#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 5.52 -1.58 1.61 0.01 -1.26 -3.48 113.70 114.52 2yu7 s SER 2 Ca 0.00 0.36 -0.16 0.00 1.31 0.00 0.00 55.95 57.46 2yu7 s SER 2 Cb 0.00 -2.53 0.12 0.00 0.21 0.00 0.00 66.02 63.82 2yu7 s SER 2 CO 0.00 -2.18 0.78 -1.20 0.41 0.00 0.00 173.24 171.05 2yu7 n SER 3 N 11.82 -3.81 -4.60 2.44 7.64 -1.26 -4.93 113.62 120.91 2yu7 n SER 3 Ca 0.18 -0.82 -0.34 0.00 1.01 0.00 0.00 58.87 58.89 2yu7 n SER 3 Cb 0.51 -3.10 -0.11 0.00 -1.01 0.00 0.00 64.21 60.50 2yu7 n SER 3 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2yu7 s GLY 4 N -3.17 1.80 0.61 0.23 0.00 -1.23 -4.77 107.32 100.80 2yu7 s GLY 4 Ca 0.66 -0.80 -0.14 0.00 0.00 0.00 0.00 44.72 44.44 2yu7 s GLY 4 CO 0.81 -0.27 1.05 -0.45 0.00 0.00 0.00 173.10 174.24 2yu7 s SER 5 N -0.19 5.77 -0.21 1.64 0.15 -1.26 -4.27 113.70 115.33 2yu7 s SER 5 Ca 0.05 1.73 -0.16 0.00 0.70 0.00 0.00 55.95 58.26 2yu7 s SER 5 Cb -0.13 -2.52 -0.18 0.00 -1.71 0.00 0.00 66.02 61.48 2yu7 s SER 5 CO 0.02 -1.18 0.07 -0.24 1.20 0.00 0.00 173.24 173.12 2yu7 n SER 6 N -2.31 1.94 0.00 5.45 2.88 -1.26 -4.94 113.62 115.38 2yu7 n SER 6 Ca 0.08 0.33 0.00 0.00 -1.33 0.00 0.00 58.87 57.95 2yu7 n SER 6 Cb 0.53 -0.88 0.00 0.00 -0.75 0.00 0.00 64.21 63.11 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 1.53 2.69 0.76 0.46 0.00 -1.26 -5.00 105.19 104.38 2yu7 n GLY 7 Ca -0.38 -1.80 0.12 0.00 0.00 0.00 0.00 46.02 43.95 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 0.19 -2.58 1.61 4.27 -1.26 -4.62 117.44 115.06 2yu7 n TRP 8 Ca 0.00 -0.09 -0.42 0.00 -3.89 0.00 0.00 57.50 53.09 2yu7 n TRP 8 Cb 0.00 0.00 -0.03 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 -1.81 3.52 0.00 -2.67 5.04 -1.26 -3.26 117.35 116.91 2yu7 s TYR 9 Ca 0.34 1.50 0.00 0.00 -2.44 0.00 0.00 57.07 56.47 2yu7 s TYR 9 Cb 0.20 -3.27 0.00 0.00 0.35 0.00 0.00 41.96 39.24 2yu7 s TYR 9 CO 0.30 -0.63 0.00 0.72 -1.34 0.00 0.00 175.55 174.60 2yu7 n HIS 10 N 4.11 0.00 0.00 4.97 8.25 -0.59 -4.80 115.22 127.16 2yu7 n HIS 10 Ca 0.08 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.54 2yu7 n HIS 10 Cb 0.49 -0.07 0.00 0.00 1.12 0.00 0.00 29.99 31.52 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 2.09 2.11 2.84 -1.41 0.00 -1.26 -5.03 105.19 104.53 2yu7 n GLY 11 Ca 0.00 -0.50 -0.26 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 1.27 -0.29 1.61 2.46 -1.26 -3.04 115.29 116.04 2yu7 s HIS 12 Ca 0.00 -0.72 -0.20 0.00 0.47 0.00 0.00 55.06 54.61 2yu7 s HIS 12 Cb 0.00 -1.11 0.16 0.00 -0.13 0.00 0.00 32.58 31.49 2yu7 s HIS 12 CO 0.00 -0.51 1.12 1.41 -2.47 0.00 0.00 174.74 174.29 2yu7 s MET 13 N 1.78 0.31 0.15 2.88 0.00 -1.26 -4.78 119.30 118.38 2yu7 s MET 13 Ca 0.03 0.44 -0.08 0.00 0.00 0.00 0.00 55.69 56.09 2yu7 s MET 13 Cb -0.14 0.11 -0.06 0.00 0.00 0.00 0.00 34.83 34.74 2yu7 s MET 13 CO -0.07 -0.05 0.43 -1.54 0.00 0.00 0.00 175.02 173.79 2yu7 s SER 14 N 0.73 6.57 0.54 1.11 1.04 -1.26 -4.70 113.70 117.73 2yu7 s SER 14 Ca -0.02 0.74 0.40 0.00 0.48 0.00 0.00 55.95 57.55 2yu7 s SER 14 Cb -0.04 -2.15 1.59 0.00 0.10 0.00 0.00 66.02 65.52 2yu7 s SER 14 CO -0.12 0.05 1.73 1.23 0.98 0.00 0.00 173.24 177.11 2yu7 h GLY 15 N 2.97 0.08 1.53 7.32 0.00 -1.99 0.59 103.07 113.57 2yu7 h GLY 15 Ca -0.47 -0.01 -0.06 0.00 0.00 0.00 0.00 47.33 46.79 2yu7 h GLY 15 CO 0.70 -0.02 -0.02 -1.33 0.00 0.00 0.00 176.54 175.88 2yu7 h GLY 16 N 0.01 0.63 1.52 4.60 0.00 -2.01 -1.94 103.07 105.88 2yu7 h GLY 16 Ca 0.68 -0.39 -0.23 0.00 0.00 0.00 0.00 47.33 47.39 2yu7 h GLY 16 CO -0.03 0.36 -1.27 -1.61 0.00 0.00 0.00 176.54 173.99 2yu7 h GLN 17 N 0.55 0.00 0.27 4.80 4.15 -0.22 -3.32 115.11 121.33 2yu7 h GLN 17 Ca 0.11 0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.52 2yu7 h GLN 17 Cb 0.38 