#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wbj n PHE 2 N 0.00 0.00 -1.59 -0.67 0.99 -1.26 -4.97 117.46 109.97 2wbj n PHE 2 Ca 0.00 0.00 -0.49 0.00 -0.00 0.00 0.00 57.45 56.96 2wbj n PHE 2 Cb 0.00 0.00 -0.04 0.00 -1.00 0.00 0.00 39.48 38.44 2wbj n PHE 2 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2wbj n ALA 3 N -1.93 -0.67 -2.85 4.37 0.00 -1.26 -4.94 120.51 113.23 2wbj n ALA 3 Ca 0.00 0.47 -0.34 0.00 0.00 0.00 0.00 53.44 53.56 2wbj n ALA 3 Cb 0.00 -2.05 -0.11 0.00 0.00 0.00 0.00 19.45 17.29 2wbj n ALA 3 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2wbj s ARG 4 N -0.28 3.67 -0.09 0.00 1.81 -1.26 -5.07 118.95 117.73 2wbj s ARG 4 Ca 0.74 -0.43 -0.29 0.00 -1.72 0.00 0.00 55.73 54.03 2wbj s ARG 4 Cb -0.85 -3.01 -0.05 0.00 -0.45 0.00 0.00 34.95 30.59 2wbj s ARG 4 CO 0.51 0.34 1.66 0.08 -0.68 0.00 0.00 175.30 177.22 2wbj s VAL 5 N 0.13 3.59 0.53 3.52 1.01 -1.26 -5.03 120.40 122.89 2wbj s VAL 5 Ca 0.02 0.70 -0.17 0.00 0.00 0.00 0.00 61.98 62.54 2wbj s VAL 5 Cb -0.13 -3.49 -0.07 0.00 0.00 0.00 0.00 36.38 32.69 2wbj s VAL 5 CO 0.02 -0.10 1.00 -1.00 0.00 0.00 0.00 175.10 175.02 2wbj s HIS 6 N 4.34 3.34 0.14 5.22 3.76 -1.26 -5.07 115.29 125.76 2wbj s HIS 6 Ca 0.74 1.48 0.10 0.00 -0.15 0.00 0.00 55.06 57.23 2wbj s HIS 6 Cb -0.32 -2.85 -0.04 0.00 1.11 0.00 0.00 32.58 30.49 2wbj s HIS 6 CO 0.29 -0.53 -0.24 -0.59 -0.85 0.00 0.00 174.74 172.83 2wbj s PHE 7 N -2.56 2.11 -0.09 1.40 -0.12 -1.26 -4.92 117.98 112.54 2wbj s PHE 7 Ca 0.60 -0.40 -0.30 0.00 -0.05 0.00 0.00 56.93 56.79 2wbj s PHE 7 Cb -0.11 -1.11 -0.02 0.00 -0.63 0.00 0.00 43.02 41.14 2wbj s PHE 7 CO 0.31 0.33 1.09 0.42 -0.05 0.00 0.00 175.22 177.33 2wbj s ILE 8 N -1.31 4.55 0.15 -4.49 -1.09 -1.26 -0.39 121.20 117.35 2wbj s ILE 8 Ca 0.13 1.84 -0.31 0.00 -2.23 0.00 0.00 60.65 60.09 2wbj s ILE 8 Cb -0.09 -4.18 -0.08 0.00 -1.58 0.00 0.00 42.46 36.52 2wbj s ILE 8 CO 0.06 -0.00 1.36 -0.94 -1.23 0.00 0.00 174.94 174.19 2wbj s SER 9 N 1.27 6.85 0.14 3.58 1.04 -1.26 -4.96 113.70 120.37 2wbj s SER 9 Ca 0.51 2.36 -0.31 0.00 0.48 0.00 0.00 55.95 58.99 2wbj s SER 9 Cb -0.21 -2.60 -0.10 0.00 0.10 0.00 0.00 66.02 63.22 2wbj s SER 9 CO 0.19 -0.61 1.59 0.00 0.98 0.00 0.00 173.24 175.39 2wbj s ALA 10 N 0.71 3.76 0.43 5.32 0.00 -1.26 -5.00 121.76 125.71 2wbj s ALA 10 Ca 0.61 1.34 -0.21 0.00 0.00 0.00 0.00 51.96 53.70 2wbj s ALA 10 Cb -0.37 -3.64 -0.11 0.00 0.00 0.00 0.00 23.12 19.01 2wbj s ALA 10 CO 0.33 -0.85 0.95 -0.51 0.00 0.00 0.00 175.76 175.69 2wbj s LEU 11 N 1.47 3.95 0.15 0.00 1.43 -1.26 -5.05 118.68 119.37 2wbj s LEU 11 Ca 0.71 1.70 -0.29 0.00 -1.03 0.00 0.00 54.13 55.22 2wbj s LEU 11 Cb -0.43 -4.52 -0.07 0.00 0.03 0.00 0.00 46.19 41.20 2wbj s LEU 11 CO 0.31 -0.35 0.91 -1.00 0.23 0.00 0.00 176.35 176.45 2wbj s HIS 12 N -2.16 3.87 1.20 0.29 3.76 -1.26 -5.07 115.29 115.92 2wbj s HIS 12 Ca 0.62 1.78 -0.19 0.00 -0.15 0.00 0.00 55.06 57.11 2wbj s HIS 12 Cb -0.09 -2.96 0.29 0.00 1.11 0.00 0.00 32.58 30.92 2wbj s HIS 12 CO 0.13 0.34 1.13 0.20 -0.85 0.00 0.00 174.74 175.69 2wbj s GLY 13 N -0.54 1.60 -0.39 -2.22 0.00 -1.26 -4.85 107.32 99.66 2wbj s GLY 13 Ca 0.42 -1.01 -0.29 0.00 0.00 0.00 0.00 44.72 43.84 2wbj s GLY 13 CO 0.29 -0.12 1.49 -0.45 0.00 0.00 0.00 173.10 174.32 2wbj s SER 14 N -4.01 6.25 0.00 1.64 0.15 -1.26 -1.35 113.70 115.12 2wbj s SER 14 Ca 0.72 0.94 0.00 0.00 0.70 0.00 0.00 55.95 58.31 2wbj s SER 14 Cb -0.08 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 61.69 2wbj s SER 14 CO 0.56 -1.48 0.00 0.61 1.20 0.00 0.00 173.24 174.12 2wbj n GLY 15 N 5.13 1.48 3.19 9.45 0.00 -1.26 -5.36 105.19 117.81 2wbj n GLY 15 Ca 0.18 -0.20 -0.11 0.00 0.00 0.00 0.00 46.02 45.89 2wbj