#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 3.74 -0.30 1.61 1.04 -1.26 -5.07 113.70 113.46 2yu7 s SER 2 Ca 0.00 -0.50 -0.16 0.00 0.48 0.00 0.00 55.95 55.77 2yu7 s SER 2 Cb 0.00 -1.61 0.17 0.00 0.10 0.00 0.00 66.02 64.68 2yu7 s SER 2 CO 0.00 0.01 1.03 -0.55 0.98 0.00 0.00 173.24 174.71 2yu7 s SER 3 N 1.25 -0.50 -0.77 7.02 0.15 -1.26 -5.10 113.70 114.50 2yu7 s SER 3 Ca 0.03 0.69 0.03 0.00 0.70 0.00 0.00 55.95 57.40 2yu7 s SER 3 Cb -0.14 1.54 0.22 0.00 -1.71 0.00 0.00 66.02 65.93 2yu7 s SER 3 CO -0.06 -0.10 0.73 0.61 1.20 0.00 0.00 173.24 175.62 2yu7 n GLY 4 N 4.79 4.39 3.91 9.45 0.00 -1.26 -5.07 105.19 121.40 2yu7 n GLY 4 Ca -0.10 -2.66 -0.31 0.00 0.00 0.00 0.00 46.02 42.96 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 -1.46 6.28 0.45 1.61 0.01 -1.26 -5.12 113.70 114.22 2yu7 s SER 5 Ca 0.31 0.24 0.06 0.00 1.31 0.00 0.00 55.95 57.87 2yu7 s SER 5 Cb 0.02 -1.91 -0.04 0.00 0.21 0.00 0.00 66.02 64.30 2yu7 s SER 5 CO -0.09 0.17 0.16 -0.94 0.41 0.00 0.00 173.24 172.95 2yu7 s SER 6 N -2.52 4.33 0.00 2.44 1.04 -1.26 -5.08 113.70 112.65 2yu7 s SER 6 Ca 0.34 -1.24 0.00 0.00 0.48 0.00 0.00 55.95 55.54 2yu7 s SER 6 Cb -0.13 -0.17 0.00 0.00 0.10 0.00 0.00 66.02 65.82 2yu7 s SER 6 CO 0.27 -0.67 0.00 0.61 0.98 0.00 0.00 173.24 174.44 2yu7 n GLY 7 N -1.28 -1.41 0.08 7.32 0.00 -1.26 -5.05 105.19 103.59 2yu7 n GLY 7 Ca -0.05 0.54 -0.02 0.00 0.00 0.00 0.00 46.02 46.49 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 0.67 -1.65 1.61 4.27 -1.26 -4.07 117.44 117.00 2yu7 n TRP 8 Ca 0.00 0.23 -0.46 0.00 -3.89 0.00 0.00 57.50 53.37 2yu7 n TRP 8 Cb 0.00 -1.02 -0.04 0.00 -1.36 0.00 0.00 31.31 28.90 2yu7 n TRP 8 CO 0.00 0.00 0.00 0.98 -2.29 0.00 0.00 177.69 176.38 2yu7 n TYR 9 N -2.81 2.04 0.00 -2.67 9.36 -1.26 -4.24 117.16 117.58 2yu7 n TYR 9 Ca -0.15 0.43 0.00 0.00 3.32 0.00 0.00 57.90 61.50 2yu7 n TYR 9 Cb 0.90 -2.45 0.00 0.00 -0.63 0.00 0.00 39.34 37.16 2yu7 n TYR 9 CO 0.00 0.00 0.00 0.72 0.22 0.00 0.00 176.86 177.80 2yu7 n HIS 10 N 2.34 0.00 0.00 2.98 8.25 -0.75 -4.52 115.22 123.52 2yu7 n HIS 10 Ca 0.14 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.60 2yu7 n HIS 10 Cb 0.29 -0.03 0.00 0.00 1.12 0.00 0.00 29.99 31.37 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 1.83 1.12 3.48 -1.41 0.00 -1.26 -5.01 105.19 103.94 2yu7 n GLY 11 Ca 0.00 -0.41 -0.42 0.00 0.00 0.00 0.00 46.02 45.19 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 3.23 0.01 1.61 2.46 -1.26 -2.24 115.29 119.11 2yu7 s HIS 12 Ca 0.00 -0.47 -0.28 0.00 0.47 0.00 0.00 55.06 54.78 2yu7 s HIS 12 Cb 0.00 -2.57 0.08 0.00 -0.13 0.00 0.00 32.58 29.96 2yu7 s HIS 12 CO 0.00 -0.53 0.72 1.41 -2.47 0.00 0.00 174.74 173.87 2yu7 s MET 13 N 1.71 1.04 0.02 2.88 0.00 -1.26 -5.01 119.30 118.68 2yu7 s MET 13 Ca 0.06 -0.06 0.08 0.00 0.00 0.00 0.00 55.69 55.77 2yu7 s MET 13 Cb -0.18 0.49 -0.02 0.00 0.00 0.00 0.00 34.83 35.11 2yu7 s MET 13 CO 0.10 -0.39 -0.24 -1.54 0.00 0.00 0.00 175.02 172.95 2yu7 s SER 14 N -1.83 2.90 0.59 1.11 1.04 -1.26 -4.59 113.70 111.66 2yu7 s SER 14 Ca -0.04 -0.52 0.33 0.00 0.48 0.00 0.00 55.95 56.19 2yu7 s SER 14 Cb -0.00 -0.28 1.15 0.00 0.10 0.00 0.00 66.02 66.98 2yu7 s SER 14 CO -0.01 0.25 1.40 1.23 0.98 0.00 0.00 173.24 177.09 2yu7 h GLY 15 N 5.05 0.00 1.28 7.32 0.00 -1.99 1.13 103.07 115.86 2yu7 h GLY 15 Ca -0.44 0.00 -0.20 0.00 0.00 0.00 0.00 47.33 46.69 2yu7 h GLY 15 CO 0.45 0.00 -0.69 -1.33 0.00 0.00 0.00 176.54 174.96 2yu7 h GLY 16 N 0.00 0.80 1.70 4.60 0.00 -2.01 -2.93 103.07 105.22 2yu7 h GLY 16 Ca 0.59 -1.06 -0.26 0.00 0.00 0.00 0.00 47.33 46.60 2yu7 h GLY 16 CO -0.01 0.94 -1.17 -1.61 0.00 0.00 0.00 176.54 174.70 2yu7 h GLN 17 N 0.52 0.23 0.49 4.80 4.15 0.88 -3.32 115.11 122.85 2yu7 h GLN 17 Ca -0.03 -0.38 -0.02 0.00 0.77 