 114.58 118.57 2yu7 h GLU 90 Ca -0.09 0.00 -0.18 0.00 0.34 0.00 0.00 59.36 59.43 2yu7 h GLU 90 Cb 0.99 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.64 2yu7 h GLU 90 CO -0.05 0.00 -0.74 1.25 -1.16 0.00 0.00 179.01 178.30 2yu7 h HIS 91 N 0.00 0.46 0.00 4.33 2.76 -1.23 -3.18 115.15 118.29 2yu7 h HIS 91 Ca 0.36 -0.21 -0.11 0.00 -2.20 0.00 0.00 60.37 58.22 2yu7 h HIS 91 Cb 1.46 -0.07 -0.02 0.00 1.55 0.00 0.00 27.41 30.34 2yu7 h HIS 91 CO 0.00 0.96 -0.87 0.74 -1.30 0.00 0.00 177.93 177.46 2yu7 h PHE 92 N 0.22 0.00 0.00 5.26 0.04 -0.45 -2.67 116.94 119.35 2yu7 h PHE 92 Ca -0.03 0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.73 2yu7 h PHE 92 Cb 1.32 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 39.46 2yu7 h PHE 92 CO 0.04 0.42 -0.06 0.87 -0.60 0.00 0.00 178.31 178.98 2yu7 h LYS 93 N 0.00 0.00 0.00 1.51 1.57 -0.27 1.52 116.57 120.90 2yu7 h LYS 93 Ca -0.06 0.00 -0.31 0.00 -1.87 0.00 0.00 60.65 58.40 2yu7 h LYS 93 Cb 1.37 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 -2.19 0.36 -0.57 0.00 0.00 179.45 177.15 2yu7 n LYS 94 N -3.50 0.52 -0.10 3.15 2.85 -1.23 -4.67 118.16 115.17 2yu7 n LYS 94 Ca -0.02 0.12 -0.23 0.00 -1.05 0.00 0.00 58.31 57.13 2yu7 n LYS 94 Cb 0.18 -1.42 -0.11 0.00 -0.65 0.00 0.00 35.03 33.03 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 -3.13 1.55 0.00 0.58 -2.24 -1.01 -5.11 114.28 104.92 2yu7 n THR 95 Ca -0.37 -0.15 0.00 0.00 -2.27 0.00 0.00 64.05 61.26 2yu7 n THR 95 Cb 0.89 -1.98 0.00 0.00 -2.10 0.00 0.00 70.33 67.14 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 2.17 3.63 3.38 0.00 0.52 -5.00 105.19 111.35 2yu7 n GLY 96 Ca -0.36 -1.93 -0.36 0.00 0.00 0.00 0.00 46.02 43.37 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 -2.81 5.04 -0.34 -0.61 1.01 -0.60 -4.82 121.20 118.07 2yu7 s ILE 97 Ca 0.00 0.06 -0.12 0.00 0.00 0.00 0.00 60.65 60.59 2yu7 s ILE 97 Cb 0.00 -3.32 -0.01 0.00 0.01 0.00 0.00 42.46 39.14 2yu7 s ILE 97 CO 0.00 0.39 0.22 -0.70 0.00 0.00 0.00 174.94 174.85 2yu7 s GLU 98 N 0.84 3.32 0.42 2.79 2.12 -1.26 -0.71 118.70 126.21 2yu7 s GLU 98 Ca 0.06 -0.76 -0.24 0.00 0.36 0.00 0.00 54.97 54.39 2yu7 s GLU 98 Cb -0.13 -3.76 -0.08 0.00 0.26 0.00 0.00 34.13 30.42 2yu7 s GLU 98 CO 0.02 -0.50 1.12 -1.21 -0.54 0.00 0.00 175.26 174.15 2yu7 s GLU 99 N 1.67 4.00 0.38 4.30 2.02 -0.53 -4.89 118.70 125.66 2yu7 s GLU 99 Ca 0.05 1.68 0.21 0.00 0.02 0.00 0.00 54.97 56.94 2yu7 s GLU 99 