n GLY 15 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2wbj s GLY 16 N -2.21 0.84 0.00 -0.02 0.00 -0.45 -5.22 107.32 100.26 2wbj s GLY 16 Ca 0.00 -1.39 0.00 0.00 0.00 0.00 0.00 44.72 43.33 2wbj s GLY 16 CO 0.00 -1.48 0.00 -0.62 0.00 0.00 0.00 173.10 171.00 2wbj n VAL 25 N -0.08 0.00 -4.78 1.40 0.31 -1.26 -4.95 118.33 108.98 2wbj n VAL 25 Ca -0.12 0.00 -0.32 0.00 -0.01 0.00 0.00 64.34 63.89 2wbj n VAL 25 Cb 0.61 0.00 -0.13 0.00 -0.91 0.00 0.00 33.84 33.41 2wbj n VAL 25 CO 0.00 0.00 0.00 0.68 -1.32 0.00 0.00 176.83 176.19 2wbj s VAL 26 N -0.60 3.12 -0.05 2.52 -7.23 -1.26 -2.13 120.40 114.78 2wbj s VAL 26 Ca 0.00 -0.81 0.04 0.00 -1.81 0.00 0.00 61.98 59.41 2wbj s VAL 26 Cb 0.00 -2.26 -0.02 0.00 0.56 0.00 0.00 36.38 34.65 2wbj s VAL 26 CO 0.00 0.52 -0.16 -0.94 -0.31 0.00 0.00 175.10 174.20 2wbj s SER 27 N -0.97 3.84 -0.16 4.85 1.04 0.07 -4.39 113.70 117.98 2wbj s SER 27 Ca 0.13 -0.26 0.02 0.00 0.48 0.00 0.00 55.95 56.32 2wbj s SER 27 Cb -0.11 -0.81 0.01 0.00 0.10 0.00 0.00 66.02 65.22 2wbj s SER 27 CO 0.02 0.33 -0.21 -1.58 0.98 0.00 0.00 173.24 172.78 2wbj s GLN 28 N -0.63 3.02 -0.02 4.02 0.74 -1.26 -1.28 119.66 124.24 2wbj s GLN 28 Ca 0.09 -0.84 0.00 0.00 0.05 0.00 0.00 55.36 54.67 2wbj s GLN 28 Cb -0.11 -2.50 0.03 0.00 1.10 0.00 0.00 33.01 31.53 2wbj s GLN 28 CO 0.01 -0.09 0.02 -1.01 -0.55 0.00 0.00 175.29 173.66 2wbj s HIS 29 N 1.01 0.11 0.50 1.67 3.76 -0.80 -4.20 115.29 117.34 2wbj s HIS 29 Ca -0.02 0.08 -0.05 0.00 -0.15 0.00 0.00 55.06 54.92 2wbj s HIS 29 Cb -0.15 -0.27 -0.03 0.00 1.11 0.00 0.00 32.58 33.25 2wbj s HIS 29 CO -0.06 -0.09 0.79 -1.25 -0.85 0.00 0.00 174.74 173.28 2wbj s PRO 30 N 0.99 3.39 0.04 8.40 0.04 -1.26 -0.96 135.00 145.62 2wbj s PRO 30 Ca -0.09 0.10 -0.18 0.00 0.04 0.00 0.00 61.00 60.88 2wbj s PRO 30 Cb -0.12 -2.37 -0.21 0.00 0.04 0.00 0.00 34.50 31.84 2wbj s PRO 30 CO -0.02 -0.30 1.18 0.77 0.04 0.00 0.00 177.00 178.67 2wbj h SER 31 N 0.17 0.64 -4.29 6.66 0.02 -1.80 -3.41 113.55 111.53 2wbj h SER 31 Ca -0.47 -0.70 -0.52 0.00 -0.84 0.00 0.00 61.79 59.27 2wbj h SER 31 Cb 1.22 -0.19 -0.26 0.00 0.14 0.00 0.00 62.40 63.31 2wbj h SER 31 CO 0.61 1.24 -0.82 0.26 -1.14 0.00 0.00 176.83 176.98 2wbj s TRP 32 N -3.46 1.52 -0.00 3.45 0.52 -1.26 -0.82 118.94 118.89 2wbj s TRP 32 Ca -0.12 -0.35 0.03 0.00 0.02 0.00 0.00 56.10 55.68 2wbj s TRP 32 Cb 0.05 -0.92 -0.01 0.00 -1.15 0.00 0.00 33.47 31.44 2wbj s TRP 32 CO 0.84 0.05 -0.11 0.08 0.02 0.00 0.00 176.95 177.83 2wbj s VAL 33 N -0.73 0.86 -0.13 4.03 1.01 -1.12 -4.96 120.40 119.35 2wbj s VAL 33 Ca 0.05 -0.51 -0.01 0.00 0.00 0.00 0.00 61.98 61.51 2wbj s VAL 33 Cb -0.08 -0.73 0.03 0.00 0.00 0.00 0.00 36.38 35.61 2wbj s VAL 33 CO 0.01 0.21 -0.05 -0.63 0.00 0.00 0.00 175.10 174.64 2wbj s ILE 34 N -0.32 0.96 0.06 2.22 1.09 -1.26 -2.02 121.20 121.93 2wbj s ILE 34 Ca 0.04 -0.39 0.08 0.00 -1.10 0.00 0.00 60.65 59.28 2wbj s ILE 34 Cb -0.05 -1.08 -0.03 0.00 -1.06 0.00 0.00 42.46 40.25 2wbj s ILE 34 CO -0.00 0.23 -0.21 -0.55 -0.10 0.00 0.00 174.94 174.31 2wbj s SER 35 N 1.72 2.55 0.25 3.58 0.15 -1.18 -4.99 113.70 115.78 2wbj s SER 35 Ca 0.03 -0.58 -0.30 0.00 0.70 0.00 0.00 55.95 55.80 2wbj s SER 35 Cb -0.14 -0.19 -0.09 0.00 -1.71 0.00 0.00 66.02 63.89 2wbj s SER 35 CO -0.08 0.14 1.20 -0.75 1.20 0.00 0.00 173.24 174.95 2wbj s LYS 36 N -1.42 4.50 0.06 5.44 2.20 -1.26 -1.84 119.74 127.42 2wbj s LYS 36 Ca 0.08 1.95 -0.30 0.00 -0.36 0.00 0.00 55.97 57.33 2wbj s LYS 36 Cb -0.09 -3.18 -0.09 0.00 -1.51 0.00 0.00 37.83 32.96 2wbj s LYS 36 CO 0.03 -0.02 1.80 -1.54 -0.36 0.00 0.00 175.35 175.26 2wbj s SER 37 N -0.36 6.51 0.00 1.43 1.04 -0.47 -1.89 113.70 119.97 2wbj s SER 37 Ca 0.49 2.59 0.00 