0.00 0.00 58.65 58.99 2yu7 h GLN 17 Cb 1.30 0.14 0.00 0.00 0.21 0.00 0.00 27.48 29.13 2yu7 h GLN 17 CO 0.14 1.17 -0.24 0.00 -1.93 0.00 0.00 178.83 177.97 2yu7 h ALA 18 N 0.67 -1.17 -1.00 3.38 0.00 -1.31 0.71 119.26 120.55 2yu7 h ALA 18 Ca -0.11 -0.14 0.36 0.00 0.00 0.00 0.00 54.91 55.02 2yu7 h ALA 18 Cb 1.90 0.28 -0.18 0.00 0.00 0.00 0.00 17.79 19.78 2yu7 h ALA 18 CO 0.19 -1.12 0.34 0.93 0.00 0.00 0.00 179.25 179.59 2yu7 h GLU 19 N -0.66 0.00 -0.24 0.00 5.08 -1.68 0.90 114.58 117.98 2yu7 h GLU 19 Ca -0.07 -0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 58.17 2yu7 h GLU 19 Cb 0.51 -0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.76 2yu7 h GLU 19 CO 0.10 0.00 -0.35 1.15 -1.00 0.00 0.00 179.01 178.92 2yu7 h THR 20 N 0.00 1.31 0.29 1.13 2.02 -1.60 -2.88 112.91 113.19 2yu7 h THR 20 Ca 0.76 -1.54 -0.01 0.00 0.77 0.00 0.00 66.41 66.38 2yu7 h THR 20 Cb 1.86 1.72 0.00 0.00 -1.74 0.00 0.00 68.15 70.00 2yu7 h THR 20 CO -0.83 0.49 -0.14 -0.07 0.37 0.00 0.00 175.52 175.33 2yu7 h LEU 21 N 0.38 -0.33 -0.83 2.58 3.38 0.31 -1.85 115.31 118.95 2yu7 h LEU 21 Ca 0.03 0.01 0.08 0.00 0.09 0.00 0.00 57.88 58.08 2yu7 h LEU 21 Cb 0.93 0.09 -0.10 0.00 0.09 0.00 0.00 40.66 41.66 2yu7 h LEU 21 CO 0.08 -0.21 -0.54 -0.07 0.09 0.00 0.00 178.44 177.80 2yu7 h LEU 22 N -0.46 -1.94 -1.99 1.67 3.38 -0.94 1.15 115.31 116.18 2yu7 h LEU 22 Ca -0.04 0.29 0.22 0.00 0.09 0.00 0.00 57.88 58.44 2yu7 h LEU 22 Cb 0.30 0.85 -0.03 0.00 0.09 0.00 0.00 40.66 41.87 2yu7 h LEU 22 CO 0.07 -0.23 0.54 1.56 0.09 0.00 0.00 178.44 180.46 2yu7 h GLN 23 N -0.05 0.01 -0.23 1.13 4.20 -1.58 -0.78 115.11 117.80 2yu7 h GLN 23 Ca 0.13 -0.00 0.03 0.00 0.06 0.00 0.00 58.65 58.87 2yu7 h GLN 23 Cb 0.40 -0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.15 2yu7 h GLN 23 CO -0.81 0.00 0.06 0.00 -0.67 0.00 0.00 178.83 177.41 2yu7 h ALA 24 N 1.62 0.24 -0.38 3.87 0.00 0.23 -2.77 119.26 122.07 2yu7 h ALA 24 Ca 0.36 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 55.28 2yu7 h ALA 24 Cb 1.43 0.03 -0.02 0.00 0.00 0.00 0.00 17.79 19.23 2yu7 h ALA 24 CO -0.01 -0.36 0.15 -0.22 0.00 0.00 0.00 179.25 178.82 2yu7 h LYS 25 N 0.16 0.57 0.00 0.00 3.64 -0.83 -3.47 116.57 116.64 2yu7 h LYS 25 Ca 0.10 -0.10 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2yu7 h LYS 25 Cb 0.08 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 31.81 2yu7 h LYS 25 CO -0.11 0.55 0.00 0.41 -2.27 0.00 0.00 179.45 178.02 2yu7 n GLY 26 N -0.76 0.56 3.47 5.01 0.00 -1.05 -5.04 105.19 107.39 2yu7 n GLY 26 Ca -0.01 -0.83 -0.37 0.00 0.00 0.00 0.00 46.02 44.82 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 -2.68 3.65 0.48 1.61 2.02 -1.26 -5.09 118.70 117.43 2yu7 s GLU 27 Ca 0.00 -0.49 -0.22 0.00 0.02 0.00 0.00 54.97 54.28 2yu7 s GLU 27 Cb 0.00 -3.43 -0.07 0.00 0.10 0.00 0.00 34.13 30.73 2yu7 s GLU 27 CO 0.00 -0.23 1.16 -1.25 0.02 0.00 0.00 175.26 174.96 2yu7 s PRO 28 N 1.64 3.67 -1.02 0.39 0.04 -1.26 -3.49 135.00 134.97 2yu7 s PRO 28 Ca 0.06 1.74 -0.05 0.00 0.04 0.00 0.00 61.00 62.79 2yu7 s PRO 28 Cb -0.16 -2.32 0.01 0.00 0.04 0.00 0.00 34.50 32.07 2yu7 s PRO 28 CO 0.05 -0.62 0.60 0.91 0.04 0.00 0.00 177.00 177.98 2yu7 n TRP 29 N -0.67 -1.64 -3.62 0.56 5.03 0.13 -4.71 117.44 112.52 2yu7 n TRP 29 Ca 0.08 0.51 -0.39 0.00 3.03 0.00 0.00 57.50 60.73 2yu7 n TRP 29 Cb 0.49 -3.59 -0.11 0.00 -1.03 0.00 0.00 31.31 27.06 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 -3.08 4.88 0.12 -0.99 2.01 -1.19 -1.70 115.64 115.69 2yu7 s THR 30 Ca 0.30 -0.26 0.04 0.00 0.31 0.00 0.00 61.69 62.08 2yu7 s THR 30 Cb -0.13 -3.46 -0.04 0.00 0.01 0.00 0.00 72.50 68.88 2yu7 s THR 30 CO 0.37 0.09 0.09 0.72 -0.69 0.00 0.00 174.62 175.20 2yu7 s PHE 31 N 1.67 3.14 -0.12 4.92 -0.71 -0.94 -0.03 117.98 125.90 2yu7 s PHE 