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.07 2yu7 h GLN 17 CO 0.01 0.70 -0.13 0.00 -1.93 0.00 0.00 178.83 177.49 2yu7 h ALA 18 N 1.08 -0.73 -0.99 3.38 0.00 -1.10 -1.19 119.26 119.71 2yu7 h ALA 18 Ca -0.13 -0.08 0.32 0.00 0.00 0.00 0.00 54.91 55.02 2yu7 h ALA 18 Cb 1.82 0.14 -0.18 0.00 0.00 0.00 0.00 17.79 19.57 2yu7 h ALA 18 CO 0.10 -0.71 0.23 0.93 0.00 0.00 0.00 179.25 179.80 2yu7 h GLU 19 N -0.51 0.03 -0.09 0.00 5.08 -1.55 0.51 114.58 118.04 2yu7 h GLU 19 Ca -0.04 -0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.31 2yu7 h GLU 19 Cb 0.28 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.52 2yu7 h GLU 19 CO 0.06 0.02 -0.01 1.15 -1.00 0.00 0.00 179.01 179.23 2yu7 h THR 20 N 0.03 1.27 0.81 1.13 2.02 -1.66 -2.02 112.91 114.48 2yu7 h THR 20 Ca 0.69 -0.85 -0.04 0.00 0.77 0.00 0.00 66.41 66.98 2yu7 h THR 20 Cb 1.59 1.66 0.01 0.00 -1.74 0.00 0.00 68.15 69.66 2yu7 h THR 20 CO -0.85 0.24 -0.39 -0.07 0.37 0.00 0.00 175.52 174.83 2yu7 h LEU 21 N -0.13 -0.92 -0.52 2.58 3.38 0.11 0.22 115.31 120.03 2yu7 h LEU 21 Ca 0.02 0.03 0.10 0.00 0.09 0.00 0.00 57.88 58.13 2yu7 h LEU 21 Cb 0.38 0.24 -0.10 0.00 0.09 0.00 0.00 40.66 41.26 2yu7 h LEU 21 CO 0.01 -0.64 -0.19 -0.07 0.09 0.00 0.00 178.44 177.64 2yu7 h LEU 22 N -1.11 -0.67 -1.33 1.67 3.38 -0.53 0.18 115.31 116.89 2yu7 h LEU 22 Ca -0.11 0.18 -0.06 0.00 0.09 0.00 0.00 57.88 57.98 2yu7 h LEU 22 Cb 0.83 0.39 -0.01 0.00 0.09 0.00 0.00 40.66 41.96 2yu7 h LEU 22 CO 0.18 -0.22 -0.16 1.56 0.09 0.00 0.00 178.44 179.89 2yu7 h GLN 23 N -0.07 0.26 -0.05 1.13 4.20 -1.28 -2.82 115.11 116.48 2yu7 h GLN 23 Ca 0.25 -0.07 0.03 0.00 0.06 0.00 0.00 58.65 58.92 2yu7 h GLN 23 Cb 0.45 -0.03 -0.03 0.00 0.30 0.00 0.00 27.48 28.16 2yu7 h GLN 23 CO -0.57 0.42 -0.14 0.00 -0.67 0.00 0.00 178.83 177.87 2yu7 h ALA 24 N 1.60 -0.12 -0.59 3.87 0.00 0.25 -2.59 119.26 121.68 2yu7 h ALA 24 Ca 0.05 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 2yu7 h ALA 24 Cb 0.43 0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.45 2yu7 h ALA 24 CO 0.03 -0.62 0.29 -0.22 0.00 0.00 0.00 179.25 178.73 2yu7 h LYS 25 N -0.21 0.85 -0.43 0.00 3.64 -1.27 -3.47 116.57 115.68 2yu7 h LYS 25 Ca 0.06 -0.12 0.00 0.00 -1.27 0.00 0.00 60.65 59.32 2yu7 h LYS 25 Cb 0.30 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 31.96 2yu7 h LYS 25 CO -0.17 0.69 0.00 0.41 -2.27 0.00 0.00 179.45 178.11 2yu7 n GLY 26 N -0.94 0.67 3.36 5.01 0.00 -0.98 -5.05 105.19 107.26 2yu7 n GLY 26 Ca 0.04 -0.76 -0.37 0.00 0.00 0.00 0.00 46.02 44.92 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 -4.29 3.21 0.44 1.61 2.02 -1.26 -5.09 118.70 115.33 2yu7 s GLU 27 Ca 0.00 -0.78 -0.24 0.00 0.02 0.00 0.00 54.97 53.98 2yu7 s GLU 27 Cb 0.00 -3.33 -0.08 0.00 0.10 0.00 0.00 34.13 30.82 2yu7 s GLU 27 CO 0.00 -0.38 1.18 -1.25 0.02 0.00 0.00 175.26 174.82 2yu7 s PRO 28 N 1.52 3.87 -1.01 0.39 0.04 -1.26 -3.31 135.00 135.23 2yu7 s PRO 28 Ca 0.03 1.82 -0.01 0.00 0.04 0.00 0.00 61.00 62.89 2yu7 s PRO 28 Cb -0.17 -2.52 0.00 0.00 0.04 0.00 0.00 34.50 31.86 2yu7 s PRO 28 CO 0.02 -0.47 0.11 0.91 0.04 0.00 0.00 177.00 177.61 2yu7 n TRP 29 N -0.26 -0.76 -3.40 0.56 5.03 0.22 -4.74 117.44 114.09 2yu7 n TRP 29 Ca 0.06 0.10 -0.41 0.00 3.03 0.00 0.00 57.50 60.28 2yu7 n TRP 29 Cb 0.47 -2.85 -0.09 0.00 -1.03 0.00 0.00 31.31 27.80 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 -2.71 5.17 0.16 -0.99 2.01 -1.17 -1.43 115.64 116.68 2yu7 s THR 30 Ca 0.06 0.02 0.05 0.00 0.31 0.00 0.00 61.69 62.12 2yu7 s THR 30 Cb -0.02 -3.83 -0.04 0.00 0.01 0.00 0.00 72.50 68.62 2yu7 s THR 30 CO 0.07 -0.10 0.12 0.72 -0.69 0.00 0.00 174.62 174.73 2yu7 s PHE 31 N 2.01 3.13 -0.17 4.92 -0.71 -0.94 0.03 117.98 126.26 2yu7 s PHE 31 Ca 0.12 -0.02 -0.08 0.00 -1.04 0.00 0.00 56.93 