0.00 0.48 0.00 0.00 55.95 59.51 2wbj s SER 37 Cb -0.34 -2.55 0.00 0.00 0.10 0.00 0.00 66.02 63.23 2wbj s SER 37 CO 0.42 -0.98 0.00 0.61 0.98 0.00 0.00 173.24 174.27 2wbj n GLY 38 N 4.26 2.05 3.92 7.32 0.00 -0.35 -4.99 105.19 117.39 2wbj n GLY 38 Ca 0.18 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.91 2wbj n GLY 38 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2wbj s THR 39 N -2.10 5.23 0.41 2.61 -4.23 -0.79 -4.84 115.64 111.93 2wbj s THR 39 Ca 0.00 -0.30 -0.23 0.00 -1.18 0.00 0.00 61.69 59.99 2wbj s THR 39 Cb 0.00 -3.69 -0.10 0.00 1.34 0.00 0.00 72.50 70.05 2wbj s THR 39 CO 0.00 -0.08 1.00 -0.94 -0.54 0.00 0.00 174.62 174.06 2wbj s SER 40 N -2.91 6.82 -0.08 3.99 1.04 -1.24 -4.25 113.70 117.07 2wbj s SER 40 Ca 0.38 1.87 0.04 0.00 0.48 0.00 0.00 55.95 58.72 2wbj s SER 40 Cb -0.12 -2.56 0.00 0.00 0.10 0.00 0.00 66.02 63.44 2wbj s SER 40 CO 0.28 -0.44 -0.20 -0.69 0.98 0.00 0.00 173.24 173.17 2wbj s VAL 41 N -1.88 1.73 -0.15 5.02 1.01 -0.75 -5.00 120.40 120.38 2wbj s VAL 41 Ca 0.60 -0.83 0.02 0.00 0.00 0.00 0.00 61.98 61.77 2wbj s VAL 41 Cb -0.16 -1.51 0.01 0.00 0.00 0.00 0.00 36.38 34.72 2wbj s VAL 41 CO 0.21 0.49 -0.21 -0.75 0.00 0.00 0.00 175.10 174.83 2wbj s LYS 42 N 0.41 3.02 -0.10 2.72 2.20 -1.26 -0.26 119.74 126.48 2wbj s LYS 42 Ca -0.16 -0.85 0.04 0.00 -0.36 0.00 0.00 55.97 54.64 2wbj s LYS 42 Cb -0.17 -2.47 0.00 0.00 -1.51 0.00 0.00 37.83 33.68 2wbj s LYS 42 CO 0.07 -0.06 -0.23 0.42 -0.36 0.00 0.00 175.35 175.19 2wbj s ILE 43 N 0.92 1.97 -0.14 5.43 1.01 0.98 -4.53 121.20 126.85 2wbj s ILE 43 Ca -0.04 -0.97 -0.06 0.00 0.00 0.00 0.00 60.65 59.58 2wbj s ILE 43 Cb -0.15 -1.71 -0.04 0.00 0.01 0.00 0.00 42.46 40.57 2wbj s ILE 43 CO -0.04 0.54 0.08 -1.61 0.00 0.00 0.00 174.94 173.90 2wbj s GLU 44 N 0.37 3.60 -0.21 2.79 2.02 -0.14 -0.93 118.70 126.20 2wbj s GLU 44 Ca -0.18 -0.28 0.01 0.00 0.02 0.00 0.00 54.97 54.54 2wbj s GLU 44 Cb -0.18 -3.12 0.04 0.00 0.10 0.00 0.00 34.13 30.97 2wbj s GLU 44 CO 0.08 0.53 -0.13 0.00 0.02 0.00 0.00 175.26 175.77 2wbj s ARG 46 N 1.30 2.90 -0.12 0.00 0.52 -0.40 -1.10 118.95 122.05 2wbj s ARG 46 Ca -0.01 -0.79 -0.15 0.00 -0.52 0.00 0.00 55.73 54.26 2wbj s ARG 46 Cb -0.16 -2.38 -0.05 0.00 0.52 0.00 0.00 34.95 32.88 2wbj s ARG 46 CO -0.09 0.34 0.37 -1.54 0.02 0.00 0.00 175.30 174.40 2wbj s SER 47 N -0.03 6.58 -0.24 0.23 1.04 0.01 -0.75 113.70 120.54 2wbj s SER 47 Ca -0.05 0.68 -0.12 0.00 0.48 0.00 0.00 55.95 56.94 2wbj s SER 47 Cb -0.15 -2.22 -0.10 0.00 0.10 0.00 0.00 66.02 63.65 2wbj s SER 47 CO 0.05 0.12 -0.31 0.18 0.98 0.00 0.00 173.24 174.26 2wbj n LEU 48 N 3.24 1.73 -0.52 2.42 4.77 -0.90 -4.63 117.00 123.11 2wbj n LEU 48 Ca -0.11 0.28 0.10 0.00 -0.03 0.00 0.00 56.01 56.25 2wbj n LEU 48 Cb 0.52 -0.71 0.01 0.00 -2.33 0.00 0.00 43.42 40.91 2wbj n LEU 48 CO 0.40 0.51 0.34 -0.90 -1.33 0.00 0.00 177.39 176.41 2wbj n ASP 49 N -4.04 2.04 -3.03 -1.43 5.68 -1.26 -5.01 116.55 109.50 2wbj n ASP 49 Ca -0.47 -1.52 -0.18 0.00 -0.50 0.00 0.00 54.79 52.12 2wbj n ASP 49 Cb 0.84 0.40 -0.07 0.00 -1.14 0.00 0.00 41.12 41.15 2wbj n ASP 49 CO 0.00 0.00 0.00 2.22 -1.33 0.00 0.00 177.20 178.09 2wbj n PHE 50 N 0.15 -0.68 -5.18 2.11 1.16 -1.26 -5.00 117.46 108.75 2wbj n PHE 50 Ca 0.09 -2.52 -0.32 0.00 -1.87 0.00 0.00 57.45 52.83 2wbj n PHE 50 Cb 0.44 0.25 -0.16 0.00 -1.61 0.00 0.00 39.48 38.40 2wbj n PHE 50 CO 0.00 0.00 0.00 -0.65 -1.87 0.00 0.00 176.76 174.24 2wbj s GLN 51 N -3.23 2.77 -0.16 3.97 -0.21 -1.26 -4.77 119.66 116.78 2wbj s GLN 51 Ca 0.35 -0.86 -0.00 0.00 0.02 0.00 0.00 55.36 54.87 2wbj s GLN 51 Cb 0.02 -2.26 -0.00 0.00 1.00 0.00 0.00 33.01 31.76 2wbj s GLN 51 CO 0.25 0.32 -0.14 0.00 -2.12 0.00 0.00 