31 Ca 0.06 0.02 -0.06 0.00 -1.04 0.00 0.00 56.93 55.90 2yu7 s PHE 31 Cb -0.17 -1.56 0.05 0.00 -1.21 0.00 0.00 43.02 40.14 2yu7 s PHE 31 CO 0.08 0.52 0.29 -0.48 -1.34 0.00 0.00 175.22 174.29 2yu7 s LEU 32 N -2.70 0.22 -0.08 -1.99 0.05 0.57 -0.74 118.68 114.02 2yu7 s LEU 32 Ca 0.29 0.63 -0.14 0.00 0.05 0.00 0.00 54.13 54.97 2yu7 s LEU 32 Cb -0.11 0.90 -0.05 0.00 -2.05 0.00 0.00 46.19 44.88 2yu7 s LEU 32 CO 0.22 -0.18 0.34 -0.69 -0.55 0.00 0.00 176.35 175.49 2yu7 s VAL 33 N 1.39 5.20 0.34 1.48 1.01 -1.26 -2.26 120.40 126.31 2yu7 s VAL 33 Ca -0.09 0.67 0.03 0.00 0.00 0.00 0.00 61.98 62.59 2yu7 s VAL 33 Cb -0.10 -3.65 -0.01 0.00 0.00 0.00 0.00 36.38 32.61 2yu7 s VAL 33 CO -0.10 0.50 0.37 0.00 0.00 0.00 0.00 175.10 175.87 2yu7 s ARG 34 N -0.40 1.85 -0.19 2.72 1.70 -1.17 -1.80 118.95 121.65 2yu7 s ARG 34 Ca 0.20 -1.92 -0.09 0.00 -0.47 0.00 0.00 55.73 53.45 2yu7 s ARG 34 Cb -0.15 0.38 -0.05 0.00 -0.57 0.00 0.00 34.95 34.57 2yu7 s ARG 34 CO 0.09 -0.72 0.11 -1.21 -1.08 0.00 0.00 175.30 172.49 2yu7 s GLU 35 N -3.22 4.10 0.35 3.89 0.41 -0.95 -2.35 118.70 120.92 2yu7 s GLU 35 Ca 0.36 -0.24 -0.28 0.00 -0.41 0.00 0.00 54.97 54.40 2yu7 s GLU 35 Cb 0.01 -3.36 -0.10 0.00 -1.78 0.00 0.00 34.13 28.90 2yu7 s GLU 35 CO 0.25 0.32 1.31 0.45 -0.49 0.00 0.00 175.26 177.10 2yu7 s SER 36 N 0.28 6.64 0.08 -0.19 0.15 0.34 -4.52 113.70 116.48 2yu7 s SER 36 Ca 0.07 2.69 0.20 0.00 0.70 0.00 0.00 55.95 59.61 2yu7 s SER 36 Cb -0.11 -2.65 -0.13 0.00 -1.71 0.00 0.00 66.02 61.42 2yu7 s SER 36 CO -0.01 -0.62 0.80 0.18 1.20 0.00 0.00 173.24 174.78 2yu7 n LEU 37 N 0.61 0.66 0.00 3.45 4.77 -1.26 -4.64 117.00 120.60 2yu7 n LEU 37 Ca 0.01 0.27 0.00 0.00 -0.03 0.00 0.00 56.01 56.26 2yu7 n LEU 37 Cb 0.42 0.04 0.00 0.00 -2.33 0.00 0.00 43.42 41.55 2yu7 n LEU 37 CO 0.58 0.02 0.00 -1.20 -1.33 0.00 0.00 177.39 175.47 2yu7 n SER 38 N -2.70 0.00 -4.75 -1.43 7.64 -1.26 -4.94 113.62 106.18 2yu7 n SER 38 Ca -0.07 0.14 -0.41 0.00 1.01 0.00 0.00 58.87 59.54 2yu7 n SER 38 Cb 0.71 -0.42 -0.03 0.00 -1.01 0.00 0.00 64.21 63.46 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 -0.84 4.35 0.61 1.43 -1.52 -1.26 -4.99 119.66 117.44 2yu7 s GLN 39 Ca 0.00 2.16 -0.17 0.00 -1.95 0.00 0.00 55.36 55.40 2yu7 s GLN 39 Cb 0.00 -3.13 -0.03 0.00 -0.22 0.00 0.00 33.01 29.63 2yu7 s GLN 39 CO 0.00 -0.26 1.12 -1.25 -0.25 0.00 0.00 175.29 174.65 2yu7 s PRO 40 N -0.75 3.04 -0.73 2.91 0.04 -1.26 -3.39 135.00 134.86 2yu7 s PRO 40 Ca 0.55 1.49 -0.09 0.00 0.04 0.00 0.00 61.00 62.98 2yu7 s PRO 40 Cb -0.39 -1.97 0.09 0.00 0.04 0.00 0.00 34.50 32.27 2yu7 s PRO 40 CO 0.44 -1.07 0.23 0.41 0.04 0.00 0.00 177.00 177.05 2yu7 n GLY 41 N -0.23 -0.30 3.64 0.56 0.00 -1.26 -4.85 105.19 102.75 2yu7 n GLY 41 Ca 0.11 0.03 -0.23 0.00 0.00 0.00 0.00 46.02 45.92 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 -2.03 4.52 0.18 1.61 1.11 -1.22 -4.17 116.67 116.67 2yu7 s ASP 42 Ca 0.32 -0.63 0.07 0.00 0.18 0.00 0.00 52.55 52.50 2yu7 s ASP 42 Cb -0.19 -0.84 -0.04 0.00 1.07 0.00 0.00 42.92 42.92 2yu7 s ASP 42 CO 0.40 0.02 -0.15 -0.36 1.18 0.00 0.00 175.17 176.26 2yu7 s PHE 43 N -2.24 1.63 -0.16 4.23 0.40 -0.82 -0.51 117.98 120.51 2yu7 s PHE 43 Ca 0.31 -0.57 0.01 0.00 -0.60 0.00 0.00 56.93 56.07 2yu7 s PHE 43 Cb -0.07 -0.79 0.02 0.00 0.51 0.00 0.00 43.02 42.70 2yu7 s PHE 43 CO 0.19 0.29 -0.16 0.08 0.70 0.00 0.00 175.22 176.33 2yu7 s VAL 44 N -2.72 1.74 -0.54 -0.44 1.01 -0.99 0.09 120.40 118.54 2yu7 s VAL 44 Ca 0.19 -0.76 -0.20 0.00 0.00 0.00 0.00 61.98 61.20 2yu7 s VAL 44 Cb -0.02 -1.62 0.06 0.00 0.00 0.00 0.00 36.38 34.81 2yu7 s VAL 44 CO 0.05 0.47 0.72 -0.22 0.00 0.00 0.00 175.10 176.12 2yu7 s LEU 45 N 1.42 4.82 -0.25 3.92 1.98 -0.42 -3.05 118.68 127.10 2yu7 s LEU 45 Ca 0.05 -0.88 -0.09 0.00 -2.89 0.00 0.00 