#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dhj s SER 2 N 0.00 3.21 0.56 1.61 0.15 -1.26 -5.13 113.70 112.84 2dhj s SER 2 Ca 0.00 -0.62 -0.01 0.00 0.70 0.00 0.00 55.95 56.03 2dhj s SER 2 Cb 0.00 -1.49 0.03 0.00 -1.71 0.00 0.00 66.02 62.85 2dhj s SER 2 CO 0.00 0.02 0.80 -0.44 1.20 0.00 0.00 173.24 174.83 2dhj s SER 3 N 1.16 5.32 0.07 5.45 0.01 -1.26 -4.97 113.70 119.48 2dhj s SER 3 Ca 0.02 0.16 0.00 0.00 1.31 0.00 0.00 55.95 57.44 2dhj s SER 3 Cb -0.14 -1.08 0.00 0.00 0.21 0.00 0.00 66.02 65.01 2dhj s SER 3 CO -0.09 -1.13 0.00 0.61 0.41 0.00 0.00 173.24 173.03 2dhj n GLY 4 N -2.41 -1.39 3.71 3.44 0.00 -1.26 -5.15 105.19 102.13 2dhj n GLY 4 Ca 0.07 0.54 -0.30 0.00 0.00 0.00 0.00 46.02 46.32 2dhj n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2dhj s SER 5 N -2.00 3.47 -0.04 1.61 0.15 -1.26 -5.06 113.70 110.57 2dhj s SER 5 Ca 0.00 1.64 0.00 0.00 0.70 0.00 0.00 55.95 58.29 2dhj s SER 5 Cb 0.00 -2.30 0.02 0.00 -1.71 0.00 0.00 66.02 62.04 2dhj s SER 5 CO 0.00 -2.66 -0.02 -0.94 1.20 0.00 0.00 173.24 170.82 2dhj s SER 6 N -3.27 0.79 0.00 5.45 1.04 -1.26 -5.08 113.70 111.36 2dhj s SER 6 Ca 0.64 -0.08 0.00 0.00 0.48 0.00 0.00 55.95 56.99 2dhj s SER 6 Cb -0.19 -0.34 0.00 0.00 0.10 0.00 0.00 66.02 65.59 2dhj s SER 6 CO 0.57 -0.09 0.00 0.61 0.98 0.00 0.00 173.24 175.31 2dhj n GLY 7 N 4.22 0.65 0.70 7.32 0.00 -1.26 -4.85 105.19 111.96 2dhj n GLY 7 Ca -0.23 -1.51 0.04 0.00 0.00 0.00 0.00 46.02 44.32 2dhj n GLY 7 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2dhj n ASP 8 N 0.00 2.38 -3.51 1.61 8.00 -1.26 -4.93 116.55 118.84 2dhj n ASP 8 Ca 0.00 -3.57 -0.16 0.00 0.71 0.00 0.00 54.79 51.78 2dhj n ASP 8 Cb 0.00 -0.54 -0.12 0.00 -0.02 0.00 0.00 41.12 40.43 2dhj n ASP 8 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2dhj s ALA 9 N -3.11 -0.47 0.25 2.24 0.00 -1.26 -4.68 121.76 114.74 2dhj s ALA 9 Ca 0.39 0.52 0.04 0.00 0.00 0.00 0.00 51.96 52.91 2dhj s ALA 9 Cb 0.36 -1.30 0.68 0.00 0.00 0.00 0.00 23.12 22.85 2dhj s ALA 9 CO -0.01 -1.08 1.22 0.00 0.00 0.00 0.00 175.76 175.90 2dhj n ALA 10 N 5.33 0.47 -3.63 0.00 0.00 0.73 -4.65 120.51 118.76 2dhj n ALA 10 Ca -0.05 0.83 -0.07 0.00 0.00 0.00 0.00 53.44 54.15 2dhj n ALA 10 Cb 0.50 -0.64 -0.02 0.00 0.00 0.00 0.00 19.45 19.29 2dhj n ALA 10 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 2dhj s LYS 11 N -5.62 1.16 0.10 0.00 2.20 -1.22 -4.67 119.74 111.70 2dhj s LYS 11 Ca -0.10 -0.55 -0.26 0.00 -0.36 0.00 0.00 55.97 54.70 2dhj s LYS 11 Cb 0.24 0.45 0.08 0.00 -1.51 0.00 0.00 37.83 37.09 2dhj s LYS 11 CO 0.61 -0.52 0.85 -1.83 -0.36 0.00 0.00 175.35 174.10 2dhj s GLU 12 N -3.39 1.11 0.00 4.03 4.04 -1.26 0.16 118.70 123.40 2dhj s GLU 12 Ca 0.08 -0.51 0.00 0.00 0.04 0.00 0.00 54.97 54.57 2dhj s GLU 12 Cb -0.02 0.44 0.00 0.00 0.02 0.00 0.00 34.13 34.58 2dhj s GLU 12 CO -0.03 -0.50 0.00 0.41 -1.84 0.00 0.00 175.26 173.30 2dhj n GLY 13 N -0.36 3.28 3.60 -3.83 0.00 -0.74 -5.01 105.19 102.13 2dhj n GLY 13 Ca -0.09 -0.92 -0.43 0.00 0.00 0.00 0.00 46.02 44.58 2dhj n GLY 13 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2dhj s TRP 14 N -2.00 1.80 0.01 1.61 0.52 -1.26 -2.30 118.94 117.32 2dhj s TRP 14 Ca 0.00 0.61 0.03 0.00 0.02 0.00 0.00 56.10 56.76 2dhj s TRP 14 Cb 0.00 -4.12 -0.01 0.00 -1.15 0.00 0.00 33.47 28.18 2dhj s TRP 14 CO 0.00 -3.00 -0.09 -0.51 0.02 0.00 0.00 176.95 173.38 2dhj s LEU 15 N 6.83 2.10 -0.45 2.99 1.43 -1.26 -4.78 118.68 125.53 2dhj s LEU 15 Ca 0.80 -0.29 -0.29 0.00 -1.03 0.00 0.00 54.13 53.33 2dhj s LEU 15 Cb -0.23 -0.36 0.02 0.00 0.03 0.00 0.00 46.19 45.64 2dhj s LEU 15 CO 0.34 0.01 1.34 -1.00 0.23 0.00 0.00 176.35 177.26 2dhj s HIS 16 N -0.57 2.50 -0.44 0.29 3.76 -1.22 -3.26 115.29 116.35 2dhj s HIS 16 Ca -0.00 0.66 -0.19 0.00 -0.15 0.00 0.00 55.06 55.37 2dhj s HIS 16 Cb -0.05 -4.36 0.03 0.00 1.11 0.00 0.00 32.58 29.30 2dhj s HIS 16 CO 0.00 -1.79 0.56 0.12 -0.85 0.00 0.00 174.74 172.79 2dhj s PHE 17 N 5.23 3.10 -0.37 1.40 5.36 0.16 -3.04 117.98 129.82 2dhj s PHE 17 Ca 0.57 -0.24 0.01 0.00 -0.96 0.00 0.00 56.93 56.31 2dhj s PHE 17 Cb -0.11 -3.19 