55.90 2yu7 s PHE 31 Cb -0.17 -1.51 0.06 0.00 -1.21 0.00 0.00 43.02 40.20 2yu7 s PHE 31 CO 0.12 0.52 0.39 -0.48 -1.34 0.00 0.00 175.22 174.42 2yu7 s LEU 32 N -3.02 -0.12 -0.12 -1.99 0.05 0.75 -1.23 118.68 113.00 2yu7 s LEU 32 Ca 0.30 0.86 -0.13 0.00 0.05 0.00 0.00 54.13 55.21 2yu7 s LEU 32 Cb -0.10 1.26 -0.05 0.00 -2.05 0.00 0.00 46.19 45.25 2yu7 s LEU 32 CO 0.23 -0.20 0.31 -0.69 -0.55 0.00 0.00 176.35 175.45 2yu7 s VAL 33 N 1.58 5.27 0.21 1.48 1.01 -1.20 -2.22 120.40 126.53 2yu7 s VAL 33 Ca -0.08 0.59 -0.08 0.00 0.00 0.00 0.00 61.98 62.40 2yu7 s VAL 33 Cb -0.09 -3.63 -0.02 0.00 0.00 0.00 0.00 36.38 32.64 2yu7 s VAL 33 CO -0.12 0.46 0.32 0.00 0.00 0.00 0.00 175.10 175.76 2yu7 s ARG 34 N -0.07 1.35 0.46 2.72 1.70 -1.11 -1.54 118.95 122.46 2yu7 s ARG 34 Ca 0.18 -1.36 -0.15 0.00 -0.47 0.00 0.00 55.73 53.93 2yu7 s ARG 34 Cb -0.14 0.39 -0.08 0.00 -0.57 0.00 0.00 34.95 34.55 2yu7 s ARG 34 CO 0.06 -0.51 0.91 -1.21 -1.08 0.00 0.00 175.30 173.47 2yu7 s GLU 35 N -4.05 3.94 0.46 3.89 2.02 -1.17 -1.41 118.70 122.38 2yu7 s GLU 35 Ca 0.27 0.83 -0.14 0.00 0.02 0.00 0.00 54.97 55.94 2yu7 s GLU 35 Cb 0.03 -2.23 -0.07 0.00 0.10 0.00 0.00 34.13 31.96 2yu7 s GLU 35 CO 0.08 -0.16 0.90 -1.12 0.02 0.00 0.00 175.26 174.98 2yu7 s SER 36 N -2.95 6.60 -0.18 -0.19 0.01 -1.10 -4.59 113.70 111.30 2yu7 s SER 36 Ca 0.57 1.40 -0.16 0.00 1.31 0.00 0.00 55.95 59.07 2yu7 s SER 36 Cb -0.10 -2.44 -0.12 0.00 0.21 0.00 0.00 66.02 63.58 2yu7 s SER 36 CO 0.28 -0.50 0.02 0.18 0.41 0.00 0.00 173.24 173.64 2yu7 n LEU 37 N -1.41 1.84 -0.01 2.44 4.77 -1.26 -4.69 117.00 118.68 2yu7 n LEU 37 Ca 0.05 0.51 -0.03 0.00 -0.03 0.00 0.00 56.01 56.51 2yu7 n LEU 37 Cb 0.54 -0.92 -0.02 0.00 -2.33 0.00 0.00 43.42 40.69 2yu7 n LEU 37 CO 0.46 -0.04 0.08 -1.28 -1.33 0.00 0.00 177.39 175.28 2yu7 h SER 38 N -1.00 -0.08 -2.75 -1.43 0.87 -2.01 -3.44 113.55 103.72 2yu7 h SER 38 Ca -0.21 -0.09 -0.56 0.00 -1.23 0.00 0.00 61.79 59.69 2yu7 h SER 38 Cb 0.97 0.02 -0.03 0.00 -0.44 0.00 0.00 62.40 62.92 2yu7 h SER 38 CO -0.13 0.46 1.13 -1.10 -0.53 0.00 0.00 176.83 176.66 2yu7 s GLN 39 N -1.94 3.79 0.08 2.24 -1.52 -1.26 -4.96 119.66 116.09 2yu7 s GLN 39 Ca -0.03 1.67 -0.31 0.00 -1.95 0.00 0.00 55.36 54.74 2yu7 s GLN 39 Cb -0.00 -4.04 -0.07 0.00 -0.22 0.00 0.00 33.01 28.68 2yu7 s GLN 39 CO 0.11 -1.30 1.38 -1.25 -0.25 0.00 0.00 175.29 173.98 2yu7 s PRO 40 N 4.69 4.32 0.00 2.91 0.04 -1.26 -3.14 135.00 142.56 2yu7 s PRO 40 Ca 0.72 2.03 0.00 0.00 0.04 0.00 0.00 61.00 63.79 2yu7 s PRO 40 Cb -0.25 -3.34 0.00 0.00 0.04 0.00 0.00 34.50 30.95 2yu7 s PRO 40 CO 0.29 -0.46 0.00 0.41 0.04 0.00 0.00 177.00 177.28 2yu7 n GLY 41 N 3.52 1.85 3.07 0.56 0.00 -1.26 -4.98 105.19 107.95 2yu7 n GLY 41 Ca 0.12 -0.04 -0.21 0.00 0.00 0.00 0.00 46.02 45.89 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 1.42 -3.28 -3.83 1.61 9.92 -1.19 -4.82 116.55 116.39 2yu7 n ASP 42 Ca 0.00 -0.51 -0.10 0.00 -0.53 0.00 0.00 54.79 53.65 2yu7 n ASP 42 Cb 0.00 -0.83 -0.08 0.00 -0.64 0.00 0.00 41.12 39.57 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 -2.09 0.05 -0.11 1.24 0.08 -1.15 -2.71 117.98 113.30 2yu7 s PHE 43 Ca 0.44 -0.32 0.03 0.00 0.12 0.00 0.00 56.93 57.19 2yu7 s PHE 43 Cb -0.08 -0.01 -0.00 0.00 -0.57 0.00 0.00 43.02 42.36 2yu7 s PHE 43 CO 0.39 -0.48 -0.22 0.08 -0.10 0.00 0.00 175.22 174.89 2yu7 s VAL 44 N -2.96 2.26 -0.57 -0.44 1.01 -0.50 0.18 120.40 119.39 2yu7 s VAL 44 Ca -0.02 -0.94 -0.14 0.00 0.00 0.00 0.00 61.98 60.88 2yu7 s VAL 44 Cb 0.01 -1.88 0.14 0.00 0.00 0.00 0.00 36.38 34.64 2yu7 s VAL 44 CO -0.06 0.55 0.50 -0.22 0.00 0.00 0.00 175.10 175.87 2yu7 s LEU 45 N 0.36 6.13 0.02 3.92 1.98 0.83 -2.76 118.68 129.16 2yu7 s LEU 45 Ca -0.17 -1.98 -0.16 0.00 -2.89 0.00 0.00 54.13 48.93 2yu7 s LEU 45 