54.13 50.31 2yu7 s LEU 45 Cb -0.13 -2.50 -0.04 0.00 0.66 0.00 0.00 46.19 44.18 2yu7 s LEU 45 CO -0.11 -1.02 0.14 -0.44 -1.89 0.00 0.00 176.35 173.02 2yu7 s SER 46 N 2.91 5.72 -0.04 3.68 0.01 -0.96 -0.32 113.70 124.70 2yu7 s SER 46 Ca 0.18 -0.04 0.05 0.00 1.31 0.00 0.00 55.95 57.45 2yu7 s SER 46 Cb -0.18 -2.04 -0.01 0.00 0.21 0.00 0.00 66.02 64.00 2yu7 s SER 46 CO 0.12 -0.01 -0.19 -0.69 0.41 0.00 0.00 173.24 172.89 2yu7 s VAL 47 N 1.47 1.56 -0.19 3.43 1.01 -0.74 -0.31 120.40 126.62 2yu7 s VAL 47 Ca 0.06 -0.81 -0.20 0.00 0.00 0.00 0.00 61.98 61.04 2yu7 s VAL 47 Cb -0.15 -1.32 -0.03 0.00 0.00 0.00 0.00 36.38 34.88 2yu7 s VAL 47 CO 0.07 0.44 0.58 -0.22 0.00 0.00 0.00 175.10 175.97 2yu7 s LEU 48 N -0.16 4.15 0.20 3.92 2.96 0.96 -0.96 118.68 129.74 2yu7 s LEU 48 Ca 0.00 0.77 -0.15 0.00 -0.22 0.00 0.00 54.13 54.53 2yu7 s LEU 48 Cb -0.10 -2.81 -0.08 0.00 0.50 0.00 0.00 46.19 43.70 2yu7 s LEU 48 CO 0.01 -0.23 0.62 -0.94 -1.32 0.00 0.00 176.35 174.50 2yu7 s SER 49 N 1.16 6.86 0.00 3.68 1.04 0.48 0.18 113.70 127.11 2yu7 s SER 49 Ca 0.27 1.18 0.16 0.00 0.48 0.00 0.00 55.95 58.04 2yu7 s SER 49 Cb -0.16 -2.33 0.93 0.00 0.10 0.00 0.00 66.02 64.56 2yu7 s SER 49 CO 0.10 0.03 1.36 -0.67 0.98 0.00 0.00 173.24 175.04 2yu7 n ASP 50 N 0.54 0.00 -4.64 7.02 2.03 -1.26 -3.96 116.55 116.28 2yu7 n ASP 50 Ca -0.03 -0.44 -0.37 0.00 0.52 0.00 0.00 54.79 54.48 2yu7 n ASP 50 Cb 0.52 -0.03 -0.10 0.00 -0.72 0.00 0.00 41.12 40.79 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 -2.06 4.03 0.74 -0.67 -0.21 -1.26 -5.00 119.66 115.23 2yu7 s GLN 51 Ca 0.23 -0.29 -0.12 0.00 0.02 0.00 0.00 55.36 55.20 2yu7 s GLN 51 Cb 0.11 -3.54 0.04 0.00 1.00 0.00 0.00 33.01 30.62 2yu7 s GLN 51 CO 0.19 0.03 1.10 -1.25 -2.12 0.00 0.00 175.29 173.23 2yu7 s PRO 52 N 1.15 2.42 0.03 2.91 0.04 -1.26 -1.65 135.00 138.64 2yu7 s PRO 52 Ca 0.07 1.23 -0.03 0.00 0.04 0.00 0.00 61.00 62.31 2yu7 s PRO 52 Cb -0.14 -1.91 -0.28 0.00 0.04 0.00 0.00 34.50 32.21 2yu7 s PRO 52 CO 0.05 -1.53 0.96 1.57 0.04 0.00 0.00 177.00 178.10 2yu7 h LYS 53 N -0.79 0.25 -2.66 4.56 2.10 -1.79 -3.42 116.57 114.82 2yu7 h LYS 53 Ca -0.44 -0.42 -0.60 0.00 -2.00 0.00 0.00 60.65 57.18 2yu7 h LYS 53 Cb 1.24 0.16 -0.39 0.00 -0.90 0.00 0.00 32.23 32.33 2yu7 h LYS 53 CO 0.52 1.14 -0.83 0.00 -2.00 0.00 0.00 179.45 178.27 2yu7 s ALA 54 N -2.63 1.91 0.00 0.07 0.00 -1.26 -5.08 121.76 114.77 2yu7 s ALA 54 Ca -0.07 -2.63 0.00 0.00 0.00 0.00 0.00 51.96 49.26 2yu7 s ALA 54 Cb 0.07 -1.76 0.00 0.00 0.00 0.00 0.00 23.12 21.43 2yu7 s ALA 54 CO 0.86 -2.04 0.00 0.41 0.00 0.00 0.00 175.76 175.00 2yu7 n GLY 55 N 3.04 0.62 3.77 0.00 0.00 -1.26 -3.74 105.19 107.62 2yu7 n GLY 55 Ca 0.21 -0.80 -0.38 0.00 0.00 0.00 0.00 46.02 45.05 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 3.96 0.00 1.61 0.04 -1.26 -3.25 135.00 136.10 2yu7 s PRO 56 Ca 0.00 1.86 0.00 0.00 0.04 0.00 0.00 61.00 62.90 2yu7 s PRO 56 Cb 0.00 -2.61 0.00 0.00 0.04 0.00 0.00 34.50 31.93 2yu7 s PRO 56 CO 0.00 -0.41 0.00 0.41 0.04 0.00 0.00 177.00 177.04 2yu7 n GLY 57 N 0.59 3.24 3.86 0.56 0.00 -1.26 -5.04 105.19 107.14 2yu7 n GLY 57 Ca 0.05 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.75 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 -0.53 6.68 0.41 1.61 1.04 -1.20 -5.05 113.70 116.66 2yu7 s SER 58 Ca 0.00 1.19 -0.25 0.00 0.48 0.00 0.00 55.95 57.37 2yu7 s SER 58 Cb 0.00 -2.34 -0.08 0.00 0.10 0.00 0.00 66.02 63.70 2yu7 s SER 58 CO 0.00 -0.24 1.19 -2.16 0.98 0.00 0.00 173.24 173.01 2yu7 s PRO 59 N -3.21 4.01 0.32 4.02 0.04 -1.26 -4.63 135.00 134.29 2yu7 s PRO 59 Ca 0.52 1.88 -0.29 0.00 0.04 0.00 0.00 61.00 63.15 2yu7 s PRO 59 Cb -0.10 -2.66 -0.12 0.00 0.04 0.00 0.00 34.50 31.65 2yu7 s PRO 59 CO 0.22 -0.37 1.33 1.28 0.04 0.00 0.00 177.00 179.50 