0.11 0.00 -0.34 0.00 0.00 43.02 39.48 2dhj s PHE 17 CO 0.32 -0.82 0.13 0.50 -1.46 0.00 0.00 175.22 173.89 2dhj s ARG 18 N 2.53 1.13 0.34 10.12 3.52 -1.15 -2.66 118.95 132.79 2dhj s ARG 18 Ca 0.18 -1.61 -0.28 0.00 -0.13 0.00 0.00 55.73 53.88 2dhj s ARG 18 Cb -0.16 -2.46 -0.09 0.00 -1.56 0.00 0.00 34.95 30.68 2dhj s ARG 18 CO 0.16 -1.03 1.21 -1.25 -0.81 0.00 0.00 175.30 173.59 2dhj s PRO 19 N 0.99 4.32 -0.06 5.12 0.04 -1.26 -0.86 135.00 143.28 2dhj s PRO 19 Ca 0.13 2.00 -0.25 0.00 0.04 0.00 0.00 61.00 62.92 2dhj s PRO 19 Cb -0.20 -2.97 -0.25 0.00 0.04 0.00 0.00 34.50 31.12 2dhj s PRO 19 CO -0.13 -0.14 0.97 -0.07 0.04 0.00 0.00 177.00 177.67 2dhj h LEU 20 N 3.23 0.24 -7.94 -3.56 3.38 -1.26 -3.47 115.31 105.93 2dhj h LEU 20 Ca -0.48 -0.84 -0.21 0.00 0.09 0.00 0.00 57.88 56.44 2dhj h LEU 20 Cb 1.23 -0.07 -0.24 0.00 0.09 0.00 0.00 40.66 41.67 2dhj h LEU 20 CO 0.65 1.05 -0.71 0.68 0.09 0.00 0.00 178.44 180.19 2dhj s VAL 21 N -2.89 0.17 0.00 1.22 -7.23 -1.24 -5.03 120.40 105.40 2dhj s VAL 21 Ca -0.16 -0.64 0.00 0.00 -1.81 0.00 0.00 61.98 59.38 2dhj s VAL 21 Cb 0.00 -0.25 0.00 0.00 0.56 0.00 0.00 36.38 36.69 2dhj s VAL 21 CO 0.75 -0.30 0.00 0.35 -0.31 0.00 0.00 175.10 175.59 2dhj n THR 22 N 2.09 0.00 -4.98 5.32 -2.24 -1.26 -4.42 114.28 108.79 2dhj n THR 22 Ca -0.20 -0.21 -0.29 0.00 -2.27 0.00 0.00 64.05 61.09 2dhj n THR 22 Cb 0.57 0.71 -0.17 0.00 -2.10 0.00 0.00 70.33 69.34 2dhj n THR 22 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2dhj s ASP 23 N -1.16 2.53 -0.27 3.42 1.01 -1.26 -5.11 116.67 115.84 2dhj s ASP 23 Ca 0.00 -0.44 0.02 0.00 0.71 0.00 0.00 52.55 52.84 2dhj s ASP 23 Cb 0.00 -0.99 0.07 0.00 1.01 0.00 0.00 42.92 43.00 2dhj s ASP 23 CO 0.00 0.14 -0.06 -0.54 0.21 0.00 0.00 175.17 174.92 2dhj s LYS 24 N 0.28 1.86 0.00 8.23 1.02 -1.26 -4.76 119.74 125.11 2dhj s LYS 24 Ca -0.12 -1.30 0.00 0.00 0.02 0.00 0.00 55.97 54.57 2dhj s LYS 24 Cb -0.15 -2.81 0.00 0.00 -0.52 0.00 0.00 37.83 34.35 2dhj s LYS 24 CO 0.05 -0.65 0.00 0.41 -0.92 0.00 0.00 175.35 174.24 2dhj n GLY 25 N 4.50 0.50 3.43 -3.33 0.00 -1.26 -5.11 105.19 103.93 2dhj n GLY 25 Ca -0.10 -0.32 -0.14 0.00 0.00 0.00 0.00 46.02 45.47 2dhj n GLY 25 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2dhj s LYS 26 N -2.16 1.70 -0.37 1.61 -0.14 -1.26 -5.14 119.74 113.98 2dhj s LYS 26 Ca 0.00 -1.67 0.02 0.00 -1.36 0.00 0.00 55.97 52.96 2dhj s LYS 26 Cb 0.00 0.40 0.11 0.00 -1.68 0.00 0.00 37.83 36.66 2dhj s LYS 26 CO 0.00 -0.67 0.13 1.03 -0.76 0.00 0.00 175.35 175.07 2dhj s ARG 27 N -3.49 1.18 0.01 1.68 0.52 -1.26 -5.11 118.95 112.49 2dhj s ARG 27 Ca 0.32 -1.66 0.07 0.00 -0.52 0.00 0.00 55.73 53.94 2dhj s ARG 27 Cb 0.01 -2.55 -0.03 0.00 0.52 0.00 0.00 34.95 32.90 2dhj s ARG 27 CO 0.17 -1.02 -0.23 0.08 0.02 0.00 0.00 175.30 174.33 2dhj s VAL 28 N 0.95 2.39 -0.85 3.52 1.01 -1.26 -5.07 120.40 121.10 2dhj s VAL 28 Ca 0.13 -1.14 0.01 0.00 0.00 0.00 0.00 61.98 60.97 2dhj s VAL 28 Cb -0.20 -1.92 0.26 0.00 0.00 0.00 0.00 36.38 34.52 2dhj s VAL 28 CO -0.12 0.47 0.98 0.61 0.00 0.00 0.00 175.10 177.04 2dhj n GLY 29 N 2.05 4.72 2.06 4.51 0.00 -1.26 -5.02 105.19 112.25 2dhj n GLY 29 Ca -0.16 -2.69 -0.10 0.00 0.00 0.00 0.00 46.02 43.06 2dhj n GLY 29 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2dhj n GLY 30 N 1.41 2.83 3.51 -0.02 0.00 -1.26 -5.18 105.19 106.48 2dhj n GLY 30 Ca 0.26 -1.64 -0.25 0.00 0.00 0.00 0.00 46.02 44.39 2dhj n GLY 30 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dhj s SER 31 N -2.39 3.86 0.13 1.61 0.01 -1.26 -5.12 113.70 110.53 2dhj s SER 31 Ca 0.21 -0.83 -0.29 0.00 1.31 0.00 0.00 55.95 56.35 2dhj s SER 31 Cb 0.00 -0.47 -0.06 0.00 0.21 0.00 0.00 66.02 65.70 2dhj s SER 31 CO 0.15 0.07 0.92 -0.63 0.41 0.00 0.00 173.24 174.16 2dhj s ILE 32 N -2.09 4.45 0.59 1.44 -1.09 -1.26 -5.04 121.20 118.20 2dhj s ILE 32 Ca 0.27 2.00 -0.15 0.00 -2.23 0.00 0.00 60.65 60.55 2dhj s ILE 32 Cb -0.07 -4.29 -0.04 0.00 -1.58 0.00 0.00 42.46 36.48 2dhj s ILE 32 CO 0.15 0.36 1.04 -0.13 -1.23 0.00 0.00 174.94 175.12 2dhj s ARG 33 N -0.25 3.44 0.90 2.79 3.00 -1.26 -5.04 