Cb -0.18 -2.53 1.28 0.00 0.10 0.00 0.00 34.13 32.80 2yu7 s GLU 99 CO 0.09 -0.32 1.62 0.00 0.02 0.00 0.00 175.26 176.67 2yu7 h ALA 100 N 2.39 2.26 -0.44 5.21 0.00 -1.98 0.86 119.26 127.56 2yu7 h ALA 100 Ca -0.49 0.20 -0.11 0.00 0.00 0.00 0.00 54.91 54.51 2yu7 h ALA 100 Cb 1.23 0.23 -0.01 0.00 0.00 0.00 0.00 17.79 19.24 2yu7 h ALA 100 CO 0.62 -0.94 -0.15 0.77 0.00 0.00 0.00 179.25 179.55 2yu7 h SER 101 N 0.14 0.90 0.00 0.00 0.02 -2.04 -3.47 113.55 109.09 2yu7 h SER 101 Ca 0.80 -0.38 0.00 0.00 -0.84 0.00 0.00 61.79 61.37 2yu7 h SER 101 Cb 2.14 -0.25 0.00 0.00 0.14 0.00 0.00 62.40 64.43 2yu7 h SER 101 CO -0.61 1.07 0.00 0.61 -1.14 0.00 0.00 176.83 176.76 2yu7 n GLY 102 N -0.15 1.41 2.81 -3.77 0.00 0.30 -5.13 105.19 100.66 2yu7 n GLY 102 Ca -0.01 -0.03 -0.34 0.00 0.00 0.00 0.00 46.02 45.65 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 -3.67 -3.92 4.61 0.00 -1.26 -4.40 120.51 111.87 2yu7 n ALA 103 Ca 0.00 -0.23 -0.30 0.00 0.00 0.00 0.00 53.44 52.90 2yu7 n ALA 103 Cb 0.00 -1.17 -0.15 0.00 0.00 0.00 0.00 19.45 18.13 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 -1.78 2.71 -0.19 0.00 0.08 -1.26 -1.45 117.98 116.10 2yu7 s PHE 104 Ca 0.45 -2.20 -0.25 0.00 0.12 0.00 0.00 56.93 55.05 2yu7 s PHE 104 Cb -0.35 -2.09 -0.01 0.00 -0.57 0.00 0.00 43.02 40.00 2yu7 s PHE 104 CO 0.64 -0.87 0.82 0.08 -0.10 0.00 0.00 175.22 175.79 2yu7 s VAL 105 N 1.28 4.87 -0.17 -0.44 1.01 0.11 -4.92 120.40 122.13 2yu7 s VAL 105 Ca 0.04 1.60 -0.04 0.00 0.00 0.00 0.00 61.98 63.58 2yu7 s VAL 105 Cb -0.18 -4.12 -0.02 0.00 0.00 0.00 0.00 36.38 32.05 2yu7 s VAL 105 CO -0.12 0.00 -0.04 -0.31 0.00 0.00 0.00 175.10 174.63 2yu7 s TYR 106 N 2.32 2.99 -0.37 5.22 2.02 -1.26 -1.55 117.35 126.73 2yu7 s TYR 106 Ca 0.37 -0.45 -0.09 0.00 -0.37 0.00 0.00 57.07 56.53 2yu7 s TYR 106 Cb -0.16 -1.99 0.04 0.00 -0.40 0.00 0.00 41.96 39.45 2yu7 s TYR 106 CO 0.11 -0.17 0.18 -0.51 -1.57 0.00 0.00 175.55 173.59 2yu7 s LEU 107 N 0.65 4.65 0.00 -1.29 1.43 -1.26 -4.39 118.68 118.46 2yu7 s LEU 107 Ca -0.02 -1.14 0.00 0.00 -1.03 0.00 0.00 54.13 51.93 2yu7 s LEU 107 Cb -0.14 -1.96 0.00 0.00 0.03 0.00 0.00 46.19 44.12 2yu7 s LEU 107 CO 0.02 -0.39 0.00 0.54 0.23 0.00 0.00 176.35 176.75 2yu7 n ARG 108 N 4.91 1.56 -3.47 1.70 1.74 -0.80 -4.48 116.66 117.83 2yu7 n ARG 108 Ca -0.12 0.00 -0.43 0.00 -0.77 0.00 0.00 57.85 56.54 2yu7 n ARG 108 Cb 0.45 -0.82 -0.06 0.00 -1.02 0.00 0.00 32.46 31.00 