2yu7 n LEU 60 N 0.03 3.54 -4.77 -3.56 4.32 -1.26 -2.85 117.00 112.44 2yu7 n LEU 60 Ca 0.04 1.19 -0.37 0.00 -0.02 0.00 0.00 56.01 56.86 2yu7 n LEU 60 Cb 0.46 -1.48 -0.02 0.00 -1.62 0.00 0.00 43.42 40.76 2yu7 n LEU 60 CO 0.51 -0.44 0.81 -0.60 -1.22 0.00 0.00 177.39 176.45 2yu7 s ARG 61 N -1.56 3.88 0.23 3.23 6.06 -0.66 -4.78 118.95 125.34 2yu7 s ARG 61 Ca 0.58 1.73 0.08 0.00 -2.50 0.00 0.00 55.73 55.62 2yu7 s ARG 61 Cb -0.58 -2.47 -0.04 0.00 0.06 0.00 0.00 34.95 31.92 2yu7 s ARG 61 CO 0.59 -0.44 0.04 0.08 -2.50 0.00 0.00 175.30 173.07 2yu7 s VAL 62 N -1.55 3.75 -0.13 7.11 1.01 -1.26 -0.39 120.40 128.94 2yu7 s VAL 62 Ca 0.61 -1.62 -0.01 0.00 0.00 0.00 0.00 61.98 60.96 2yu7 s VAL 62 Cb -0.28 -2.96 0.03 0.00 0.00 0.00 0.00 36.38 33.17 2yu7 s VAL 62 CO 0.34 -0.27 -0.06 -0.89 0.00 0.00 0.00 175.10 174.23 2yu7 s THR 63 N -2.06 0.96 -0.50 3.92 2.01 -0.14 -4.95 115.64 114.88 2yu7 s THR 63 Ca 0.30 -0.36 -0.18 0.00 0.31 0.00 0.00 61.69 61.77 2yu7 s THR 63 Cb -0.08 -1.06 0.07 0.00 0.01 0.00 0.00 72.50 71.44 2yu7 s THR 63 CO 0.20 0.26 0.54 -1.00 -0.69 0.00 0.00 174.62 173.93 2yu7 s HIS 64 N 1.72 3.12 -0.41 4.92 3.76 -1.26 -1.80 115.29 125.35 2yu7 s HIS 64 Ca 0.03 -0.75 -0.12 0.00 -0.15 0.00 0.00 55.06 54.08 2yu7 s HIS 64 Cb -0.14 -3.45 0.04 0.00 1.11 0.00 0.00 32.58 30.15 2yu7 s HIS 64 CO -0.08 -0.97 0.27 0.42 -0.85 0.00 0.00 174.74 173.53 2yu7 s ILE 65 N 2.23 4.77 0.06 0.60 1.01 0.56 -4.91 121.20 125.52 2yu7 s ILE 65 Ca 0.10 -0.95 -0.35 0.00 0.00 0.00 0.00 60.65 59.45 2yu7 s ILE 65 Cb -0.22 -3.74 -0.14 0.00 0.01 0.00 0.00 42.46 38.37 2yu7 s ILE 65 CO 0.09 -0.36 1.59 0.29 0.00 0.00 0.00 174.94 176.55 2yu7 n LYS 66 N 5.05 1.81 -3.73 2.79 5.02 -1.26 -1.30 118.16 126.54 2yu7 n LYS 66 Ca -0.11 0.65 -0.38 0.00 -2.02 0.00 0.00 58.31 56.45 2yu7 n LYS 66 Cb 0.45 -2.40 -0.12 0.00 -0.02 0.00 0.00 35.03 32.95 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 1.62 3.72 -0.08 -0.18 1.01 0.11 -4.66 120.40 121.95 2yu7 s VAL 67 Ca 0.85 -1.46 -0.30 0.00 0.00 0.00 0.00 61.98 61.06 2yu7 s VAL 67 Cb -0.79 -3.27 -0.03 0.00 0.00 0.00 0.00 36.38 32.29 2yu7 s VAL 67 CO 0.45 -0.40 1.26 -0.04 0.00 0.00 0.00 175.10 176.38 2yu7 s MET 68 N 1.33 4.30 -0.33 2.72 -1.94 0.17 -1.94 119.30 123.61 2yu7 s MET 68 Ca 0.02 1.73 0.03 0.00 -1.71 0.00 0.00 55.69 55.76 2yu7 s MET 68 Cb -0.22 -3.63 0.10 0.00 2.01 0.00 0.00 34.83 33.10 2yu7 s MET 68 CO 0.00 -0.55 0.05 0.00 -0.01 0.00 0.00 175.02 174.52 2yu7 s GLU 70 N 1.00 2.70 0.20 0.00 0.41 -1.11 -4.78 118.70 117.12 2yu7 s GLU 70 Ca 0.10 -0.78 0.00 0.00 -0.41 0.00 0.00 54.97 53.89 2yu7 s GLU 70 Cb -0.19 -2.62 0.00 0.00 -1.78 0.00 0.00 34.13 29.54 2yu7 s GLU 70 CO -0.10 0.55 0.00 0.41 -0.49 0.00 0.00 175.26 175.63 2yu7 n GLY 71 N 0.49 0.48 1.89 -1.39 0.00 -1.26 -0.13 105.19 105.28 2yu7 n GLY 71 Ca -0.10 0.12 0.01 0.00 0.00 0.00 0.00 46.02 46.05 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 1.23 3.04 -0.02 0.00 -1.26 -5.11 105.19 103.06 2yu7 n GLY 72 Ca 0.00 -0.71 -0.21 0.00 0.00 0.00 0.00 46.02 45.10 2yu7 n GLY 72 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2yu7 n ARG 73 N -0.06 0.48 -3.92 1.61 0.00 0.82 -4.59 116.66 111.00 2yu7 n ARG 73 Ca -0.01 -3.14 -0.10 0.00 -0.00 0.00 0.00 57.85 54.59 2yu7 n ARG 73 Cb 0.96 2.17 -0.12 0.00 -0.00 0.00 0.00 32.46 35.47 2yu7 n ARG 73 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.63 178.34 2yu7 s TYR 74 N -3.13 0.12 0.13 2.89 2.02 -0.96 -2.77 117.35 115.65 2yu7 s TYR 74 Ca 0.29 -0.24 -0.15 0.00 -0.37 0.00 0.00 57.07 56.60 2yu7 s TYR 74 Cb 0.01 -0.09 0.02 0.00 -0.40 0.00 0.00 41.96 41.50 2yu7 s TYR 74 CO 0.20 -0.15 0.38 -0.08 -1.57 0.00 0.00 175.55 174.34 2yu7 s THR 75 N -0.92 0.07 -0.19 -0.71 -1.32 0.28 -0.74 115.64 112.11 2yu7 s THR 75 Ca -0.10 -0.76 -0.04 