118.95 122.52 2dhj s ARG 33 Ca 0.44 1.05 -0.12 0.00 0.00 0.00 0.00 55.73 57.11 2dhj s ARG 33 Cb -0.23 -2.06 0.13 0.00 0.00 0.00 0.00 34.95 32.79 2dhj s ARG 33 CO 0.29 -0.70 1.09 -1.25 0.00 0.00 0.00 175.30 174.74 2dhj s PRO 34 N -4.36 1.23 0.28 3.54 0.04 -1.26 -4.92 135.00 129.54 2dhj s PRO 34 Ca 0.60 0.81 -0.21 0.00 0.04 0.00 0.00 61.00 62.25 2dhj s PRO 34 Cb -0.14 -1.81 -0.14 0.00 0.04 0.00 0.00 34.50 32.46 2dhj s PRO 34 CO 0.40 -2.26 0.22 0.91 0.04 0.00 0.00 177.00 176.32 2dhj n TRP 35 N -3.89 -1.26 -4.02 0.56 7.02 -1.26 -4.93 117.44 109.65 2dhj n TRP 35 Ca 0.07 0.65 -0.31 0.00 -1.02 0.00 0.00 57.50 56.89 2dhj n TRP 35 Cb 0.55 -1.59 -0.15 0.00 -2.42 0.00 0.00 31.31 27.70 2dhj n TRP 35 CO 0.00 0.00 0.00 0.15 -2.02 0.00 0.00 177.69 175.82 2dhj s LYS 36 N -0.86 1.82 -0.38 -0.99 1.02 -1.09 -4.96 119.74 114.30 2dhj s LYS 36 Ca 0.52 -1.47 -0.29 0.00 0.02 0.00 0.00 55.97 54.76 2dhj s LYS 36 Cb -0.65 -2.92 0.01 0.00 -0.52 0.00 0.00 37.83 33.76 2dhj s LYS 36 CO 0.52 -0.72 1.32 -1.14 -0.92 0.00 0.00 175.35 174.40 2dhj s GLN 37 N 1.10 3.73 -0.16 1.68 0.74 -1.26 -0.67 119.66 124.81 2dhj s GLN 37 Ca -0.01 0.98 -0.07 0.00 0.05 0.00 0.00 55.36 56.31 2dhj s GLN 37 Cb -0.19 -3.95 0.07 0.00 1.10 0.00 0.00 33.01 30.04 2dhj s GLN 37 CO -0.07 -1.37 0.36 0.00 -0.55 0.00 0.00 175.29 173.66 2dhj s MET 38 N 4.56 0.30 -0.44 1.67 0.23 -1.20 -4.86 119.30 119.56 2dhj s MET 38 Ca 0.57 0.82 -0.41 0.00 -1.03 0.00 0.00 55.69 55.63 2dhj s MET 38 Cb -0.13 0.06 -0.18 0.00 -1.53 0.00 0.00 34.83 33.06 2dhj s MET 38 CO 0.29 -0.21 1.57 0.98 -2.03 0.00 0.00 175.02 175.61 2dhj n TYR 39 N 4.79 1.41 -3.77 3.16 9.36 0.64 -4.25 117.16 128.49 2dhj n TYR 39 Ca -0.16 0.92 -0.37 0.00 3.32 0.00 0.00 57.90 61.62 2dhj n TYR 39 Cb 0.52 -2.00 -0.13 0.00 -0.63 0.00 0.00 39.34 37.11 2dhj n TYR 39 CO 0.00 0.00 0.00 0.08 0.22 0.00 0.00 176.86 177.16 2dhj s VAL 40 N 3.46 4.08 0.08 2.97 1.01 -0.97 0.13 120.40 131.16 2dhj s VAL 40 Ca 0.97 -0.37 0.07 0.00 0.00 0.00 0.00 61.98 62.65 2dhj s VAL 40 Cb -1.33 -2.96 -0.04 0.00 0.00 0.00 0.00 36.38 32.04 2dhj s VAL 40 CO 0.69 0.27 -0.12 -0.69 0.00 0.00 0.00 175.10 175.25 2dhj s VAL 41 N 1.56 3.24 -0.28 2.92 1.01 0.57 -1.79 120.40 127.63 2dhj s VAL 41 Ca 0.05 -1.22 0.00 0.00 0.00 0.00 0.00 61.98 60.81 2dhj s VAL 41 Cb -0.16 -2.48 0.05 0.00 0.00 0.00 0.00 36.38 33.80 2dhj s VAL 41 CO 0.02 0.19 -0.05 -0.22 0.00 0.00 0.00 175.10 175.04 2dhj s LEU 42 N -1.96 3.67 -0.29 3.92 2.96 0.12 -0.69 118.68 126.41 2dhj s LEU 42 Ca 0.19 -1.28 0.03 0.00 -0.22 0.00 0.00 54.13 52.84 2dhj s LEU 42 Cb -0.11 -1.65 0.08 0.00 0.50 0.00 0.00 46.19 45.01 2dhj s LEU 42 CO 0.11 -0.22 -0.02 -0.13 -1.32 0.00 0.00 176.35 174.77 2dhj s ARG 43 N 1.20 1.68 5.38 1.98 0.52 -0.83 -0.19 118.95 128.70 2dhj s ARG 43 Ca -0.06 -1.45 0.00 0.00 -0.52 0.00 0.00 55.73 53.70 2dhj s ARG 43 Cb -0.20 -2.86 0.00 0.00 0.52 0.00 0.00 34.95 32.41 2dhj s ARG 43 CO -0.03 -0.75 0.00 0.41 0.02 0.00 0.00 175.30 174.95 2dhj n GLY 44 N 4.45 1.58 0.04 -3.53 0.00 -1.26 -2.53 105.19 103.94 2dhj n GLY 44 Ca -0.06 -0.02 0.02 0.00 0.00 0.00 0.00 46.02 45.96 2dhj n GLY 44 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2dhj n HIS 45 N 0.00 0.00 -4.95 1.61 8.25 -1.26 -4.82 115.22 114.05 2dhj n HIS 45 Ca 0.00 -0.49 -0.27 0.00 -0.26 0.00 0.00 57.72 56.70 2dhj n HIS 45 Cb 0.00 -0.06 -0.16 0.00 1.12 0.00 0.00 29.99 30.89 2dhj n HIS 45 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 2dhj s SER 46 N -1.23 2.31 -0.34 0.41 0.01 -1.05 0.12 113.70 113.93 2dhj s SER 46 Ca 0.07 -0.36 -0.12 0.00 1.31 0.00 0.00 55.95 56.84 2dhj s SER 46 Cb 0.06 -0.36 -0.01 0.00 0.21 0.00 0.00 66.02 65.92 2dhj s SER 46 CO 0.01 0.22 0.23 -0.76 0.41 0.00 0.00 173.24 173.35 2dhj s LEU 47 N -0.34 4.47 -0.31 2.44 1.43 -1.03 -1.97 118.68 123.37 2dhj s LEU 47 Ca 0.05 -0.46 -0.11 0.00 -1.03 0.00 0.00 54.13 52.57 2dhj s LEU 47 Cb -0.09 -2.11 -0.02 0.00 0.03 0.00 0.00 46.19 44.00 2dhj s LEU 47 CO 0.00 -0.24 0.18 -0.31 0.23 0.00 0.00 176.35 176.21 2dhj s TYR 48 N 1.70 3.19 0.25 0.29 2.02 0.13 -3.34 117.35 121.59 2dhj s TYR 48 Ca 0.06 -0.38 0.04 0.00 -0.37 0.00 0.00 57.07 56.42 2dhj s TYR 48 Cb -0.17 -2.39 -0.03 0.00 -0.40 0.00 0.00 41.96 38.96 2dhj s TYR 48 CO 0.10 -0.39 0.38 -0.51 -1.57 0.00 0.00 175.55 173.56 2dhj s LEU 49 N 1.66 4.27 -0.13 -1.29 1.02 -1.26 -0.32 118.68 122.63 2dhj s LEU 49 Ca 0.05 0.16 -0.17 0.00 0.02 0.00 0.00 54.13 54.19 2dhj s LEU 49 Cb -0.17 -2.96 0.04 0.00 0.02 0.00 0.00 46.19 43.13 2dhj s LEU 49 CO 0.08 -0.09 0.46 -0.31 0.02 0.00 0.00 176.35 176.50 2dhj s TYR 50 N -2.00 -0.46 0.14 0.29 2.02 0.34 -4.59 117.35 113.09 2dhj s TYR 50 Ca 0.35 1.04 -0.09 0.00 -0.37 0.00 0.00 57.07 58.00 2dhj s TYR 50 Cb -0.09 0.18 -0.04 0.00 -0.40 0.00 0.00 41.96 41.60 2dhj s TYR 50 CO 0.30 -0.31 1.42 0.87 -1.57 0.00 0.00 175.55 176.26 2dhj h LYS 51 N 4.86 0.78 -6.10 -0.62 1.57 -1.89 1.89 116.57 117.07 2dhj h LYS 51 Ca -0.28 -0.52 -0.59 0.00 -1.87 0.00 0.00 60.65 57.39 2dhj h LYS 51 Cb 1.17 0.07 -0.12 0.00 0.08 0.00 0.00 32.23 33.43 2dhj h LYS 51 CO 0.27 1.14 -0.68 0.16 -0.57 0.00 0.00 179.45 179.77 2dhj s ASP 52 N -6.96 3.99 -0.39 0.86 -4.77 -1.26 -4.49 116.67 103.64 2dhj s ASP 52 Ca -0.10 -0.98 0.05 0.00 -3.30 0.00 0.00 52.55 48.23 2dhj s ASP 52 Cb 0.10 -0.49 0.51 0.00 -1.09 0.00 0.00 42.92 41.95 2dhj s ASP 52 CO 0.88 -0.11 1.59 1.17 0.70 0.00 0.00 175.17 179.41 2dhj n LYS 53 N -0.82 2.44 -0.03 2.11 4.81 -1.26 -4.63 118.16 120.77 2dhj n LYS 53 Ca -0.05 -3.40 -0.05 0.00 -0.87 0.00 0.00 58.31 53.94 2dhj n LYS 53 Cb 0.61 -2.06 -0.02 0.00 0.02 0.00 0.00 35.03 33.58 2dhj n LYS 53 CO 0.00 0.00 0.00 -2.13 1.17 0.00 0.00 177.40 176.44 2dhj n ARG 54 N -1.00 0.31 0.01 1.64 0.63 -1.26 -4.80 116.66 112.19 2dhj n ARG 54 Ca 0.45 0.12 -0.05 0.00 -0.92 0.00 0.00 57.85 57.46 2dhj n ARG 54 Cb 1.03 -1.05 -0.03 0.00 0.45 0.00 0.00 32.46 32.86 2dhj n ARG 54 CO 0.00 0.00 0.00 1.49 -2.51 0.00 0.00 177.63 176.61 2dhj h GLU 55 N -0.59 -0.19 -6.83 -0.14 4.57 -2.02 -3.45 114.58 105.93 2dhj h GLU 55 Ca -0.00 0.01 -0.57 0.00 -1.18 0.00 0.00 59.36 57.63 2dhj h GLU 55 Cb 0.59 0.04 -0.24 0.00 -0.16 0.00 0.00 28.75 28.99 2dhj h GLU 55 CO -0.00 -0.13 -0.85 1.04 -1.18 0.00 0.00 179.01 177.89 2dhj n GLN 56 N -3.46 -2.69 0.03 1.92 6.02 -1.26 -4.80 117.38 113.14 2dhj n GLN 56 Ca -0.02 0.33 -0.01 0.00 -0.01 0.00 0.00 57.00 57.29 2dhj n GLN 56 Cb 0.12 -4.98 -0.00 0.00 1.02 0.00 0.00 30.24 26.40 2dhj n GLN 56 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 177.06 178.46 2dhj n THR 57 N -4.33 1.09 -1.98 5.09 -1.04 -1.26 -5.07 114.28 106.78 2dhj n THR 57 Ca 0.06 0.34 -0.32 0.00 -2.04 0.00 0.00 64.05 62.10 2dhj n THR 57 Cb 0.49 -1.56 0.01 0.00 -1.82 0.00 0.00 70.33 67.45 2dhj n THR 57 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 2dhj s THR 58 N -1.92 4.18 0.32 12.58 -4.23 -1.26 -4.97 115.64 120.34 2dhj s THR 58 Ca -0.02 0.90 0.13 0.00 -1.18 0.00 0.00 61.69 61.52 2dhj s THR 58 Cb 0.00 -3.55 0.05 0.00 1.34 0.00 0.00 72.50 70.35 2dhj s THR 58 CO 0.03 -0.74 1.74 1.55 -0.54 0.00 0.00 174.62 176.65 2dhj h PRO 59 N 0.13 0.00 -0.87 3.99 0.13 -1.97 -3.45 132.00 129.96 2dhj h PRO 59 Ca -0.46 0.00 0.20 0.00 -0.87 0.00 0.00 66.00 64.87 2dhj h PRO 59 Cb 1.20 0.00 -0.28 0.00 0.13 0.00 0.00 31.00 32.05 2dhj h PRO 59 CO 0.59 0.46 0.51 -1.54 -0.23 0.00 0.00 178.00 177.79 2dhj s SER 60 N -6.84 -0.26 0.00 1.44 1.04 -1.26 -4.11 113.70 103.71 2dhj s SER 60 Ca -0.02 0.38 0.00 0.00 0.48 0.00 0.00 55.95 56.79 2dhj s SER 60 Cb 0.13 1.21 0.00 0.00 0.10 0.00 0.00 66.02 67.46 2dhj s SER 60 CO 0.73 -0.06 0.74 -0.62 0.98 0.00 0.00 173.24 175.02 2dhj n GLU 61 N 4.02 0.00 -0.08 4.02 1.02 -1.26 -4.73 120.64 123.63 2dhj n GLU 61 Ca -0.13 0.46 -0.13 0.00 -0.02 0.00 0.00 57.16 57.35 2dhj n GLU 61 Cb 0.56 -1.34 -0.04 0.00 -0.02 0.00 0.00 31.44 30.59 2dhj n GLU 61 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2dhj n GLU 62 N -1.88 0.44 -0.39 3.49 4.71 -1.26 -5.03 120.64 120.73 2dhj n GLU 62 Ca 0.00 0.18 -0.27 0.00 -0.01 0.00 0.00 57.16 57.06 2dhj n GLU 62 Cb 0.00 -1.26 0.24 0.00 -1.01 0.00 0.00 31.44 29.41 2dhj n GLU 62 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 2dhj n GLU 63 N -4.18 -3.51 -4.32 3.49 4.71 -1.26 -5.04 120.64 110.51 2dhj n GLU 63 Ca -0.22 -1.03 -0.23 0.00 -0.01 0.00 0.00 57.16 55.67 2dhj n GLU 63 Cb 0.54 -1.83 -0.12 0.00 -1.01 0.00 0.00 31.44 29.03 2dhj n GLU 63 CO 0.00 0.00 0.00 1.14 0.09 0.00 0.00 177.13 178.36 2dhj s GLN 64 N -4.38 1.24 0.38 3.49 -2.07 -1.26 -4.74 119.66 112.32 2dhj s GLN 64 Ca 0.59 -1.33 -0.26 0.00 -1.82 0.00 0.00 55.36 52.53 2dhj s GLN 64 Cb -0.13 -1.40 -0.09 0.00 -1.09 0.00 0.00 33.01 30.30 2dhj s GLN 64 CO 0.53 0.30 1.20 -1.25 -1.32 0.00 0.00 175.29 174.76 2dhj s PRO 65 N -2.48 4.16 -0.28 9.60 0.04 -1.26 -4.92 135.00 139.87 2dhj s PRO 65 Ca 0.13 1.94 -0.05 0.00 0.04 0.00 0.00 61.00 63.05 2dhj s PRO 65 Cb -0.07 -2.81 0.01 0.00 0.04 0.00 0.00 34.50 31.66 2dhj s PRO 65 CO 0.06 -0.26 0.04 0.42 0.04 0.00 0.00 177.00 177.30 2dhj s ILE 66 N -1.32 3.71 -0.44 0.56 1.01 -1.21 -4.93 121.20 118.58 2dhj s ILE 66 Ca 0.54 -0.71 -0.27 0.00 0.00 0.00 0.00 60.65 60.22 2dhj s ILE 66 Cb -0.33 -2.88 -0.05 0.00 0.01 0.00 0.00 42.46 39.21 2dhj s ILE 66 CO 0.43 0.15 2.16 -0.94 0.00 0.00 0.00 174.94 176.73 2dhj s SER 67 N 1.47 5.04 -0.21 3.58 1.04 -1.26 -2.46 113.70 120.91 2dhj s SER 67 Ca 0.03 1.11 0.07 0.00 0.48 0.00 0.00 55.95 57.63 2dhj s SER 67 Cb -0.17 -2.51 0.49 0.00 0.10 0.00 0.00 66.02 63.94 2dhj s SER 67 CO 0.01 -2.41 1.42 1.33 0.98 0.00 0.00 173.24 174.57 2dhj n VAL 68 N 7.69 2.04 -0.13 5.02 0.24 0.31 -4.50 118.33 129.00 2dhj n VAL 68 Ca 0.30 -1.04 -0.04 0.00 -2.04 0.00 0.00 64.34 61.52 2dhj n VAL 68 Cb 0.51 -0.47 0.03 0.00 -1.47 0.00 0.00 33.84 32.44 2dhj n VAL 68 CO 0.00 0.00 0.00 -1.13 -2.14 0.00 0.00 176.83 173.56 2dhj h ASN 69 N 1.84 -0.27 -2.09 -1.34 -1.24 -1.84 -3.27 115.58 107.38 2dhj h ASN 69 Ca 0.16 0.11 -0.55 0.00 0.71 0.00 0.00 56.30 56.73 2dhj h ASN 69 Cb 1.76 0.22 -0.40 0.00 0.73 0.00 0.00 38.32 40.62 2dhj h ASN 69 CO 0.48 -0.09 -0.94 0.00 -1.29 0.00 0.00 177.43 175.58 2dhj n ALA 70 N -2.66 3.04 -2.73 1.57 0.00 -1.26 -4.12 120.51 114.35 2dhj n ALA 70 Ca 0.03 -3.91 -0.31 0.00 0.00 0.00 0.00 53.44 49.26 2dhj n ALA 70 Cb 0.23 -0.85 -0.04 0.00 0.00 0.00 0.00 19.45 18.79 2dhj n ALA 70 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2dhj s LEU 72 N -2.72 4.92 0.13 0.00 2.96 -0.22 -4.91 118.68 118.83 2dhj s LEU 72 Ca 0.40 -1.47 -0.17 0.00 -0.22 0.00 0.00 54.13 52.66 2dhj s LEU 72 Cb -0.12 -1.93 -0.07 0.00 0.50 0.00 0.00 46.19 44.57 2dhj s LEU 72 CO 0.26 -0.48 0.58 -0.63 -1.32 0.00 0.00 176.35 174.76 2dhj s ILE 73 N 1.38 4.78 -0.30 6.68 1.01 -1.26 -2.28 121.20 131.21 2dhj s ILE 73 Ca 0.02 1.02 -0.09 0.00 0.00 0.00 0.00 60.65 61.61 2dhj s ILE 73 Cb -0.22 -3.81 0.15 0.00 0.01 0.00 0.00 42.46 38.59 2dhj s ILE 73 CO 0.01 0.36 0.69 -1.81 0.00 0.00 0.00 174.94 174.19 2dhj s ASP 74 N -1.48 -1.11 -0.85 3.58 1.01 0.66 -5.00 116.67 113.48 2dhj s ASP 74 Ca 0.35 1.32 -0.30 0.00 0.71 0.00 0.00 52.55 54.63 2dhj s ASP 74 Cb -0.17 2.18 -0.20 0.00 1.01 0.00 0.00 42.92 45.74 2dhj s ASP 74 CO 0.19 -0.21 2.39 -0.38 0.21 0.00 0.00 175.17 177.37 2dhj n ILE 75 N 5.39 0.00 -0.93 0.77 5.41 -1.26 -1.47 119.36 127.26 2dhj n ILE 75 Ca -0.09 0.00 -0.31 0.00 1.00 0.00 0.00 62.75 63.35 2dhj n ILE 75 Cb 0.50 -0.46 0.02 0.00 -0.71 0.00 0.00 39.64 38.99 2dhj n ILE 75 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 176.55 175.01 2dhj n SER 76 N 9.18 -3.81 -4.04 4.38 3.41 -1.21 -4.74 113.62 116.78 2dhj n SER 76 Ca 0.59 0.37 -0.37 0.00 -0.26 0.00 0.00 58.87 59.20 2dhj n SER 76 Cb 0.02 -0.66 0.05 0.00 -0.26 0.00 0.00 64.21 63.36 2dhj n SER 76 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2dhj n TYR 77 N -1.57 -3.48 -2.01 7.33 4.11 -1.26 -4.86 117.16 115.42 2dhj n TYR 77 Ca 0.03 0.23 -0.36 0.00 -0.00 0.00 0.00 57.90 57.80 2dhj n TYR 77 Cb 0.41 -1.45 0.03 0.00 -0.00 0.00 0.00 39.34 38.34 2dhj n TYR 77 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.86 177.31 2dhj n SER 78 N 2.91 6.75 -0.01 9.48 2.88 -1.26 -4.58 113.62 129.80 2dhj n SER 78 Ca -0.01 -3.80 -0.04 0.00 -1.33 0.00 0.00 58.87 53.68 2dhj n SER 78 Cb 0.63 -0.88 -0.01 0.00 -0.75 0.00 0.00 64.21 63.19 2dhj n SER 78 