Cb -0.17 -2.15 -0.06 0.00 0.66 0.00 0.00 46.19 44.47 2yu7 s LEU 45 CO 0.08 -0.76 0.45 -0.55 -1.89 0.00 0.00 176.35 173.67 2yu7 s SER 46 N 3.08 6.86 -0.08 3.68 0.15 -0.94 -0.54 113.70 125.91 2yu7 s SER 46 Ca 0.06 1.03 -0.06 0.00 0.70 0.00 0.00 55.95 57.68 2yu7 s SER 46 Cb -0.26 -2.27 0.03 0.00 -1.71 0.00 0.00 66.02 61.81 2yu7 s SER 46 CO 0.00 0.31 0.20 -0.69 1.20 0.00 0.00 173.24 174.26 2yu7 s VAL 47 N -1.10 -0.02 -0.25 4.45 1.01 -0.39 -0.18 120.40 123.92 2yu7 s VAL 47 Ca 0.25 0.06 -0.17 0.00 0.00 0.00 0.00 61.98 62.12 2yu7 s VAL 47 Cb -0.17 -0.30 -0.03 0.00 0.00 0.00 0.00 36.38 35.88 2yu7 s VAL 47 CO 0.15 0.02 0.49 -0.22 0.00 0.00 0.00 175.10 175.54 2yu7 s LEU 48 N 0.51 4.06 0.31 3.92 2.96 0.11 0.08 118.68 130.62 2yu7 s LEU 48 Ca -0.03 0.50 -0.19 0.00 -0.22 0.00 0.00 54.13 54.18 2yu7 s LEU 48 Cb -0.05 -2.62 -0.09 0.00 0.50 0.00 0.00 46.19 43.93 2yu7 s LEU 48 CO -0.03 -0.25 0.80 -0.94 -1.32 0.00 0.00 176.35 174.62 2yu7 s SER 49 N 1.51 7.00 0.00 3.68 1.04 0.78 0.72 113.70 128.42 2yu7 s SER 49 Ca 0.20 1.49 0.15 0.00 0.48 0.00 0.00 55.95 58.27 2yu7 s SER 49 Cb -0.16 -2.45 0.86 0.00 0.10 0.00 0.00 66.02 64.37 2yu7 s SER 49 CO 0.09 -0.12 1.32 -0.67 0.98 0.00 0.00 173.24 174.84 2yu7 n ASP 50 N 0.13 0.00 -4.60 7.02 -0.08 -1.26 -4.01 116.55 113.75 2yu7 n ASP 50 Ca 0.02 -0.37 -0.35 0.00 -1.51 0.00 0.00 54.79 52.58 2yu7 n ASP 50 Cb 0.52 -0.05 -0.10 0.00 2.34 0.00 0.00 41.12 43.83 2yu7 n ASP 50 CO 0.00 0.00 0.00 -1.10 0.12 0.00 0.00 177.20 176.22 2yu7 s GLN 51 N -2.10 3.91 0.83 -0.67 -1.52 -1.26 -5.00 119.66 113.85 2yu7 s GLN 51 Ca 0.21 -0.37 -0.11 0.00 -1.95 0.00 0.00 55.36 53.13 2yu7 s GLN 51 Cb 0.10 -3.22 0.09 0.00 -0.22 0.00 0.00 33.01 29.76 2yu7 s GLN 51 CO 0.18 0.19 1.09 -1.25 -0.25 0.00 0.00 175.29 175.25 2yu7 s PRO 52 N 0.59 1.79 0.30 2.91 0.04 -1.26 -1.32 135.00 138.04 2yu7 s PRO 52 Ca 0.03 1.01 0.20 0.00 0.04 0.00 0.00 61.00 62.28 2yu7 s PRO 52 Cb -0.13 -1.86 0.13 0.00 0.04 0.00 0.00 34.50 32.68 2yu7 s PRO 52 CO 0.01 -1.92 1.35 1.57 0.04 0.00 0.00 177.00 178.05 2yu7 h LYS 53 N -1.33 0.00 -5.13 4.56 2.10 -1.77 -3.42 116.57 111.58 2yu7 h LYS 53 Ca -0.46 0.00 -0.40 0.00 -2.00 0.00 0.00 60.65 57.78 2yu7 h LYS 53 Cb 1.26 0.00 -0.14 0.00 -0.90 0.00 0.00 32.23 32.44 2yu7 h LYS 53 CO 0.53 0.19 -0.64 0.00 -2.00 0.00 0.00 179.45 177.53 2yu7 s ALA 54 N -3.12 1.96 0.03 0.07 0.00 -1.26 -5.07 121.76 114.37 2yu7 s ALA 54 Ca 0.03 -1.85 -0.28 0.00 0.00 0.00 0.00 51.96 49.86 2yu7 s ALA 54 Cb 0.07 0.56 -0.16 0.00 0.00 0.00 0.00 23.12 23.59 2yu7 s ALA 54 CO 0.73 -0.27 1.25 0.78 0.00 0.00 0.00 175.76 178.25 2yu7 h GLY 55 N 2.37 -1.07 -0.91 0.00 0.00 -1.99 -3.42 103.07 98.05 2yu7 h GLY 55 Ca -0.39 0.40 -0.41 0.00 0.00 0.00 0.00 47.33 46.93 2yu7 h GLY 55 CO 0.65 -0.39 0.12 2.56 0.00 0.00 0.00 176.54 179.49 2yu7 s PRO 56 N -4.97 -1.44 -0.94 4.80 0.04 -1.26 -4.74 135.00 126.50 2yu7 s PRO 56 Ca -0.15 -0.14 -0.19 0.00 0.04 0.00 0.00 61.00 60.56 2yu7 s PRO 56 Cb 0.01 -1.58 -0.26 0.00 0.04 0.00 0.00 34.50 32.72 2yu7 s PRO 56 CO 0.45 -3.84 2.37 0.41 0.04 0.00 0.00 177.00 176.43 2yu7 n GLY 57 N -0.92 -0.40 3.27 0.56 0.00 -1.26 -4.85 105.19 101.59 2yu7 n GLY 57 Ca 0.14 0.44 -0.16 0.00 0.00 0.00 0.00 46.02 46.44 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 5.07 2.07 0.30 1.61 1.04 -1.26 -5.05 113.70 117.47 2yu7 s SER 58 Ca 1.26 -0.95 -0.29 0.00 0.48 0.00 0.00 55.95 56.44 2yu7 s SER 58 Cb -0.84 -0.06 -0.10 0.00 0.10 0.00 0.00 66.02 65.12 2yu7 s SER 58 CO 0.46 -0.23 1.24 -2.16 0.98 0.00 0.00 173.24 173.53 2yu7 s PRO 59 N -3.40 4.46 0.27 4.02 0.04 -1.26 -4.68 135.00 134.46 2yu7 s PRO 59 Ca 0.16 2.06 -0.30 0.00 0.04 0.00 0.00 61.00 62.96 2yu7 s PRO 59 Cb -0.01 -3.12 -0.13 0.00 0.04 0.00 0.00 34.50 31.28 2yu7 s PRO 59 CO 0.03 -0.06 