0.00 -1.21 0.00 0.00 61.69 59.58 2yu7 s THR 75 Cb -0.06 -1.31 0.09 0.00 -1.51 0.00 0.00 72.50 69.71 2yu7 s THR 75 CO -0.00 -0.33 0.24 0.68 -2.21 0.00 0.00 174.62 173.00 2yu7 s VAL 76 N -3.84 -0.36 0.00 5.08 -7.23 -1.26 -0.66 120.40 112.13 2yu7 s VAL 76 Ca 0.05 -0.03 0.00 0.00 -1.81 0.00 0.00 61.98 60.19 2yu7 s VAL 76 Cb 0.02 -0.64 0.00 0.00 0.56 0.00 0.00 36.38 36.32 2yu7 s VAL 76 CO -0.09 -0.13 0.00 0.61 -0.31 0.00 0.00 175.10 175.17 2yu7 n GLY 77 N 5.33 1.13 0.00 2.32 0.00 -1.26 -4.83 105.19 107.88 2yu7 n GLY 77 Ca -0.05 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.95 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 1.29 0.08 -0.02 0.00 -1.26 -5.03 105.19 100.25 2yu7 n GLY 78 Ca 0.00 -2.00 0.11 0.00 0.00 0.00 0.00 46.02 44.14 2yu7 n GLY 78 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 173.32 174.79 2yu7 n LEU 79 N 0.00 0.60 -4.04 0.99 -0.00 -1.26 -4.90 117.00 108.39 2yu7 n LEU 79 Ca 0.00 0.21 -0.33 0.00 -0.00 0.00 0.00 56.01 55.89 2yu7 n LEU 79 Cb 0.00 -0.05 -0.15 0.00 -0.00 0.00 0.00 43.42 43.22 2yu7 n LEU 79 CO 0.00 -0.12 1.97 -0.62 -0.00 0.00 0.00 177.39 178.63 2yu7 n GLU 80 N -2.50 0.00 -3.34 1.47 1.02 -1.26 -4.83 120.64 111.21 2yu7 n GLU 80 Ca -0.01 0.00 -0.45 0.00 -0.02 0.00 0.00 57.16 56.68 2yu7 n GLU 80 Cb 0.54 -1.24 -0.06 0.00 -0.02 0.00 0.00 31.44 30.65 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 6.24 5.19 0.49 2.62 -4.23 -1.25 -4.12 115.64 120.58 2yu7 s THR 81 Ca 1.21 -1.20 -0.19 0.00 -1.18 0.00 0.00 61.69 60.33 2yu7 s THR 81 Cb -1.05 -4.23 -0.09 0.00 1.34 0.00 0.00 72.50 68.48 2yu7 s THR 81 CO 0.46 -0.72 1.01 -0.36 -0.54 0.00 0.00 174.62 174.46 2yu7 s PHE 82 N 1.71 3.14 0.24 3.99 0.40 0.09 -4.76 117.98 122.79 2yu7 s PHE 82 Ca 0.04 1.57 -0.05 0.00 -0.60 0.00 0.00 56.93 57.89 2yu7 s PHE 82 Cb -0.26 -2.96 0.45 0.00 0.51 0.00 0.00 43.02 40.75 2yu7 s PHE 82 CO 0.05 -0.60 1.70 0.38 0.70 0.00 0.00 175.22 177.46 2yu7 h ASP 83 N 1.45 0.13 -5.15 1.36 3.04 -1.89 -2.56 116.42 112.79 2yu7 h ASP 83 Ca -0.49 0.13 -0.01 0.00 -3.24 0.00 0.00 57.03 53.42 2yu7 h ASP 83 Cb 1.20 0.15 -0.07 0.00 -1.04 0.00 0.00 39.33 39.57 2yu7 h ASP 83 CO 0.60 0.02 0.02 -0.55 -2.04 0.00 0.00 179.24 177.29 2yu7 s SER 84 N -5.28 -0.13 0.25 4.15 0.15 -1.26 -4.35 113.70 107.22 2yu7 s SER 84 Ca -0.13 -0.83 -0.04 0.00 0.70 0.00 0.00 55.95 55.66 2yu7 s SER 84 Cb 0.21 0.65 0.41 0.00 -1.71 0.00 0.00 66.02 65.57 2yu7 s SER 84 CO 0.76 -1.24 1.82 -0.07 1.20 0.00 0.00 173.24 175.71 2yu7 h LEU 85 N 2.15 0.76 -1.89 3.45 3.38 -1.93 0.22 115.31 121.44 2yu7 h LEU 85 Ca -0.24 0.04 0.14 0.00 0.09 0.00 0.00 57.88 57.92 2yu7 h LEU 85 Cb 1.25 -0.11 -0.03 0.00 0.09 0.00 0.00 40.66 41.86 2yu7 h LEU 85 CO 0.31 0.44 0.40 0.74 0.09 0.00 0.00 178.44 180.41 2yu7 h THR 86 N 0.87 0.77 0.02 0.22 2.02 -1.98 0.23 112.91 115.05 2yu7 h THR 86 Ca 0.41 -0.04 -0.15 0.00 0.77 0.00 0.00 66.41 67.40 2yu7 h THR 86 Cb 0.33 0.65 -0.02 0.00 -1.74 0.00 0.00 68.15 67.38 2yu7 h THR 86 CO -0.23 0.02 -0.81 0.44 0.37 0.00 0.00 175.52 175.31 2yu7 h ASP 87 N 0.11 0.07 -0.92 4.18 5.19 -1.43 -2.41 116.42 121.20 2yu7 h ASP 87 Ca 0.27 -0.75 0.07 0.00 -0.62 0.00 0.00 57.03 55.99 2yu7 h ASP 87 Cb 0.91 -0.02 -0.06 0.00 0.18 0.00 0.00 39.33 40.34 2yu7 h ASP 87 CO -0.03 1.33 0.60 0.25 -3.12 0.00 0.00 179.24 178.26 2yu7 h LEU 88 N -0.88 0.91 0.03 1.55 6.46 -0.63 -0.15 115.31 122.60 2yu7 h LEU 88 Ca -0.21 0.01 -0.09 0.00 -0.12 0.00 0.00 57.88 57.47 2yu7 h LEU 88 Cb 1.27 -0.19 0.01 0.00 -0.73 0.00 0.00 40.66 41.02 2yu7 h LEU 88 CO -0.08 0.58 -0.37 0.58 -0.62 0.00 0.00 178.44 178.53 2yu7 h VAL 89 N 1.03 1.56 -0.59 1.05 2.07 -0.71 -3.27 116.25 117.39 2yu7 h VAL 89 Ca 0.40 -2.13 0.10 0.00 0.82 0.00 0.00 66.70 65.89 2yu7 h VAL 89 Cb 0.22 2.91 -0.04 0.00 -1.52 0.00 0.00 