175.29 173.60 2wbj s ALA 52 N -0.01 2.54 -0.28 6.09 0.00 -0.99 -2.47 121.76 126.65 2wbj s ALA 52 Ca -0.08 -1.03 0.26 0.00 0.00 0.00 0.00 51.96 51.11 2wbj s ALA 52 Cb -0.15 -1.27 0.65 0.00 0.00 0.00 0.00 23.12 22.36 2wbj s ALA 52 CO 0.05 -0.03 1.72 0.00 0.00 0.00 0.00 175.76 177.51 2wbj h THR 53 N 5.63 0.00 -2.38 0.00 1.03 -1.84 -3.38 112.91 111.96 2wbj h THR 53 Ca -0.33 -0.85 -0.06 0.00 -0.01 0.00 0.00 66.41 65.17 2wbj h THR 53 Cb 1.19 1.85 -0.24 0.00 -1.07 0.00 0.00 68.15 69.87 2wbj h THR 53 CO 0.57 0.00 -0.18 -0.89 -0.01 0.00 0.00 175.52 175.01 2wbj s THR 54 N -3.35 -0.10 0.24 0.00 2.01 -1.26 -1.95 115.64 111.23 2wbj s THR 54 Ca 0.05 0.06 0.08 0.00 0.31 0.00 0.00 61.69 62.19 2wbj s THR 54 Cb 0.06 -0.77 -0.05 0.00 0.01 0.00 0.00 72.50 71.75 2wbj s THR 54 CO 0.63 0.03 -0.12 -0.04 -0.69 0.00 0.00 174.62 174.42 2wbj s MET 55 N 1.64 1.45 -0.04 4.92 -1.94 -0.35 -2.64 119.30 122.34 2wbj s MET 55 Ca -0.09 -1.68 0.02 0.00 -1.71 0.00 0.00 55.69 52.23 2wbj s MET 55 Cb -0.08 -1.23 0.01 0.00 2.01 0.00 0.00 34.83 35.55 2wbj s MET 55 CO -0.16 0.16 -0.08 -0.06 -0.01 0.00 0.00 175.02 174.87 2wbj s PHE 56 N -2.92 0.96 -0.21 -0.03 0.40 0.44 0.33 117.98 116.96 2wbj s PHE 56 Ca 0.26 -0.27 -0.04 0.00 -0.60 0.00 0.00 56.93 56.28 2wbj s PHE 56 Cb 0.00 -0.72 -0.01 0.00 0.51 0.00 0.00 43.02 42.79 2wbj s PHE 56 CO 0.10 -0.15 -0.04 -1.58 0.70 0.00 0.00 175.22 174.25 2wbj s TRP 57 N 0.44 2.97 -0.02 0.36 0.52 -0.79 -0.98 118.94 121.45 2wbj s TRP 57 Ca -0.07 -0.75 0.04 0.00 0.02 0.00 0.00 56.10 55.34 2wbj s TRP 57 Cb -0.11 -2.07 -0.03 0.00 -1.15 0.00 0.00 33.47 30.10 2wbj s TRP 57 CO 0.01 -0.42 -0.11 0.71 0.02 0.00 0.00 176.95 177.16 2wbj s TYR 58 N 1.22 2.77 0.03 -1.98 1.51 0.34 -1.35 117.35 119.89 2wbj s TYR 58 Ca 0.03 -0.11 0.07 0.00 -1.01 0.00 0.00 57.07 56.05 2wbj s TYR 58 Cb -0.14 -1.60 -0.03 0.00 -0.11 0.00 0.00 41.96 40.07 2wbj s TYR 58 CO -0.01 0.28 -0.20 0.50 -1.11 0.00 0.00 175.55 175.01 2wbj s ARG 59 N -1.10 2.05 -0.03 -0.62 3.52 0.28 -1.04 118.95 122.01 2wbj s ARG 59 Ca 0.14 -0.98 -0.01 0.00 -0.13 0.00 0.00 55.73 54.75 2wbj s ARG 59 Cb -0.11 -2.15 0.02 0.00 -1.56 0.00 0.00 34.95 31.16 2wbj s ARG 59 CO 0.04 0.54 0.06 -1.14 -0.81 0.00 0.00 175.30 173.99 2wbj s GLN 60 N -1.27 0.02 0.12 5.12 0.74 0.62 -0.52 119.66 124.50 2wbj s GLN 60 Ca 0.13 0.19 0.01 0.00 0.05 0.00 0.00 55.36 55.75 2wbj s GLN 60 Cb -0.10 -0.15 -0.04 0.00 1.10 0.00 0.00 33.01 33.82 2wbj s GLN 60 CO 0.04 -0.12 0.27 -0.06 -0.55 0.00 0.00 175.29 174.86 2wbj s PHE 61 N 0.77 3.50 0.07 1.67 0.40 -1.26 -1.23 117.98 121.89 2wbj s PHE 61 Ca -0.06 0.18 -0.13 0.00 -0.60 0.00 0.00 56.93 56.32 2wbj s PHE 61 Cb -0.09 -1.71 -0.03 0.00 0.51 0.00 0.00 43.02 41.70 2wbj s PHE 61 CO -0.03 0.53 0.69 -2.30 0.70 0.00 0.00 175.22 174.82 2wbj n PRO 62 N -0.26 -0.18 0.07 0.24 -0.01 -1.26 -1.48 135.00 132.11 2wbj n PRO 62 Ca -0.06 0.68 -0.23 0.00 -0.01 0.00 0.00 63.50 63.88 2wbj n PRO 62 Cb 0.53 -1.00 -0.15 0.00 -0.01 0.00 0.00 33.50 32.87 2wbj n PRO 62 CO 0.00 0.00 0.00 0.87 -0.01 0.00 0.00 175.50 176.36 2wbj h LYS 63 N 0.00 0.38 0.00 -0.52 6.56 -2.05 -3.49 116.57 117.45 2wbj h LYS 63 Ca 0.07 -0.65 -0.07 0.00 -1.06 0.00 0.00 60.65 58.94 2wbj h LYS 63 Cb 0.17 0.24 0.03 0.00 -0.57 0.00 0.00 32.23 32.09 2wbj h LYS 63 CO -0.38 1.31 0.06 0.00 -2.06 0.00 0.00 179.45 178.38 2wbj n GLN 64 N -3.69 -0.10 -2.56 3.15 0.00 -0.55 -5.08 117.38 108.54 2wbj n GLN 64 Ca -0.24 -0.34 -0.23 0.00 0.00 0.00 0.00 57.00 56.20 2wbj n GLN 64 Cb 1.04 -0.20 0.09 0.00 0.00 0.00 0.00 30.24 31.16 2wbj n GLN 64 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 2wbj s SER 65 N -1.74 4.61 -0.38 2.61 0.15 -1.26 -4.54 113.70 113.15 2wbj s SER 