1.32 1.28 0.04 0.00 0.00 177.00 179.62 2yu7 n LEU 60 N 1.13 3.07 -4.77 -3.56 4.32 -1.26 -2.61 117.00 113.31 2yu7 n LEU 60 Ca 0.00 1.17 -0.41 0.00 -0.02 0.00 0.00 56.01 56.75 2yu7 n LEU 60 Cb 0.43 -1.43 -0.02 0.00 -1.62 0.00 0.00 43.42 40.78 2yu7 n LEU 60 CO 0.57 -0.60 0.96 -0.60 -1.22 0.00 0.00 177.39 176.50 2yu7 s ARG 61 N -0.99 4.39 0.25 3.23 3.52 -0.44 -4.77 118.95 124.14 2yu7 s ARG 61 Ca 0.63 2.16 0.06 0.00 -0.13 0.00 0.00 55.73 58.45 2yu7 s ARG 61 Cb -0.64 -3.10 -0.03 0.00 -1.56 0.00 0.00 34.95 29.63 2yu7 s ARG 61 CO 0.55 -0.15 0.29 0.08 -0.81 0.00 0.00 175.30 175.26 2yu7 s VAL 62 N -1.03 4.82 -0.18 7.11 1.01 -1.26 -0.16 120.40 130.71 2yu7 s VAL 62 Ca 0.49 -1.19 -0.03 0.00 0.00 0.00 0.00 61.98 61.26 2yu7 s VAL 62 Cb -0.39 -3.63 0.06 0.00 0.00 0.00 0.00 36.38 32.42 2yu7 s VAL 62 CO 0.50 -0.33 0.03 -0.89 0.00 0.00 0.00 175.10 174.41 2yu7 s THR 63 N -2.06 0.55 -0.40 3.92 2.01 0.11 -4.91 115.64 114.86 2yu7 s THR 63 Ca 0.34 -0.52 -0.16 0.00 0.31 0.00 0.00 61.69 61.65 2yu7 s THR 63 Cb -0.08 -1.02 0.01 0.00 0.01 0.00 0.00 72.50 71.42 2yu7 s THR 63 CO 0.27 -0.16 0.39 -1.00 -0.69 0.00 0.00 174.62 173.43 2yu7 s HIS 64 N 1.85 3.19 -0.29 4.92 3.76 -1.26 -1.26 115.29 126.21 2yu7 s HIS 64 Ca -0.01 -0.32 -0.06 0.00 -0.15 0.00 0.00 55.06 54.52 2yu7 s HIS 64 Cb -0.17 -2.78 0.01 0.00 1.11 0.00 0.00 32.58 30.75 2yu7 s HIS 64 CO -0.08 -0.61 0.07 0.42 -0.85 0.00 0.00 174.74 173.69 2yu7 s ILE 65 N 2.02 3.87 -0.23 0.60 1.01 0.30 -4.90 121.20 123.87 2yu7 s ILE 65 Ca 0.11 -0.72 -0.28 0.00 0.00 0.00 0.00 60.65 59.75 2yu7 s ILE 65 Cb -0.17 -2.99 -0.04 0.00 0.01 0.00 0.00 42.46 39.26 2yu7 s ILE 65 CO 0.12 0.09 1.99 -0.54 0.00 0.00 0.00 174.94 176.60 2yu7 s LYS 66 N 1.48 3.36 -0.22 2.79 1.02 -1.26 -0.12 119.74 126.80 2yu7 s LYS 66 Ca 0.02 1.84 -0.23 0.00 0.02 0.00 0.00 55.97 57.62 2yu7 s LYS 66 Cb -0.17 -4.26 -0.01 0.00 -0.52 0.00 0.00 37.83 32.87 2yu7 s LYS 66 CO 0.02 -1.83 0.75 0.08 -0.92 0.00 0.00 175.35 173.45 2yu7 s VAL 67 N 7.15 4.91 -0.16 3.17 1.01 0.13 -4.79 120.40 131.83 2yu7 s VAL 67 Ca 0.89 1.43 -0.22 0.00 0.00 0.00 0.00 61.98 64.08 2yu7 s VAL 67 Cb -0.29 -4.05 -0.03 0.00 0.00 0.00 0.00 36.38 32.01 2yu7 s VAL 67 CO 0.35 0.01 0.69 -0.04 0.00 0.00 0.00 175.10 176.10 2yu7 s MET 68 N 2.41 4.29 -0.12 2.72 -1.94 0.66 -2.94 119.30 124.38 2yu7 s MET 68 Ca 0.33 0.76 0.03 0.00 -1.71 0.00 0.00 55.69 55.10 2yu7 s MET 68 Cb -0.16 -3.54 0.00 0.00 2.01 0.00 0.00 34.83 33.14 2yu7 s MET 68 CO 0.09 -0.17 -0.22 0.00 -0.01 0.00 0.00 175.02 174.71 2yu7 s GLU 70 N 0.50 1.13 0.00 0.00 -1.05 -1.05 -4.93 118.70 113.30 2yu7 s GLU 70 Ca -0.14 -0.28 0.00 0.00 -0.15 0.00 0.00 54.97 54.40 2yu7 s GLU 70 Cb -0.17 -1.66 0.00 0.00 -0.44 0.00 0.00 34.13 31.86 2yu7 s GLU 70 CO 0.05 -0.39 0.00 0.41 0.95 0.00 0.00 175.26 176.28 2yu7 n GLY 71 N 4.99 0.69 0.31 -3.83 0.00 -1.26 -1.87 105.19 104.22 2yu7 n GLY 71 Ca -0.10 0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.01 2yu7 n GLY 71 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2yu7 n GLY 72 N 0.00 0.90 3.78 -0.02 0.00 -1.26 -5.14 105.19 103.45 2yu7 n GLY 72 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.70 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 2.20 0.01 1.61 3.03 -0.78 -4.44 118.95 120.59 2yu7 s ARG 73 Ca 0.00 -2.34 0.01 0.00 2.03 0.00 0.00 55.73 55.42 2yu7 s ARG 73 Cb 0.00 -1.62 -0.01 0.00 -1.03 0.00 0.00 34.95 32.29 2yu7 s ARG 73 CO 0.00 -0.39 -0.03 0.71 -1.13 0.00 0.00 175.30 174.46 2yu7 s TYR 74 N -2.86 0.27 0.17 5.89 2.02 -1.08 -2.52 117.35 119.24 2yu7 s TYR 74 Ca 0.10 -0.31 -0.13 0.00 -0.37 0.00 0.00 57.07 56.36 2yu7 s TYR 74 Cb 0.01 -0.18 0.01 0.00 -0.40 0.00 0.00 41.96 41.40 2yu7 s TYR 74 CO 0.06 -0.09 0.39 -0.08 -1.57 0.00 0.00 175.55 174.25 2yu7 s THR 