31.29 32.87 2yu7 h VAL 89 CO -0.15 0.59 0.40 -0.33 0.02 0.00 0.00 177.57 178.09 2yu7 h GLU 90 N -0.49 0.36 -0.82 1.57 4.39 -1.12 0.12 114.58 118.59 2yu7 h GLU 90 Ca -0.05 -0.02 -0.04 0.00 0.34 0.00 0.00 59.36 59.59 2yu7 h GLU 90 Cb 1.17 -0.08 -0.04 0.00 -0.10 0.00 0.00 28.75 29.70 2yu7 h GLU 90 CO 0.07 0.24 0.36 1.25 -1.16 0.00 0.00 179.01 179.77 2yu7 h HIS 91 N 0.37 1.21 0.00 4.33 2.76 -1.08 -2.58 115.15 120.15 2yu7 h HIS 91 Ca 0.28 -0.08 -0.11 0.00 -2.20 0.00 0.00 60.37 58.26 2yu7 h HIS 91 Cb 0.59 -0.37 -0.02 0.00 1.55 0.00 0.00 27.41 29.16 2yu7 h HIS 91 CO -0.00 0.90 -0.71 0.74 -1.30 0.00 0.00 177.93 177.55 2yu7 h PHE 92 N 1.18 0.00 0.00 5.26 0.04 -1.20 -2.32 116.94 119.90 2yu7 h PHE 92 Ca 0.28 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 61.03 2yu7 h PHE 92 Cb 0.17 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.32 2yu7 h PHE 92 CO 0.02 0.46 -0.09 0.87 -0.60 0.00 0.00 178.31 178.97 2yu7 h LYS 93 N 0.00 0.00 0.00 1.51 1.57 -0.44 1.83 116.57 121.05 2yu7 h LYS 93 Ca -0.04 0.00 -0.36 0.00 -1.87 0.00 0.00 60.65 58.37 2yu7 h LYS 93 Cb 1.38 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 33.63 2yu7 h LYS 93 CO 0.05 0.09 -2.38 0.36 -0.57 0.00 0.00 179.45 176.99 2yu7 n LYS 94 N -4.20 0.62 -0.10 3.15 2.85 -1.13 -4.65 118.16 114.71 2yu7 n LYS 94 Ca -0.03 0.13 -0.22 0.00 -1.05 0.00 0.00 58.31 57.15 2yu7 n LYS 94 Cb 0.17 -1.49 -0.12 0.00 -0.65 0.00 0.00 35.03 32.94 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 0.00 0.89 0.00 0.58 1.35 -1.34 -3.52 112.91 110.88 2yu7 h THR 95 Ca -0.54 -2.19 0.00 0.00 -0.55 0.00 0.00 66.41 63.13 2yu7 h THR 95 Cb 1.86 2.24 0.00 0.00 -1.73 0.00 0.00 68.15 70.52 2yu7 h THR 95 CO -0.08 0.35 0.00 0.61 -0.25 0.00 0.00 175.52 176.16 2yu7 n GLY 96 N 1.47 2.29 3.90 5.82 0.00 0.62 -5.01 105.19 114.29 2yu7 n GLY 96 Ca -0.32 -1.65 -0.28 0.00 0.00 0.00 0.00 46.02 43.76 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 -1.50 3.50 -0.21 -0.61 1.01 0.80 -4.86 121.20 119.34 2yu7 s ILE 97 Ca 0.00 0.20 -0.04 0.00 0.00 0.00 0.00 60.65 60.82 2yu7 s ILE 97 Cb 0.00 -3.44 0.10 0.00 0.01 0.00 0.00 42.46 39.14 2yu7 s ILE 97 CO 0.00 -0.51 0.27 -0.70 0.00 0.00 0.00 174.94 174.00 2yu7 s GLU 98 N -5.18 0.24 0.35 2.79 2.12 -1.26 -0.87 118.70 116.89 2yu7 s GLU 98 Ca 0.56 0.33 -0.28 0.00 0.36 0.00 0.00 54.97 55.94 2yu7 s GLU 98 Cb -0.11 -0.93 -0.10 0.00 0.26 0.00 0.00 34.13 33.26 2yu7 s GLU 98 CO 0.48 -0.63 1.27 -1.21 -0.54 0.00 0.00 175.26 174.63 2yu7 s GLU 99 N 2.40 4.29 0.34 4.30 2.02 0.48 -4.89 118.70 127.64 2yu7 s GLU 99 Ca 0.08 2.13 0.14 0.00 0.02 0.00 0.00 54.97 57.35 2yu7 s GLU 99 Cb -0.15 -2.99 1.08 0.00 0.10 0.00 0.00 34.13 32.16 2yu7 s GLU 99 CO -0.13 -0.22 1.67 0.00 0.02 0.00 0.00 175.26 176.60 2yu7 h ALA 100 N 3.23 1.94 -0.94 5.21 0.00 -2.01 0.62 119.26 127.31 2yu7 h ALA 100 Ca -0.49 0.19 0.19 0.00 0.00 0.00 0.00 54.91 54.80 2yu7 h ALA 100 Cb 1.23 0.15 -0.08 0.00 0.00 0.00 0.00 17.79 19.09 2yu7 h ALA 100 CO 0.65 -0.56 0.61 1.03 0.00 0.00 0.00 179.25 180.98 2yu7 h SER 101 N 0.34 0.56 0.00 0.00 0.87 -2.06 -3.44 113.55 109.81 2yu7 h SER 101 Ca 0.73 0.06 0.00 0.00 -1.23 0.00 0.00 61.79 61.35 2yu7 h SER 101 Cb 1.65 -0.04 0.00 0.00 -0.44 0.00 0.00 62.40 63.56 2yu7 h SER 101 CO -0.60 0.22 0.00 0.61 -0.53 0.00 0.00 176.83 176.53 2yu7 n GLY 102 N -1.45 0.29 3.93 5.77 0.00 0.22 -5.14 105.19 108.80 2yu7 n GLY 102 Ca 0.20 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.97 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 3.43 -0.09 4.61 0.00 -1.17 -4.87 121.76 122.58 2yu7 s ALA 103 Ca 0.00 -0.79 0.01 0.00 0.00 0.00 0.00 51.96 51.19 2yu7 s ALA 103 Cb 0.00 -2.48 0.02 0.00 0.00 0.00 0.00 23.12 20.66 2yu7 s ALA 103 CO 0.00 -0.68 -0.12 -0.06 0.00 0.00 0.00 175.76 174.91 2yu7 s PHE 104 