65 Ca 0.12 -0.20 -0.29 0.00 0.70 0.00 0.00 55.95 56.28 2wbj s SER 65 Cb -0.00 -0.33 0.02 0.00 -1.71 0.00 0.00 66.02 64.00 2wbj s SER 65 CO 0.08 -1.67 1.09 -0.76 1.20 0.00 0.00 173.24 173.18 2wbj s LEU 66 N -5.06 3.84 -0.25 3.45 1.02 -1.26 -4.46 118.68 115.96 2wbj s LEU 66 Ca 0.64 0.82 -0.20 0.00 0.02 0.00 0.00 54.13 55.40 2wbj s LEU 66 Cb -0.07 -3.53 -0.02 0.00 0.02 0.00 0.00 46.19 42.59 2wbj s LEU 66 CO 0.43 -1.01 0.63 -0.04 0.02 0.00 0.00 176.35 176.38 2wbj s MET 67 N 3.91 4.12 0.30 1.70 -1.94 0.32 -4.92 119.30 122.80 2wbj s MET 67 Ca 0.46 0.55 -0.29 0.00 -1.71 0.00 0.00 55.69 54.70 2wbj s MET 67 Cb -0.10 -3.64 -0.10 0.00 2.01 0.00 0.00 34.83 32.99 2wbj s MET 67 CO 0.21 -0.39 1.40 -1.17 -0.01 0.00 0.00 175.02 175.06 2wbj s LEU 68 N 2.43 4.39 0.00 -0.03 1.98 -1.26 -0.55 118.68 125.63 2wbj s LEU 68 Ca 0.26 2.75 0.00 0.00 -2.89 0.00 0.00 54.13 54.25 2wbj s LEU 68 Cb -0.16 -3.64 0.00 0.00 0.66 0.00 0.00 46.19 43.05 2wbj s LEU 68 CO 0.09 -0.67 0.00 0.23 -1.89 0.00 0.00 176.35 174.11 2wbj n MET 69 N 1.40 0.00 -4.00 1.98 2.81 -0.45 -4.85 117.12 114.01 2wbj n MET 69 Ca 0.03 0.00 -0.10 0.00 -1.81 0.00 0.00 57.70 55.82 2wbj n MET 69 Cb 0.41 -0.62 -0.11 0.00 -0.71 0.00 0.00 33.22 32.18 2wbj n MET 69 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2wbj s ALA 70 N -1.89 0.21 -0.20 3.04 0.00 -1.20 -1.32 121.76 120.40 2wbj s ALA 70 Ca 0.00 -0.62 -0.07 0.00 0.00 0.00 0.00 51.96 51.27 2wbj s ALA 70 Cb 0.00 0.13 -0.04 0.00 0.00 0.00 0.00 23.12 23.21 2wbj s ALA 70 CO 0.00 -0.13 0.06 0.99 0.00 0.00 0.00 175.76 176.68 2wbj s THR 71 N -1.43 4.63 -0.13 0.00 2.01 -0.07 -1.88 115.64 118.77 2wbj s THR 71 Ca -0.15 -0.08 -0.07 0.00 0.31 0.00 0.00 61.69 61.70 2wbj s THR 71 Cb -0.10 -3.10 -0.04 0.00 0.01 0.00 0.00 72.50 69.27 2wbj s THR 71 CO -0.01 0.43 0.12 -0.94 -0.69 0.00 0.00 174.62 173.53 2wbj s SER 72 N 0.69 6.21 0.08 3.53 1.04 0.15 0.13 113.70 125.53 2wbj s SER 72 Ca 0.03 0.39 0.08 0.00 0.48 0.00 0.00 55.95 56.93 2wbj s SER 72 Cb -0.13 -2.01 -0.03 0.00 0.10 0.00 0.00 66.02 63.95 2wbj s SER 72 CO 0.02 0.37 -0.21 0.20 0.98 0.00 0.00 173.24 174.59 2wbj s ASN 73 N -0.77 2.58 -0.43 7.02 -0.87 -1.26 -1.21 114.94 120.00 2wbj s ASN 73 Ca 0.13 -0.61 -0.25 0.00 -1.57 0.00 0.00 52.86 50.56 2wbj s ASN 73 Cb -0.12 -0.18 0.02 0.00 -0.02 0.00 0.00 41.25 40.96 2wbj s ASN 73 CO 0.03 0.12 0.89 -0.70 -2.57 0.00 0.00 177.10 174.86 2wbj s GLU 74 N -1.57 3.61 0.00 -0.60 2.56 -0.82 -4.50 118.70 117.37 2wbj s GLU 74 Ca 0.08 0.23 0.00 0.00 0.00 0.00 0.00 54.97 55.27 2wbj s GLU 74 Cb -0.09 -3.89 0.00 0.00 2.00 0.00 0.00 34.13 32.15 2wbj s GLU 74 CO 0.03 -1.10 0.00 0.41 -0.56 0.00 0.00 175.26 174.04 2wbj n GLY 75 N 4.77 -1.85 2.46 -1.50 0.00 -1.26 -5.04 105.19 102.78 2wbj n GLY 75 Ca 0.05 0.87 -0.02 0.00 0.00 0.00 0.00 46.02 46.92 2wbj n GLY 75 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2wbj n SER 76 N 0.00 -5.23 -4.71 1.61 2.88 -1.26 -4.73 113.62 102.18 2wbj n SER 76 Ca 0.00 1.53 -0.34 0.00 -1.33 0.00 0.00 58.87 58.73 2wbj n SER 76 Cb 0.00 -4.46 0.11 0.00 -0.75 0.00 0.00 64.21 59.10 2wbj n SER 76 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 2wbj s LYS 77 N -0.49 1.91 0.00 -1.46 1.02 -1.26 -4.42 119.74 115.03 2wbj s LYS 77 Ca -0.10 1.77 0.00 0.00 0.02 0.00 0.00 55.97 57.66 2wbj s LYS 77 Cb 0.01 -1.81 0.00 0.00 -0.52 0.00 0.00 37.83 35.51 2wbj s LYS 77 CO 0.26 -2.01 0.00 0.00 -0.92 0.00 0.00 175.35 172.67 2wbj n ALA 78 N -2.98 0.00 -3.29 5.17 0.00 -1.26 -4.80 120.51 113.35 2wbj n ALA 78 Ca 0.14 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.52 2wbj n ALA 78 Cb 0.50 0.00 -0.06 0.00 0.00 0.00 0.00 19.45 19.90 2wbj n ALA 78 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 