75 N -0.85 0.05 -0.22 -0.71 -1.32 0.13 -1.21 115.64 111.51 2yu7 s THR 75 Ca -0.08 -1.06 -0.04 0.00 -1.21 0.00 0.00 61.69 59.30 2yu7 s THR 75 Cb -0.06 -1.65 0.12 0.00 -1.51 0.00 0.00 72.50 69.39 2yu7 s THR 75 CO -0.00 -0.24 0.37 0.68 -2.21 0.00 0.00 174.62 173.21 2yu7 s VAL 76 N -3.91 -0.58 0.00 5.08 -7.23 -1.26 -0.25 120.40 112.25 2yu7 s VAL 76 Ca 0.12 0.00 0.00 0.00 -1.81 0.00 0.00 61.98 60.29 2yu7 s VAL 76 Cb 0.01 -0.74 0.00 0.00 0.56 0.00 0.00 36.38 36.21 2yu7 s VAL 76 CO -0.03 -0.07 0.00 0.61 -0.31 0.00 0.00 175.10 175.30 2yu7 n GLY 77 N 5.37 1.14 0.00 2.32 0.00 -1.26 -4.84 105.19 107.92 2yu7 n GLY 77 Ca -0.05 -0.01 0.00 0.00 0.00 0.00 0.00 46.02 45.96 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 1.58 0.08 -0.02 0.00 -1.26 -5.04 105.19 100.53 2yu7 n GLY 78 Ca 0.00 -2.05 0.02 0.00 0.00 0.00 0.00 46.02 43.99 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 0.57 -3.58 0.99 -0.00 -1.26 -4.91 117.00 108.81 2yu7 n LEU 79 Ca 0.00 0.24 -0.30 0.00 -0.00 0.00 0.00 56.01 55.95 2yu7 n LEU 79 Cb 0.00 0.10 -0.13 0.00 -0.00 0.00 0.00 43.42 43.39 2yu7 n LEU 79 CO 0.00 0.12 1.75 -0.62 -0.00 0.00 0.00 177.39 178.64 2yu7 n GLU 80 N -2.71 0.00 -3.36 1.47 1.02 -1.26 -4.82 120.64 110.97 2yu7 n GLU 80 Ca -0.11 0.00 -0.45 0.00 -0.02 0.00 0.00 57.16 56.58 2yu7 n GLU 80 Cb 0.79 -1.12 -0.06 0.00 -0.02 0.00 0.00 31.44 31.03 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 5.78 5.11 0.75 2.62 -4.23 -1.26 -4.22 115.64 120.19 2yu7 s THR 81 Ca 1.08 -1.40 -0.11 0.00 -1.18 0.00 0.00 61.69 60.08 2yu7 s THR 81 Cb -0.94 -4.21 0.04 0.00 1.34 0.00 0.00 72.50 68.73 2yu7 s THR 81 CO 0.40 -0.77 1.08 -0.36 -0.54 0.00 0.00 174.62 174.43 2yu7 s PHE 82 N 1.59 2.75 0.41 3.99 0.40 -0.35 -4.75 117.98 122.01 2yu7 s PHE 82 Ca 0.03 1.51 0.08 0.00 -0.60 0.00 0.00 56.93 57.95 2yu7 s PHE 82 Cb -0.28 -3.00 0.86 0.00 0.51 0.00 0.00 43.02 41.11 2yu7 s PHE 82 CO 0.04 -1.63 2.03 -0.44 0.70 0.00 0.00 175.22 175.92 2yu7 h ASP 83 N -1.01 0.40 -5.26 1.36 3.32 -1.89 -2.87 116.42 110.46 2yu7 h ASP 83 Ca -0.44 -0.03 0.18 0.00 0.02 0.00 0.00 57.03 56.77 2yu7 h ASP 83 Cb 1.23 -0.10 -0.09 0.00 0.22 0.00 0.00 39.33 40.58 2yu7 h ASP 83 CO 0.53 0.34 0.51 -0.44 -1.72 0.00 0.00 179.24 178.47 2yu7 s SER 84 N -6.75 -0.19 0.27 6.45 0.01 -1.26 -4.44 113.70 107.78 2yu7 s SER 84 Ca -0.08 -0.33 -0.00 0.00 1.31 0.00 0.00 55.95 56.85 2yu7 s SER 84 Cb 0.17 0.45 0.54 0.00 0.21 0.00 0.00 66.02 67.38 2yu7 s SER 84 CO 0.73 -0.82 1.78 -0.07 0.41 0.00 0.00 173.24 175.28 2yu7 h LEU 85 N 2.00 0.64 -1.10 2.44 3.38 -1.91 0.24 115.31 121.00 2yu7 h LEU 85 Ca -0.24 0.08 0.19 0.00 0.09 0.00 0.00 57.88 58.00 2yu7 h LEU 85 Cb 1.23 -0.03 -0.10 0.00 0.09 0.00 0.00 40.66 41.85 2yu7 h LEU 85 CO 0.26 0.29 0.61 0.74 0.09 0.00 0.00 178.44 180.44 2yu7 h THR 86 N 0.72 0.70 0.00 0.22 2.02 -1.98 0.36 112.91 114.95 2yu7 h THR 86 Ca 0.47 -0.24 -0.04 0.00 0.77 0.00 0.00 66.41 67.37 2yu7 h THR 86 Cb 0.61 -0.06 -0.01 0.00 -1.74 0.00 0.00 68.15 66.95 2yu7 h THR 86 CO -0.33 0.13 -0.22 -0.78 0.37 0.00 0.00 175.52 174.68 2yu7 h ASP 87 N 0.70 0.00 -0.87 4.18 1.82 -1.46 -1.49 116.42 119.31 2yu7 h ASP 87 Ca 0.56 -0.77 0.18 0.00 -0.39 0.00 0.00 57.03 56.62 2yu7 h ASP 87 Cb 0.96 0.00 -0.06 0.00 0.68 0.00 0.00 39.33 40.91 2yu7 h ASP 87 CO -0.34 1.02 0.57 0.25 -1.61 0.00 0.00 179.24 179.13 2yu7 h LEU 88 N -1.00 0.44 0.03 2.28 6.46 -0.61 -0.78 115.31 122.13 2yu7 h LEU 88 Ca -0.06 0.04 -0.11 0.00 -0.12 0.00 0.00 57.88 57.63 2yu7 h LEU 88 Cb 0.92 -0.04 -0.01 0.00 -0.73 0.00 0.00 40.66 40.80 2yu7 h LEU 88 CO -0.04 0.19 -0.57 0.58 -0.62 0.00 0.00 178.44 177.98 2yu7 h VAL 89 N 0.45 1.45 -0.76 1.05 2.07 -0.41 -3.32 116.25 116.77 2yu7 h VAL 89 Ca 0.45 -2.32 0.17 0.00 0.82 0.00 0.00 66.70 65.81 2yu7 h VAL 89 Cb 