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 2dhj n GLU 79 N -0.57 0.17 -1.47 -1.46 1.02 -1.26 -5.04 120.64 112.04 2dhj n GLU 79 Ca 0.51 0.07 -0.45 0.00 -0.02 0.00 0.00 57.16 57.27 2dhj n GLU 79 Cb 0.40 -0.80 -0.01 0.00 -0.02 0.00 0.00 31.44 31.01 2dhj n GLU 79 CO 0.00 0.00 0.00 -2.37 1.18 0.00 0.00 177.13 175.94 2dhj n THR 80 N -3.71 1.86 -0.91 2.62 5.66 -1.26 -4.76 114.28 113.79 2dhj n THR 80 Ca -0.07 -0.50 -0.11 0.00 -3.05 0.00 0.00 64.05 60.31 2dhj n THR 80 Cb 0.27 -0.46 -0.15 0.00 -1.55 0.00 0.00 70.33 68.44 2dhj n THR 80 CO 0.00 0.00 0.00 1.17 -3.05 0.00 0.00 175.07 173.19 2dhj n LYS 81 N 0.83 1.85 -3.93 1.09 0.00 -1.26 -4.78 118.16 111.95 2dhj n LYS 81 Ca 0.13 -0.93 -0.13 0.00 0.00 0.00 0.00 58.31 57.37 2dhj n LYS 81 Cb 0.32 -1.97 -0.14 0.00 0.00 0.00 0.00 35.03 33.23 2dhj n LYS 81 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.40 178.43 2dhj s ARG 82 N 1.23 0.12 0.15 1.64 0.52 -1.26 -5.16 118.95 116.19 2dhj s ARG 82 Ca 0.61 -0.02 0.06 0.00 -0.52 0.00 0.00 55.73 55.86 2dhj s ARG 82 Cb 0.29 -0.15 -0.04 0.00 0.52 0.00 0.00 34.95 35.56 2dhj s ARG 82 CO -0.00 0.00 0.02 0.15 0.02 0.00 0.00 175.30 175.49 2dhj s LYS 83 N 0.13 2.52 -0.56 3.54 1.02 -1.26 -4.63 119.74 120.49 2dhj s LYS 83 Ca -0.01 -1.01 -0.03 0.00 0.02 0.00 0.00 55.97 54.94 2dhj s LYS 83 Cb -0.02 -2.45 0.00 0.00 -0.52 0.00 0.00 37.83 34.84 2dhj s LYS 83 CO -0.00 0.48 0.49 0.09 -0.92 0.00 0.00 175.35 175.48 2dhj n ASN 84 N 0.00 -3.58 -4.21 2.83 4.13 -1.26 -4.53 115.26 108.65 2dhj n ASN 84 Ca -0.10 -0.23 -0.31 0.00 1.68 0.00 0.00 54.58 55.62 2dhj n ASN 84 Cb 0.54 -2.41 -0.17 0.00 -1.54 0.00 0.00 39.78 36.21 2dhj n ASN 84 CO 0.00 0.00 0.00 -0.69 0.28 0.00 0.00 177.26 176.85 2dhj s VAL 85 N -3.14 1.96 -0.01 2.41 1.01 -1.26 0.69 120.40 122.06 2dhj s VAL 85 Ca 0.21 -0.97 0.06 0.00 0.00 0.00 0.00 61.98 61.28 2dhj s VAL 85 Cb -0.09 -1.69 -0.02 0.00 0.00 0.00 0.00 36.38 34.58 2dhj s VAL 85 CO 0.31 0.54 -0.20 0.72 0.00 0.00 0.00 175.10 176.46 2dhj s PHE 86 N 0.28 1.83 -0.08 5.22 -0.71 0.11 -3.32 117.98 121.31 2dhj s PHE 86 Ca -0.16 -0.35 -0.17 0.00 -1.04 0.00 0.00 56.93 55.22 2dhj s PHE 86 Cb -0.17 -1.16 -0.05 0.00 -1.21 0.00 0.00 43.02 40.43 2dhj s PHE 86 CO 0.07 -0.01 0.43 0.50 -1.34 0.00 0.00 175.22 174.88 2dhj s ARG 87 N -0.60 4.19 -0.03 1.99 3.52 -0.54 -1.12 118.95 126.37 2dhj s ARG 87 Ca 0.08 0.40 0.05 0.00 -0.13 0.00 0.00 55.73 56.13 2dhj s ARG 87 Cb -0.08 -3.36 -0.01 0.00 -1.56 0.00 0.00 34.95 29.94 2dhj s ARG 87 CO -0.00 0.35 -0.17 -1.17 -0.81 0.00 0.00 175.30 173.50 2dhj s LEU 88 N 0.01 1.96 -0.12 -0.88 0.20 0.05 -0.25 118.68 119.64 2dhj s LEU 88 Ca 0.24 -0.34 0.01 0.00 0.69 0.00 0.00 54.13 54.73 2dhj s LEU 88 Cb -0.15 -0.94 0.02 0.00 -0.43 0.00 0.00 46.19 44.68 2dhj s LEU 88 CO 0.11 0.18 -0.14 -0.89 -0.29 0.00 0.00 176.35 175.31 2dhj s THR 89 N -0.13 1.50 0.02 3.68 2.01 -0.96 -0.97 115.64 120.78 2dhj s THR 89 Ca 0.00 -0.62 0.04 0.00 0.31 0.00 0.00 61.69 61.43 2dhj s THR 89 Cb -0.10 -1.39 -0.03 0.00 0.01 0.00 0.00 72.50 70.99 2dhj s THR 89 CO 0.01 0.44 -0.10 0.42 -0.69 0.00 0.00 174.62 174.70 2dhj s THR 90 N 1.23 3.39 0.41 -0.82 -4.23 0.04 -1.06 115.64 114.60 2dhj s THR 90 Ca -0.01 -0.90 0.31 0.00 -1.18 0.00 0.00 61.69 59.91 2dhj s THR 90 Cb -0.14 -2.46 0.48 0.00 1.34 0.00 0.00 72.50 71.72 2dhj s THR 90 CO -0.06 0.37 1.39 -0.24 -0.54 0.00 0.00 174.62 175.55 2dhj n SER 91 N 1.54 0.16 0.02 3.99 2.88 -1.26 -1.01 113.62 119.94 2dhj n SER 91 Ca -0.15 1.19 -0.01 0.00 -1.33 0.00 0.00 58.87 58.57 2dhj n SER 91 Cb 0.52 -0.59 -0.00 0.00 -0.75 0.00 0.00 64.21 63.39 2dhj n SER 91 CO 0.00 0.00 0.00 0.44 -1.23 0.00 0.00 175.04 174.25 2dhj h ASP 92 N 0.00 -0.04 -5.53 -3.46 3.32 -1.94 -3.49 116.42 105.28 2dhj h ASP 92 Ca 0.79 0.00 -0.27 0.00 0.02 0.00 0.00 57.03 57.58 2dhj h ASP 92 Cb 2.65 0.01 -0.09 0.00 0.22 0.00 0.00 39.33 42.12 2dhj h ASP 92 CO -0.36 -0.01 -0.24 0.00 -1.72 0.00 0.00 179.24 176.92 2dhj s GLU 94 N -3.26 2.78 0.10 0.00 2.12 -1.26 -0.78 118.70 118.40 2dhj s GLU 94 Ca 0.31 -0.89 -0.26 0.00 0.36 0.00 0.00 54.97 54.50 2dhj s GLU 94 Cb 0.00 -2.59 0.08 0.00 