2wbj s THR 79 N -2.00 -0.71 0.25 0.00 2.01 0.35 -4.72 115.64 110.82 2wbj s THR 79 Ca 0.00 -0.13 -0.06 0.00 0.31 0.00 0.00 61.69 61.82 2wbj s THR 79 Cb 0.00 -0.92 -0.06 0.00 0.01 0.00 0.00 72.50 71.54 2wbj s THR 79 CO 0.00 -0.15 0.52 -0.31 -0.69 0.00 0.00 174.62 173.99 2wbj s TYR 80 N 2.62 3.47 0.84 4.92 1.51 -1.26 -0.89 117.35 128.55 2wbj s TYR 80 Ca 0.13 0.65 -0.10 0.00 -1.01 0.00 0.00 57.07 56.74 2wbj s TYR 80 Cb -0.14 -2.10 0.15 0.00 -0.11 0.00 0.00 41.96 39.75 2wbj s TYR 80 CO -0.22 0.24 1.18 -1.21 -1.11 0.00 0.00 175.55 174.43 2wbj s GLU 81 N -3.26 1.30 0.00 -0.62 0.41 -0.43 -4.90 118.70 111.19 2wbj s GLU 81 Ca 0.44 -0.49 0.08 0.00 -0.41 0.00 0.00 54.97 54.59 2wbj s GLU 81 Cb -0.11 -2.03 0.37 0.00 -1.78 0.00 0.00 34.13 30.58 2wbj s GLU 81 CO 0.27 -1.89 1.21 1.04 -0.49 0.00 0.00 175.26 175.41 2wbj n GLN 82 N -3.35 0.04 0.00 1.61 6.02 -1.26 -2.22 117.38 118.21 2wbj n GLN 82 Ca 0.13 0.31 0.00 0.00 -0.01 0.00 0.00 57.00 57.43 2wbj n GLN 82 Cb 0.60 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.36 2wbj n GLN 82 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2wbj n GLY 83 N -0.65 -1.36 0.00 1.08 0.00 -1.26 -5.10 105.19 97.91 2wbj n GLY 83 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 2wbj n GLY 83 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 2wbj n VAL 84 N 0.00 0.00 -3.15 1.61 0.31 -0.94 -5.04 118.33 111.11 2wbj n VAL 84 Ca 0.00 0.00 0.04 0.00 -0.01 0.00 0.00 64.34 64.37 2wbj n VAL 84 Cb 0.00 -0.04 -0.01 0.00 -0.91 0.00 0.00 33.84 32.88 2wbj n VAL 84 CO 0.00 0.00 0.00 -1.83 -1.32 0.00 0.00 176.83 173.68 2wbj s GLU 85 N 0.87 0.44 6.24 5.55 1.03 -1.26 -5.11 118.70 126.46 2wbj s GLU 85 Ca 0.00 0.76 0.00 0.00 0.03 0.00 0.00 54.97 55.76 2wbj s GLU 85 Cb 0.00 0.41 0.00 0.00 -0.80 0.00 0.00 34.13 33.74 2wbj s GLU 85 CO 0.00 -0.52 0.00 1.63 -1.33 0.00 0.00 175.26 175.04 2wbj n LYS 86 N 5.43 0.00 0.00 -4.83 4.76 -1.26 -3.54 118.16 118.72 2wbj n LYS 86 Ca -0.02 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.42 2wbj n LYS 86 Cb 0.52 0.00 0.00 0.00 -1.84 0.00 0.00 35.03 33.71 2wbj n LYS 86 CO 0.00 0.00 0.00 -0.25 -1.37 0.00 0.00 177.40 175.78 2wbj n ASP 87 N 2.24 0.00 0.18 4.39 8.00 -1.26 -4.78 116.55 125.33 2wbj n ASP 87 Ca 0.00 0.00 0.12 0.00 0.71 0.00 0.00 54.79 55.62 2wbj n ASP 87 Cb 0.00 0.00 0.23 0.00 -0.02 0.00 0.00 41.12 41.33 2wbj n ASP 87 CO 0.00 0.00 0.00 0.07 -0.39 0.00 0.00 177.20 176.88 2wbj h LYS 88 N 2.56 0.00 -4.86 -1.24 5.09 -1.96 -3.45 116.57 112.70 2wbj h LYS 88 Ca 0.00 0.00 -0.29 0.00 0.09 0.00 0.00 60.65 60.45 2wbj h LYS 88 Cb 0.00 0.00 -0.16 0.00 0.10 0.00 0.00 32.23 32.17 2wbj h LYS 88 CO 0.00 0.00 -0.72 -0.59 -2.09 0.00 0.00 179.45 176.05 2wbj s PHE 89 N -3.18 1.03 -0.08 0.07 -0.71 -1.26 -0.54 117.98 113.30 2wbj s PHE 89 Ca 0.08 -0.76 0.02 0.00 -1.04 0.00 0.00 56.93 55.24 2wbj s PHE 89 Cb 0.07 -0.56 -0.02 0.00 -1.21 0.00 0.00 43.02 41.30 2wbj s PHE 89 CO 0.65 -0.03 -0.14 -0.51 -1.34 0.00 0.00 175.22 173.85 2wbj s LEU 90 N -2.76 2.73 -0.18 -1.99 1.43 0.62 -4.91 118.68 113.62 2wbj s LEU 90 Ca 0.09 -0.24 -0.04 0.00 -1.03 0.00 0.00 54.13 52.92 2wbj s LEU 90 Cb 0.01 -1.57 -0.02 0.00 0.03 0.00 0.00 46.19 44.63 2wbj s LEU 90 CO -0.01 0.28 -0.04 -0.63 0.23 0.00 0.00 176.35 176.18 2wbj s ILE 91 N -0.37 3.63 -0.23 -0.59 -1.09 -1.26 -0.85 121.20 120.44 2wbj s ILE 91 Ca 0.04 -0.43 -0.01 0.00 -2.23 0.00 0.00 60.65 58.02 2wbj s ILE 91 Cb -0.12 -2.62 0.02 0.00 -1.58 0.00 0.00 42.46 38.16 2wbj s ILE 91 CO 0.02 0.46 -0.10 0.21 -1.23 0.00 0.00 174.94 174.30 2wbj s ASN 92 N 0.89 4.05 -0.34 3.58 3.04 -0.18 -4.90 114.94 121.08 2wbj s ASN 92 Ca -0.01 -0.83 0.01 0.00 0.04 0.00 0.00 