1.04 2.98 -0.12 0.00 -1.52 0.00 0.00 31.29 33.67 2yu7 h VAL 89 CO -0.17 0.55 0.17 -0.33 0.02 0.00 0.00 177.57 177.81 2yu7 h GLU 90 N -0.87 0.24 -0.46 1.57 5.08 -0.72 0.57 114.58 119.99 2yu7 h GLU 90 Ca -0.14 -0.01 0.05 0.00 -1.00 0.00 0.00 59.36 58.26 2yu7 h GLU 90 Cb 1.22 -0.05 -0.03 0.00 0.50 0.00 0.00 28.75 30.39 2yu7 h GLU 90 CO -0.04 0.16 0.31 1.25 -1.00 0.00 0.00 179.01 179.69 2yu7 h HIS 91 N 0.25 0.40 0.00 4.33 2.76 -1.30 -1.23 115.15 120.35 2yu7 h HIS 91 Ca 0.44 0.01 -0.17 0.00 -2.20 0.00 0.00 60.37 58.44 2yu7 h HIS 91 Cb 0.77 -0.13 -0.03 0.00 1.55 0.00 0.00 27.41 29.57 2yu7 h HIS 91 CO -0.28 0.22 -1.10 0.74 -1.30 0.00 0.00 177.93 176.21 2yu7 h PHE 92 N 0.40 0.00 0.00 5.26 0.04 -0.22 -2.63 116.94 119.80 2yu7 h PHE 92 Ca 0.20 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.96 2yu7 h PHE 92 Cb 0.27 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.42 2yu7 h PHE 92 CO -0.00 0.69 -0.02 0.87 -0.60 0.00 0.00 178.31 179.25 2yu7 h LYS 93 N 0.00 0.00 0.00 1.51 1.57 0.11 1.46 116.57 121.21 2yu7 h LYS 93 Ca -0.10 0.00 -0.36 0.00 -1.87 0.00 0.00 60.65 58.31 2yu7 h LYS 93 Cb 1.62 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 33.87 2yu7 h LYS 93 CO 0.07 0.02 -2.25 0.36 -0.57 0.00 0.00 179.45 177.08 2yu7 n LYS 94 N -3.54 0.50 -0.06 3.15 2.85 -1.13 -4.60 118.16 115.32 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 0.11 -1.35 -0.13 0.00 -0.65 0.00 0.00 35.03 33.01 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 -0.53 1.13 0.00 0.58 1.35 -1.40 -3.52 112.91 110.54 2yu7 h THR 95 Ca -0.54 -2.28 0.00 0.00 -0.55 0.00 0.00 66.41 63.04 2yu7 h THR 95 Cb 1.59 2.62 0.00 0.00 -1.73 0.00 0.00 68.15 70.63 2yu7 h THR 95 CO -0.25 0.50 0.00 0.61 -0.25 0.00 0.00 175.52 176.13 2yu7 n GLY 96 N 1.57 1.32 3.58 5.82 0.00 0.50 -5.01 105.19 112.97 2yu7 n GLY 96 Ca -0.25 -2.03 -0.34 0.00 0.00 0.00 0.00 46.02 43.39 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 -1.86 4.09 -0.27 -0.61 1.01 0.05 -4.75 121.20 118.85 2yu7 s ILE 97 Ca 0.00 -0.31 -0.08 0.00 0.00 0.00 0.00 60.65 60.26 2yu7 s ILE 97 Cb 0.00 -2.76 -0.02 0.00 0.01 0.00 0.00 42.46 39.68 2yu7 s ILE 97 CO 0.00 0.54 0.10 -0.70 0.00 0.00 0.00 174.94 174.88 2yu7 s GLU 98 N -0.14 3.58 0.41 2.79 2.12 -1.26 0.02 118.70 126.22 2yu7 s GLU 98 Ca 0.04 -0.54 -0.23 0.00 0.36 0.00 0.00 54.97 54.60 2yu7 s GLU 98 Cb -0.13 -3.41 -0.09 0.00 0.26 0.00 0.00 34.13 30.75 2yu7 s GLU 98 CO 0.02 -0.25 1.01 -1.21 -0.54 0.00 0.00 175.26 174.29 2yu7 s GLU 99 N 1.62 4.16 0.44 4.30 2.02 0.22 -4.90 118.70 126.56 2yu7 s GLU 99 Ca 0.06 1.38 0.29 0.00 0.02 0.00 0.00 54.97 56.72 2yu7 s GLU 99 Cb -0.16 -2.42 1.38 0.00 0.10 0.00 0.00 34.13 33.04 2yu7 s GLU 99 CO 0.05 -0.12 1.67 0.00 0.02 0.00 0.00 175.26 176.87 2yu7 h ALA 100 N 2.29 2.72 -0.16 5.21 0.00 -1.98 0.86 119.26 128.19 2yu7 h ALA 100 Ca -0.48 0.08 -0.20 0.00 0.00 0.00 0.00 54.91 54.30 2yu7 h ALA 100 Cb 1.21 0.15 0.00 0.00 0.00 0.00 0.00 17.79 19.15 2yu7 h ALA 100 CO 0.62 -1.28 -0.72 0.66 0.00 0.00 0.00 179.25 178.53 2yu7 h SER 101 N 0.14 0.82 0.00 0.00 4.64 -2.04 -3.47 113.55 113.64 2yu7 h SER 101 Ca 0.76 -0.52 0.00 0.00 -0.47 0.00 0.00 61.79 61.56 2yu7 h SER 101 Cb 2.39 -0.24 0.00 0.00 -0.31 0.00 0.00 62.40 64.24 2yu7 h SER 101 CO -0.34 1.30 0.00 0.61 -0.87 0.00 0.00 176.83 177.53 2yu7 n GLY 102 N 0.58 1.28 3.17 -0.77 0.00 0.30 -5.13 105.19 104.61 2yu7 n GLY 102 Ca -0.06 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.59 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 -4.02 -3.86 4.61 0.00 -1.26 -4.38 120.51 111.60 2yu7 n ALA 103 Ca 0.00 -0.40 -0.29 0.00 0.00 0.00 0.00 53.44 52.75 2yu7 n ALA 103 Cb 0.00 -1.36 -0.16 0.00 0.00 0.00 0.00 19.45 17.93 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 -2.01 