0.26 0.00 0.00 34.13 31.88 2dhj s GLU 94 CO 0.19 0.49 0.78 0.00 -0.54 0.00 0.00 175.26 176.19 2dhj s LEU 96 N -2.68 3.19 -0.16 0.00 1.43 -0.04 -0.77 118.68 119.66 2dhj s LEU 96 Ca 0.05 -0.98 -0.12 0.00 -1.03 0.00 0.00 54.13 52.05 2dhj s LEU 96 Cb -0.02 -1.61 0.05 0.00 0.03 0.00 0.00 46.19 44.64 2dhj s LEU 96 CO -0.07 -0.56 0.40 -0.36 0.23 0.00 0.00 176.35 175.99 2dhj s PHE 97 N -2.56 -0.50 0.21 0.29 0.08 -0.27 -2.93 117.98 112.30 2dhj s PHE 97 Ca 0.43 1.16 0.10 0.00 0.12 0.00 0.00 56.93 58.74 2dhj s PHE 97 Cb 0.02 0.19 -0.04 0.00 -0.57 0.00 0.00 43.02 42.62 2dhj s PHE 97 CO 0.24 -0.26 -0.15 -1.14 -0.10 0.00 0.00 175.22 173.80 2dhj s GLN 98 N 0.68 1.84 0.39 0.44 0.74 -1.17 0.08 119.66 122.67 2dhj s GLN 98 Ca -0.04 -1.46 0.02 0.00 0.05 0.00 0.00 55.36 53.93 2dhj s GLN 98 Cb -0.05 -1.99 -0.01 0.00 1.10 0.00 0.00 33.01 32.07 2dhj s GLN 98 CO -0.05 0.40 0.07 0.00 -0.55 0.00 0.00 175.29 175.16 2dhj n ALA 99 N -0.11 0.44 -0.06 1.58 0.00 0.22 -3.39 120.51 119.20 2dhj n ALA 99 Ca -0.10 -1.89 -0.22 0.00 0.00 0.00 0.00 53.44 51.24 2dhj n ALA 99 Cb 0.57 1.16 -0.13 0.00 0.00 0.00 0.00 19.45 21.05 2dhj n ALA 99 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2dhj n GLU 100 N -0.94 0.68 -4.06 0.00 1.02 -1.26 -4.81 120.64 111.27 2dhj n GLU 100 Ca -0.11 0.33 -0.12 0.00 -0.02 0.00 0.00 57.16 57.24 2dhj n GLU 100 Cb 0.54 -1.67 -0.11 0.00 -0.02 0.00 0.00 31.44 30.18 2dhj n GLU 100 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2dhj s ASP 101 N -6.96 0.78 0.17 1.62 1.11 -1.26 -5.00 116.67 107.13 2dhj s ASP 101 Ca -0.27 -0.60 -0.28 0.00 0.18 0.00 0.00 52.55 51.57 2dhj s ASP 101 Cb 0.07 0.06 -0.00 0.00 1.07 0.00 0.00 42.92 44.12 2dhj s ASP 101 CO 0.67 -0.26 1.55 -0.09 1.18 0.00 0.00 175.17 178.22 2dhj h ARG 102 N 4.32 -0.10 -0.70 8.23 2.43 -1.94 0.13 114.38 126.76 2dhj h ARG 102 Ca -0.35 0.01 0.13 0.00 -0.81 0.00 0.00 59.98 58.96 2dhj h ARG 102 Cb 1.20 0.02 -0.13 0.00 -0.42 0.00 0.00 29.97 30.64 2dhj h ARG 102 CO 0.44 -0.06 -0.28 0.22 -1.51 0.00 0.00 179.97 178.78 2dhj h ASP 103 N -0.10 -0.99 -0.77 -3.80 3.58 -1.99 0.29 116.42 112.64 2dhj h ASP 103 Ca 0.18 0.24 0.06 0.00 0.42 0.00 0.00 57.03 57.92 2dhj h ASP 103 Cb 0.50 0.55 -0.06 0.00 1.72 0.00 0.00 39.33 42.04 2dhj h ASP 103 CO -0.85 -0.28 0.46 0.44 -2.88 0.00 0.00 179.24 176.13 2dhj h ASP 104 N -0.08 0.71 0.06 2.28 3.32 -1.24 -1.08 116.42 120.40 2dhj h ASP 104 Ca 0.30 0.02 -0.00 0.00 0.02 0.00 0.00 57.03 57.37 2dhj h ASP 104 Cb 0.56 -0.13 0.00 0.00 0.22 0.00 0.00 39.33 39.98 2dhj h ASP 104 CO -0.75 0.46 -0.03 -0.03 -1.72 0.00 0.00 179.24 177.17 2dhj h MET 105 N 0.85 -0.08 -0.73 3.56 4.05 0.11 -2.70 114.93 119.99 2dhj h MET 105 Ca 0.33 0.01 0.07 0.00 -0.28 0.00 0.00 59.70 59.83 2dhj h MET 105 Cb 0.16 0.02 -0.06 0.00 -0.80 0.00 0.00 31.60 30.92 2dhj h MET 105 CO -0.17 0.02 0.42 -0.07 0.23 0.00 0.00 176.91 177.33 2dhj h LEU 106 N -0.16 0.62 0.00 3.39 -0.00 -0.41 -2.78 115.31 115.98 2dhj h LEU 106 Ca -0.01 0.03 -0.00 0.00 -0.00 0.00 0.00 57.88 57.90 2dhj h LEU 106 Cb 0.13 -0.09 -0.00 0.00 -0.00 0.00 0.00 40.66 40.70 2dhj h LEU 106 CO 0.01 0.39 -0.01 0.00 -0.00 0.00 0.00 178.44 178.84 2dhj h ALA 107 N 1.38 -0.67 -0.91 1.53 0.00 -1.00 -2.44 119.26 117.15 2dhj h ALA 107 Ca 0.33 -0.00 0.11 0.00 0.00 0.00 0.00 54.91 55.35 2dhj h ALA 107 Cb 0.22 0.34 -0.13 0.00 0.00 0.00 0.00 17.79 18.23 2dhj h ALA 107 CO -0.20 -0.67 -0.44 0.91 0.00 0.00 0.00 179.25 178.85 2dhj n TRP 108 N -2.38 -0.18 -0.30 0.00 7.02 -1.04 -0.31 117.44 120.25 2dhj n TRP 108 Ca -0.00 1.14 -0.07 0.00 -1.02 0.00 0.00 57.50 57.54 2dhj n TRP 108 Cb 0.01 -0.71 -0.03 0.00 -2.42 0.00 0.00 31.31 28.15 2dhj n TRP 108 CO 0.00 0.00 0.00 0.82 -2.02 0.00 0.00 177.69 176.49 2dhj h ILE 109 N 0.00 0.04 0.68 -0.99 2.04 -1.35 0.91 117.51 118.84 2dhj h ILE 109 Ca 0.24 0.00 -0.03 0.00 1.00 0.00 0.00 64.86 66.07 2dhj h ILE 109 Cb 0.47 0.04 -0.01 0.00 -0.74 0.00 0.00 36.82 36.58 2dhj h ILE 109 CO -0.89 0.00 -0.50 0.50 0.00 0.00 0.00 178.15 177.26 2dhj h LYS 110 N -0.12 -1.09 -0.69 2.37 3.64 -0.17 0.20 116.57 120.70 2dhj h LYS 110 Ca 0.22 