N -2.87 1.61 -0.27 0.00 0.08 -1.26 -0.38 117.98 114.90 2yu7 s PHE 104 Ca 0.52 -0.72 -0.04 0.00 0.12 0.00 0.00 56.93 56.81 2yu7 s PHE 104 Cb -0.10 -1.22 0.01 0.00 -0.57 0.00 0.00 43.02 41.14 2yu7 s PHE 104 CO 0.43 -0.41 0.01 0.08 -0.10 0.00 0.00 175.22 175.23 2yu7 s VAL 105 N 1.08 3.43 -0.15 -0.44 1.01 -0.05 -4.95 120.40 120.32 2yu7 s VAL 105 Ca -0.06 -0.80 -0.07 0.00 0.00 0.00 0.00 61.98 61.04 2yu7 s VAL 105 Cb -0.15 -2.73 -0.04 0.00 0.00 0.00 0.00 36.38 33.46 2yu7 s VAL 105 CO -0.02 0.17 0.10 -0.31 0.00 0.00 0.00 175.10 175.05 2yu7 s TYR 106 N 1.42 3.41 -0.26 5.22 2.02 -1.26 -0.14 117.35 127.76 2yu7 s TYR 106 Ca 0.02 0.32 -0.03 0.00 -0.37 0.00 0.00 57.07 57.02 2yu7 s TYR 106 Cb -0.17 -2.02 0.02 0.00 -0.40 0.00 0.00 41.96 39.40 2yu7 s TYR 106 CO -0.01 0.44 -0.03 -0.51 -1.57 0.00 0.00 175.55 173.86 2yu7 s LEU 107 N -0.27 3.34 0.00 -1.29 1.02 -1.26 -4.42 118.68 115.80 2yu7 s LEU 107 Ca 0.10 -0.86 0.00 0.00 0.02 0.00 0.00 54.13 53.38 2yu7 s LEU 107 Cb -0.12 -1.70 0.00 0.00 0.02 0.00 0.00 46.19 44.39 2yu7 s LEU 107 CO 0.01 -0.15 0.00 0.54 0.02 0.00 0.00 176.35 176.78 2yu7 n ARG 108 N 4.70 1.58 -3.35 1.70 1.74 -0.69 -4.34 116.66 118.00 2yu7 n ARG 108 Ca -0.16 0.00 -0.45 0.00 -0.77 0.00 0.00 57.85 56.47 2yu7 n ARG 108 Cb 0.47 -0.79 -0.05 0.00 -1.02 0.00 0.00 32.46 31.06 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 -1.59 2.99 -0.86 5.56 -0.21 -0.87 -5.01 119.66 119.68 2yu7 s GLN 109 Ca 0.00 -1.81 -0.25 0.00 0.02 0.00 0.00 55.36 53.32 2yu7 s GLN 109 Cb 0.00 -4.26 -0.04 0.00 1.00 0.00 0.00 33.01 29.70 2yu7 s GLN 109 CO 0.00 -1.31 1.94 -1.25 -2.12 0.00 0.00 175.29 172.55 2yu7 s PRO 110 N 1.39 2.56 -0.36 2.91 0.04 -1.26 -2.22 135.00 138.06 2yu7 s PRO 110 Ca 0.05 -0.16 -0.39 0.00 0.04 0.00 0.00 61.00 60.54 2yu7 s PRO 110 Cb -0.27 -4.97 -0.15 0.00 0.04 0.00 0.00 34.50 29.15 2yu7 s PRO 110 CO 0.01 -3.29 1.98 0.98 0.04 0.00 0.00 177.00 176.72 2yu7 n TYR 111 N 13.83 1.70 -2.15 0.56 9.36 0.08 -4.67 117.16 135.89 2yu7 n TYR 111 Ca 0.37 0.52 -0.27 0.00 3.32 0.00 0.00 57.90 61.85 2yu7 n TYR 111 Cb 0.48 -2.44 0.08 0.00 -0.63 0.00 0.00 39.34 36.83 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 5.38 2.74 -0.10 2.98 2.02 -1.26 -4.38 117.35 124.72 2yu7 s TYR 112 Ca 1.07 0.45 -0.14 0.00 -0.37 0.00 0.00 57.07 58.07 2yu7 s TYR 112 Cb -1.10 -3.32 -0.05 0.00 -0.40 0.00 0.00 41.96 37.10 2yu7 s TYR 112 CO 0.61 -1.59 0.35 0.45 -1.57 0.00 0.00 175.55 173.79 2yu7 s SER 113 N -4.57 6.59 -0.21 2.29 0.15 -1.26 -4.99 113.70 111.70 2yu7 s SER 113 Ca 0.62 0.70 -0.27 0.00 0.70 0.00 0.00 55.95 57.69 2yu7 s SER 113 Cb -0.10 -2.21 0.10 0.00 -1.71 0.00 0.00 66.02 62.10 2yu7 s SER 113 CO 0.46 0.16 0.88 -0.83 1.20 0.00 0.00 173.24 175.11 2yu7 s GLY 114 N -0.03 -0.36 0.52 9.45 0.00 -1.26 -5.14 107.32 110.50 2yu7 s GLY 114 Ca 0.20 2.13 -0.09 0.00 0.00 0.00 0.00 44.72 46.97 2yu7 s GLY 114 CO 0.08 1.50 0.46 -1.55 0.00 0.00 0.00 173.10 173.59 2yu7 n PRO 115 N 1.83 -1.91 -4.37 2.90 -0.04 -1.26 -5.09 135.00 127.06 2yu7 n PRO 115 Ca -0.14 -0.74 -0.21 0.00 -0.04 0.00 0.00 63.50 62.38 2yu7 n PRO 115 Cb 0.56 -0.69 -0.11 0.00 -0.04 0.00 0.00 33.50 33.23 2yu7 n PRO 115 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 2yu7 s SER 116 N -2.75 2.85 -0.97 3.54 1.04 -1.26 -5.05 113.70 111.10 2yu7 s SER 116 Ca 0.30 -0.95 -0.25 0.00 0.48 0.00 0.00 55.95 55.54 2yu7 s SER 116 Cb -0.03 -0.18 -0.10 0.00 0.10 0.00 0.00 66.02 65.81 2yu7 s SER 116 CO 0.23 -0.06 2.06 -0.44 0.98 0.00 0.00 173.24 176.01 2yu7 s SER 117 N -3.04 4.63 0.00 7.02 0.01 -1.26 -5.38 113.70 115.68 2yu7 s SER 117 Ca 0.21 -0.82 0.00 0.00 1.31 0.00 0.00 55.95 56.65 2yu7 s SER 117 Cb -0.04 -2.57 0.00 0.00 0.21 0.00 0.00 66.02 63.62 2yu7 s SER 117 CO 0.08 -3.33 0.03 0.61 0.41 0.00 0.00 173.24 171.04