1.77 -0.10 0.00 0.08 -1.26 -0.61 117.98 115.85 2yu7 s PHE 104 Ca 0.50 -1.30 -0.20 0.00 0.12 0.00 0.00 56.93 56.04 2yu7 s PHE 104 Cb -0.31 -1.33 -0.04 0.00 -0.57 0.00 0.00 43.02 40.77 2yu7 s PHE 104 CO 0.73 -0.68 0.58 0.08 -0.10 0.00 0.00 175.22 175.83 2yu7 s VAL 105 N 1.61 5.12 -0.10 -0.44 1.01 0.10 -4.88 120.40 122.82 2yu7 s VAL 105 Ca -0.03 1.17 0.02 0.00 0.00 0.00 0.00 61.98 63.15 2yu7 s VAL 105 Cb -0.18 -3.92 -0.01 0.00 0.00 0.00 0.00 36.38 32.28 2yu7 s VAL 105 CO -0.07 0.28 -0.18 -0.31 0.00 0.00 0.00 175.10 174.82 2yu7 s TYR 106 N 0.79 2.67 -0.35 5.22 2.02 -1.26 -0.77 117.35 125.66 2yu7 s TYR 106 Ca 0.31 -0.70 -0.03 0.00 -0.37 0.00 0.00 57.07 56.28 2yu7 s TYR 106 Cb -0.16 -1.74 0.08 0.00 -0.40 0.00 0.00 41.96 39.73 2yu7 s TYR 106 CO 0.13 -0.21 0.11 -0.51 -1.57 0.00 0.00 175.55 173.50 2yu7 s LEU 107 N 0.12 4.57 0.00 -1.29 1.02 -1.26 -4.17 118.68 117.68 2yu7 s LEU 107 Ca -0.09 -1.60 0.00 0.00 0.02 0.00 0.00 54.13 52.46 2yu7 s LEU 107 Cb -0.15 -1.79 0.00 0.00 0.02 0.00 0.00 46.19 44.27 2yu7 s LEU 107 CO 0.06 -0.40 0.00 0.54 0.02 0.00 0.00 176.35 176.57 2yu7 n ARG 108 N 4.63 2.30 -3.56 1.70 1.74 -0.51 -4.43 116.66 118.52 2yu7 n ARG 108 Ca -0.08 0.00 -0.41 0.00 -0.77 0.00 0.00 57.85 56.59 2yu7 n ARG 108 Cb 0.43 -0.79 -0.09 0.00 -1.02 0.00 0.00 32.46 30.98 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 -1.58 2.59 -0.19 5.56 -0.21 -1.01 -5.02 119.66 119.79 2yu7 s GLN 109 Ca 0.00 -1.58 -0.29 0.00 0.02 0.00 0.00 55.36 53.51 2yu7 s GLN 109 Cb 0.00 -3.88 -0.03 0.00 1.00 0.00 0.00 33.01 30.10 2yu7 s GLN 109 CO 0.00 -1.07 1.60 -1.25 -2.12 0.00 0.00 175.29 172.45 2yu7 s PRO 110 N 1.42 3.88 -0.42 2.91 0.04 -1.26 -2.21 135.00 139.35 2yu7 s PRO 110 Ca 0.04 1.74 -0.23 0.00 0.04 0.00 0.00 61.00 62.59 2yu7 s PRO 110 Cb -0.25 -4.01 0.02 0.00 0.04 0.00 0.00 34.50 30.30 2yu7 s PRO 110 CO 0.01 -1.19 0.76 -0.47 0.04 0.00 0.00 177.00 176.15 2yu7 s TYR 111 N 4.92 3.04 -0.28 0.56 5.04 -0.36 -4.91 117.35 125.35 2yu7 s TYR 111 Ca 0.71 0.24 0.08 0.00 -2.44 0.00 0.00 57.07 55.65 2yu7 s TYR 111 Cb -0.26 -3.53 0.46 0.00 0.35 0.00 0.00 41.96 38.97 2yu7 s TYR 111 CO 0.28 -0.89 1.19 2.48 -1.34 0.00 0.00 175.55 177.27 2yu7 n TYR 112 N 6.56 2.54 -3.84 4.97 0.18 -1.26 -4.69 117.16 121.61 2yu7 n TYR 112 Ca 0.02 -2.17 -0.29 0.00 1.88 0.00 0.00 57.90 57.33 2yu7 n TYR 112 Cb 0.48 -0.33 -0.13 0.00 -0.38 0.00 0.00 39.34 38.98 2yu7 n TYR 112 CO 0.00 0.00 0.00 0.45 -2.08 0.00 0.00 176.86 175.23 2yu7 s SER 113 N -3.58 4.06 0.00 9.48 0.15 -1.26 -4.67 113.70 117.88 2yu7 s SER 113 Ca 0.50 -3.01 0.00 0.00 0.70 0.00 0.00 55.95 54.14 2yu7 s SER 113 Cb 0.41 -1.39 0.00 0.00 -1.71 0.00 0.00 66.02 63.32 2yu7 s SER 113 CO 0.03 -0.22 0.00 0.61 1.20 0.00 0.00 173.24 174.86 2yu7 n GLY 114 N 3.08 0.18 0.27 9.45 0.00 -1.26 -4.85 105.19 112.06 2yu7 n GLY 114 Ca 0.09 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.27 2yu7 n GLY 114 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2yu7 h PRO 115 N 0.00 0.00 -6.33 1.61 0.13 -1.95 -3.45 132.00 122.01 2yu7 h PRO 115 Ca 0.00 0.00 -0.52 0.00 -0.87 0.00 0.00 66.00 64.61 2yu7 h PRO 115 Cb 0.00 0.00 0.24 0.00 0.13 0.00 0.00 31.00 31.37 2yu7 h PRO 115 CO 0.00 0.06 -1.52 0.43 -0.23 0.00 0.00 178.00 176.74 2yu7 n SER 116 N -3.20 -3.88 -3.62 1.44 7.64 -1.26 -5.02 113.62 105.72 2yu7 n SER 116 Ca 0.00 0.16 -0.06 0.00 1.01 0.00 0.00 58.87 59.98 2yu7 n SER 116 Cb 0.32 -0.88 -0.01 0.00 -1.01 0.00 0.00 64.21 62.64 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 -1.42 -0.16 0.00 6.43 1.04 -1.26 -5.12 113.70 113.22 2yu7 s SER 117 Ca 0.47 -0.63 0.00 0.00 0.48 0.00 0.00 55.95 56.27 2yu7 s SER 117 Cb -0.13 0.64 0.00 0.00 0.10 0.00 0.00 66.02 66.62 2yu7 s SER 117 CO 0.73 -1.20 0.00 0.61 0.98 0.00 0.00 173.24 174.36