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 -1.65 2.88 -0.74 5.56 -0.21 -0.65 -5.03 119.66 119.83 2yu7 s GLN 109 Ca 0.00 -2.05 -0.26 0.00 0.02 0.00 0.00 55.36 53.07 2yu7 s GLN 109 Cb 0.00 -4.10 -0.03 0.00 1.00 0.00 0.00 33.01 29.88 2yu7 s GLN 109 CO 0.00 -1.24 1.90 -1.25 -2.12 0.00 0.00 175.29 172.58 2yu7 s PRO 110 N 0.88 2.59 -0.10 2.91 0.04 -1.26 -2.01 135.00 138.05 2yu7 s PRO 110 Ca 0.10 0.22 -0.34 0.00 0.04 0.00 0.00 61.00 61.02 2yu7 s PRO 110 Cb -0.22 -4.68 -0.11 0.00 0.04 0.00 0.00 34.50 29.52 2yu7 s PRO 110 CO -0.03 -3.02 1.91 0.98 0.04 0.00 0.00 177.00 176.89 2yu7 n TYR 111 N 13.30 2.30 -2.55 0.56 9.36 0.53 -4.71 117.16 135.96 2yu7 n TYR 111 Ca 0.29 -0.02 -0.28 0.00 3.32 0.00 0.00 57.90 61.21 2yu7 n TYR 111 Cb 0.50 -2.67 0.00 0.00 -0.63 0.00 0.00 39.34 36.54 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 4.38 3.53 0.64 2.98 1.51 -1.26 -4.30 117.35 124.83 2yu7 s TYR 112 Ca 0.94 0.82 -0.18 0.00 -1.01 0.00 0.00 57.07 57.64 2yu7 s TYR 112 Cb -0.68 -2.39 -0.01 0.00 -0.11 0.00 0.00 41.96 38.77 2yu7 s TYR 112 CO 0.51 -0.38 1.27 0.45 -1.11 0.00 0.00 175.55 176.28 2yu7 s SER 113 N -4.14 4.69 0.00 2.29 0.15 -1.23 -4.99 113.70 110.47 2yu7 s SER 113 Ca 0.49 2.55 0.00 0.00 0.70 0.00 0.00 55.95 59.69 2yu7 s SER 113 Cb -0.10 -2.61 0.00 0.00 -1.71 0.00 0.00 66.02 61.59 2yu7 s SER 113 CO 0.46 -1.94 0.00 0.61 1.20 0.00 0.00 173.24 173.57 2yu7 n GLY 114 N 0.77 1.30 3.77 9.45 0.00 -1.26 -5.10 105.19 114.12 2yu7 n GLY 114 Ca 0.15 0.10 -0.37 0.00 0.00 0.00 0.00 46.02 45.90 2yu7 n GLY 114 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2yu7 s PRO 115 N -0.95 3.79 0.71 1.61 0.04 -1.26 -5.01 135.00 133.92 2yu7 s PRO 115 Ca 0.00 1.78 -0.14 0.00 0.04 0.00 0.00 61.00 62.68 2yu7 s PRO 115 Cb 0.00 -2.43 0.02 0.00 0.04 0.00 0.00 34.50 32.13 2yu7 s PRO 115 CO 0.00 -0.53 1.11 -1.54 0.04 0.00 0.00 177.00 176.09 2yu7 s SER 116 N -1.34 4.77 0.33 6.66 1.04 -1.26 -5.06 113.70 118.84 2yu7 s SER 116 Ca 0.63 1.99 0.10 0.00 0.48 0.00 0.00 55.95 59.14 2yu7 s SER 116 Cb -0.29 -2.55 -0.06 0.00 0.10 0.00 0.00 66.02 63.23 2yu7 s SER 116 CO 0.35 -1.86 -0.06 -0.55 0.98 0.00 0.00 173.24 172.10 2yu7 s SER 117 N -2.77 3.95 0.00 7.02 0.15 -1.26 -5.26 113.70 115.53 2yu7 s SER 117 Ca 0.66 -1.05 0.00 0.00 0.70 0.00 0.00 55.95 56.26 2yu7 s SER 117 Cb -0.20 -0.45 0.00 0.00 -1.71 0.00 0.00 66.02 63.66 2yu7 s SER 117 CO 0.47 -0.17 0.00 0.61 1.20 0.00 0.00 173.24 175.35