52.86 52.08 2wbj s ASN 92 Cb -0.15 -1.62 0.10 0.00 -1.54 0.00 0.00 41.25 38.05 2wbj s ASN 92 CO 0.01 -0.09 0.10 -2.28 -3.04 0.00 0.00 177.10 171.80 2wbj s HIS 93 N 1.31 2.41 -0.34 0.43 2.46 -1.26 -0.39 115.29 119.90 2wbj s HIS 93 Ca 0.01 -2.24 0.16 0.00 0.47 0.00 0.00 55.06 53.46 2wbj s HIS 93 Cb -0.16 -2.14 0.44 0.00 -0.13 0.00 0.00 32.58 30.59 2wbj s HIS 93 CO -0.06 -0.89 1.02 0.00 -2.47 0.00 0.00 174.74 172.34 2wbj n ALA 94 N 4.48 2.82 0.00 1.58 0.00 -1.25 -4.08 120.51 124.05 2wbj n ALA 94 Ca 0.01 -2.74 0.00 0.00 0.00 0.00 0.00 53.44 50.71 2wbj n ALA 94 Cb 0.41 -0.96 0.00 0.00 0.00 0.00 0.00 19.45 18.90 2wbj n ALA 94 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2wbj n SER 95 N -0.14 0.00 0.00 0.00 7.64 -1.26 -5.01 113.62 114.85 2wbj n SER 95 Ca 0.07 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.95 2wbj n SER 95 Cb 0.81 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 64.01 2wbj n SER 95 CO 0.00 0.00 0.00 -0.11 -3.01 0.00 0.00 175.04 171.92 2wbj n LEU 96 N -0.44 0.60 0.00 -3.43 7.94 -1.26 -4.58 117.00 115.83 2wbj n LEU 96 Ca 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.90 2wbj n LEU 96 Cb 0.00 -1.60 0.00 0.00 0.53 0.00 0.00 43.42 42.35 2wbj n LEU 96 CO 0.00 -0.56 0.00 0.41 -1.11 0.00 0.00 177.39 176.13 2wbj n THR 97 N -2.35 0.00 -3.67 1.96 -1.04 -1.26 -2.33 114.28 105.58 2wbj n THR 97 Ca 0.00 0.00 -0.15 0.00 -2.04 0.00 0.00 64.05 61.86 2wbj n THR 97 Cb 0.26 0.32 -0.14 0.00 -1.82 0.00 0.00 70.33 68.95 2wbj n THR 97 CO 0.00 0.00 0.00 -0.22 -0.64 0.00 0.00 175.07 174.21 2wbj s LEU 98 N 0.00 -0.15 -0.05 -4.42 1.98 -1.26 -0.81 118.68 113.97 2wbj s LEU 98 Ca 0.00 0.47 0.06 0.00 -2.89 0.00 0.00 54.13 51.76 2wbj s LEU 98 Cb 0.00 0.50 -0.01 0.00 0.66 0.00 0.00 46.19 47.34 2wbj s LEU 98 CO 0.00 -0.24 -0.23 -0.55 -1.89 0.00 0.00 176.35 173.44 2wbj s SER 99 N 2.29 2.85 -0.16 3.68 0.15 -0.25 -3.97 113.70 118.28 2wbj s SER 99 Ca 0.01 -0.47 0.01 0.00 0.70 0.00 0.00 55.95 56.21 2wbj s SER 99 Cb -0.12 -0.76 0.01 0.00 -1.71 0.00 0.00 66.02 63.44 2wbj s SER 99 CO -0.07 0.23 -0.20 -0.89 1.20 0.00 0.00 173.24 173.51 2wbj s THR 100 N -0.14 2.22 -0.30 6.45 2.01 0.47 -0.61 115.64 125.74 2wbj s THR 100 Ca -0.03 -0.91 -0.14 0.00 0.31 0.00 0.00 61.69 60.92 2wbj s THR 100 Cb -0.13 -1.91 -0.03 0.00 0.01 0.00 0.00 72.50 70.44 2wbj s THR 100 CO 0.03 0.54 0.32 -0.22 -0.69 0.00 0.00 174.62 174.59 2wbj s LEU 101 N 0.98 4.21 -0.23 4.42 0.20 -0.11 -1.01 118.68 127.14 2wbj s LEU 101 Ca -0.03 -0.01 0.00 0.00 0.69 0.00 0.00 54.13 54.78 2wbj s LEU 101 Cb -0.15 -2.30 0.03 0.00 -0.43 0.00 0.00 46.19 43.34 2wbj s LEU 101 CO -0.05 -0.21 -0.12 0.28 -0.29 0.00 0.00 176.35 175.96 2wbj s THR 102 N 1.96 2.47 -0.27 3.68 -1.32 -0.03 -0.01 115.64 122.11 2wbj s THR 102 Ca 0.11 -1.12 -0.28 0.00 -1.21 0.00 0.00 61.69 59.18 2wbj s THR 102 Cb -0.16 -2.23 0.01 0.00 -1.51 0.00 0.00 72.50 68.61 2wbj s THR 102 CO 0.11 0.26 1.03 -0.69 -2.21 0.00 0.00 174.62 173.12 2wbj s VAL 103 N 1.27 4.64 0.04 5.08 1.01 0.64 -0.27 120.40 132.80 2wbj s VAL 103 Ca -0.00 1.86 -0.32 0.00 0.00 0.00 0.00 61.98 63.52 2wbj s VAL 103 Cb -0.16 -4.33 -0.18 0.00 0.00 0.00 0.00 36.38 31.72 2wbj s VAL 103 CO -0.07 -0.28 1.35 0.74 0.00 0.00 0.00 175.10 176.83 2wbj h THR 104 N 5.55 0.07 0.00 3.92 2.02 -1.12 -2.00 112.91 121.37 2wbj h THR 104 Ca -0.20 -0.17 -0.24 0.00 0.77 0.00 0.00 66.41 66.57 2wbj h THR 104 Cb 1.06 0.09 -0.04 0.00 -1.74 0.00 0.00 68.15 67.53 2wbj h THR 104 CO 0.99 0.01 -1.74 -0.24 0.37 0.00 0.00 175.52 174.90 2wbj n SER 105 N -5.51 1.36 -1.57 4.18 2.88 -1.26 -3.59 113.62 110.12 2wbj n SER 105 Ca -0.14 0.23 0.00 0.00 -1.33 0.00 0.00 58.87 57.63 2wbj n SER 105 Cb 0.43 -0.55 