0.07 0.08 0.00 -1.27 0.00 0.00 60.65 59.75 2dhj h LYS 110 Cb 0.54 0.25 -0.10 0.00 -0.41 0.00 0.00 32.23 32.50 2dhj h LYS 110 CO -0.83 -0.73 -0.55 1.15 -2.27 0.00 0.00 179.45 176.23 2dhj h THR 111 N -1.13 0.01 0.34 1.00 2.02 -0.32 0.40 112.91 115.23 2dhj h THR 111 Ca -0.09 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.09 2dhj h THR 111 Cb 0.94 0.01 -0.01 0.00 -1.74 0.00 0.00 68.15 67.35 2dhj h THR 111 CO 0.03 0.00 -0.27 0.40 0.37 0.00 0.00 175.52 176.06 2dhj h ILE 112 N -0.20 0.44 -1.00 3.11 2.04 -0.77 -0.52 117.51 120.62 2dhj h ILE 112 Ca 0.14 0.00 0.25 0.00 1.00 0.00 0.00 64.86 66.25 2dhj h ILE 112 Cb 0.52 0.44 -0.07 0.00 -0.74 0.00 0.00 36.82 36.96 2dhj h ILE 112 CO -0.76 0.00 0.66 1.56 0.00 0.00 0.00 178.15 179.61 2dhj h GLN 113 N -0.61 0.30 -0.01 2.37 4.20 0.34 0.64 115.11 122.33 2dhj h GLN 113 Ca -0.03 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.65 2dhj h GLN 113 Cb 0.53 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 28.25 2dhj h GLN 113 CO -0.01 0.20 -0.05 0.93 -0.67 0.00 0.00 178.83 179.23 2dhj h GLU 114 N 0.31 0.05 -0.81 1.46 4.39 0.50 -0.78 114.58 119.70 2dhj h GLU 114 Ca 0.53 -0.04 0.04 0.00 0.34 0.00 0.00 59.36 60.23 2dhj h GLU 114 Cb 1.51 0.01 -0.05 0.00 -0.10 0.00 0.00 28.75 30.12 2dhj h GLU 114 CO -0.19 0.69 0.53 0.77 -1.16 0.00 0.00 179.01 179.65 2dhj h SER 115 N -0.56 0.84 -0.00 1.42 0.02 0.41 -2.82 113.55 112.85 2dhj h SER 115 Ca -0.00 -0.01 -0.01 0.00 -0.84 0.00 0.00 61.79 60.93 2dhj h SER 115 Cb 0.69 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 63.04 2dhj h SER 115 CO 0.01 0.57 -0.03 0.77 -1.14 0.00 0.00 176.83 177.01 2dhj h SER 116 N 0.97 0.04 -1.93 3.07 4.64 -0.98 -3.46 113.55 115.89 2dhj h SER 116 Ca 0.33 -0.70 -0.35 0.00 -0.47 0.00 0.00 61.79 60.61 2dhj h SER 116 Cb 0.10 -0.01 0.19 0.00 -0.31 0.00 0.00 62.40 62.36 2dhj h SER 116 CO -0.10 0.72 -0.96 -3.20 -0.87 0.00 0.00 176.83 172.42 2dhj n ASN 117 N -4.72 -2.72 -4.92 4.97 5.15 -0.30 -4.54 115.26 108.18 2dhj n ASN 117 Ca -0.09 -0.22 -0.27 0.00 -0.60 0.00 0.00 54.58 53.40 2dhj n ASN 117 Cb 0.36 -0.80 0.02 0.00 -0.53 0.00 0.00 39.78 38.84 2dhj n ASN 117 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 2dhj s LEU 118 N 0.89 3.34 -0.80 1.20 1.43 -1.26 -4.97 118.68 118.52 2dhj s LEU 118 Ca 0.43 0.75 -0.10 0.00 -1.03 0.00 0.00 54.13 54.19 2dhj s LEU 118 Cb -0.06 -3.62 0.21 0.00 0.03 0.00 0.00 46.19 42.76 2dhj s LEU 118 CO 0.50 -0.93 0.70 0.54 0.23 0.00 0.00 176.35 177.39 2dhj s ASN 119 N -4.25 6.30 -0.29 2.29 2.20 -1.26 -4.97 114.94 114.95 2dhj s ASN 119 Ca 0.52 -2.88 -0.16 0.00 -0.94 0.00 0.00 52.86 49.40 2dhj s ASN 119 Cb -0.10 -2.08 0.17 0.00 -2.00 0.00 0.00 41.25 37.23 2dhj s ASN 119 CO 0.45 -0.46 1.08 -0.55 -2.94 0.00 0.00 177.10 174.67 2dhj s SER 120 N 1.50 -0.36 0.00 3.54 0.15 -1.26 -5.12 113.70 112.15 2dhj s SER 120 Ca 0.19 0.56 0.00 0.00 0.70 0.00 0.00 55.95 57.41 2dhj s SER 120 Cb -0.13 1.18 0.00 0.00 -1.71 0.00 0.00 66.02 65.37 2dhj s SER 120 CO -0.07 -0.09 0.01 0.61 1.20 0.00 0.00 173.24 174.90 2dhj n GLY 121 N 3.65 -2.31 3.77 9.45 0.00 -1.26 -4.79 105.19 113.70 2dhj n GLY 121 Ca -0.17 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.50 2dhj n GLY 121 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dhj s PRO 122 N -0.02 3.41 -0.18 1.61 0.04 -1.26 -4.98 135.00 133.63 2dhj s PRO 122 Ca 0.00 1.64 -0.29 0.00 0.04 0.00 0.00 61.00 62.39 2dhj s PRO 122 Cb 0.00 -2.06 -0.01 0.00 0.04 0.00 0.00 34.50 32.47 2dhj s PRO 122 CO 0.00 -0.81 1.20 -1.54 0.04 0.00 0.00 177.00 175.89 2dhj s SER 123 N -1.71 6.99 0.21 6.66 1.04 -1.26 -5.03 113.70 120.61 2dhj s SER 123 Ca 0.71 1.61 0.07 0.00 0.48 0.00 0.00 55.95 58.82 2dhj s SER 123 Cb -0.25 -2.54 -0.04 0.00 0.10 0.00 0.00 66.02 63.30 2dhj s SER 123 CO 0.28 -0.73 0.09 -0.44 0.98 0.00 0.00 173.24 173.42 2dhj s SER 124 N 1.75 5.15 0.00 7.02 0.01 -1.26 -5.27 113.70 121.11 2dhj s SER 124 Ca 0.52 -0.33 0.00 0.00 1.31 0.00 0.00 55.95 57.45 2dhj s SER 124 Cb -0.20 -1.21 0.00 0.00 0.21 0.00 0.00 66.02 64.82 2dhj s SER 124 CO 0.12 0.03 0.00 0.61 0.41 0.00 0.00 173.24 174.41