0.00 0.00 -0.75 0.00 0.00 64.21 63.34 2wbj n SER 105 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2wbj n ALA 106 N -3.88 -2.53 -2.43 -1.46 0.00 -1.26 -2.47 120.51 106.47 2wbj n ALA 106 Ca -0.30 0.23 -0.21 0.00 0.00 0.00 0.00 53.44 53.16 2wbj n ALA 106 Cb 0.67 -0.75 -0.11 0.00 0.00 0.00 0.00 19.45 19.26 2wbj n ALA 106 CO 0.00 0.00 0.00 -1.01 0.00 0.00 0.00 177.50 176.49 2wbj s HIS 107 N -0.28 1.91 0.53 0.00 3.76 -1.26 -1.22 115.29 118.73 2wbj s HIS 107 Ca 0.00 -0.91 0.29 0.00 -0.15 0.00 0.00 55.06 54.29 2wbj s HIS 107 Cb 0.00 -1.20 1.43 0.00 1.11 0.00 0.00 32.58 33.92 2wbj s HIS 107 CO 0.00 0.05 1.92 -1.00 -0.85 0.00 0.00 174.74 174.86 2wbj h PRO 108 N 2.19 0.02 0.00 8.40 0.13 -1.94 0.17 132.00 140.98 2wbj h PRO 108 Ca -0.40 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.73 2wbj h PRO 108 Cb 1.24 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.36 2wbj h PRO 108 CO 0.69 0.02 0.00 -0.85 -0.23 0.00 0.00 178.00 177.62 2wbj n GLU 109 N -4.32 0.08 0.00 0.86 0.28 -1.26 -2.23 120.64 114.05 2wbj n GLU 109 Ca 0.16 0.49 0.11 0.00 -0.16 0.00 0.00 57.16 57.76 2wbj n GLU 109 Cb 0.82 -1.71 0.06 0.00 1.43 0.00 0.00 31.44 32.05 2wbj n GLU 109 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 2wbj n ASP 110 N -1.86 1.11 -4.62 -1.84 9.92 0.61 -4.90 116.55 114.97 2wbj n ASP 110 Ca 0.00 -0.92 -0.43 0.00 -0.53 0.00 0.00 54.79 52.92 2wbj n ASP 110 Cb 0.08 0.59 -0.03 0.00 -0.64 0.00 0.00 41.12 41.11 2wbj n ASP 110 CO 0.00 0.00 0.00 -0.44 0.13 0.00 0.00 177.20 176.89 2wbj s SER 111 N -2.82 5.79 0.36 -2.24 0.01 -0.94 -4.88 113.70 108.98 2wbj s SER 111 Ca 0.13 2.13 -0.12 0.00 1.31 0.00 0.00 55.95 59.40 2wbj s SER 111 Cb 0.17 -2.52 0.05 0.00 0.21 0.00 0.00 66.02 63.94 2wbj s SER 111 CO 0.72 -1.66 0.70 -0.24 0.41 0.00 0.00 173.24 173.17 2wbj n SER 112 N 10.30 -2.03 -4.65 2.44 2.88 -0.44 -4.97 113.62 117.14 2wbj n SER 112 Ca 0.26 -2.48 -0.37 0.00 -1.33 0.00 0.00 58.87 54.96 2wbj n SER 112 Cb 0.44 3.40 -0.10 0.00 -0.75 0.00 0.00 64.21 67.20 2wbj n SER 112 CO 0.00 0.00 0.00 0.12 -1.23 0.00 0.00 175.04 173.93 2wbj s PHE 113 N -2.79 3.31 0.00 0.66 5.36 -0.36 -1.85 117.98 122.31 2wbj s PHE 113 Ca 0.16 0.21 0.04 0.00 -0.96 0.00 0.00 56.93 56.38 2wbj s PHE 113 Cb -0.04 -2.28 -0.03 0.00 -0.34 0.00 0.00 43.02 40.33 2wbj s PHE 113 CO 0.12 0.05 -0.08 0.71 -1.46 0.00 0.00 175.22 174.55 2wbj s TYR 114 N 1.11 2.84 -0.11 10.12 2.02 0.14 -0.27 117.35 133.20 2wbj s TYR 114 Ca 0.07 -0.07 -0.08 0.00 -0.37 0.00 0.00 57.07 56.63 2wbj s TYR 114 Cb -0.14 -1.60 0.03 0.00 -0.40 0.00 0.00 41.96 39.86 2wbj s TYR 114 CO 0.05 0.35 0.27 -1.50 -1.57 0.00 0.00 175.55 173.15 2wbj s ILE 115 N -0.97 -0.01 0.13 2.71 2.07 -0.21 -0.16 121.20 124.75 2wbj s ILE 115 Ca 0.16 0.05 0.05 0.00 -1.41 0.00 0.00 60.65 59.50 2wbj s ILE 115 Cb -0.11 -0.40 -0.04 0.00 0.13 0.00 0.00 42.46 42.04 2wbj s ILE 115 CO 0.07 0.02 0.09 0.00 -1.91 0.00 0.00 174.94 173.21 2wbj s SER 117 N -2.76 0.94 -0.04 0.00 1.04 -0.16 -0.74 113.70 111.98 2wbj s SER 117 Ca 0.29 -0.69 0.02 0.00 0.48 0.00 0.00 55.95 56.06 2wbj s SER 117 Cb -0.11 0.05 0.01 0.00 0.10 0.00 0.00 66.02 66.08 2wbj s SER 117 CO 0.22 -0.28 -0.10 0.00 0.98 0.00 0.00 173.24 174.06 2wbj s ALA 118 N -2.07 1.01 -0.17 5.32 0.00 -0.24 -0.42 121.76 125.19 2wbj s ALA 118 Ca -0.03 -0.32 -0.25 0.00 0.00 0.00 0.00 51.96 51.35 2wbj s ALA 118 Cb -0.05 -0.44 -0.02 0.00 0.00 0.00 0.00 23.12 22.61 2wbj s ALA 118 CO -0.01 0.11 0.83 0.50 0.00 0.00 0.00 175.76 177.18 2wbj s ARG 119 N 0.50 4.30 0.01 0.00 3.52 -1.08 -1.26 118.95 124.94 2wbj s ARG 119 Ca -0.09 1.01 -0.30 0.00 -0.13 0.00 0.00 55.73 56.22 2wbj s ARG 119 Cb -0.13 -3.57 -0.08 0.00 -1.56 0.00 0.00 34.95 29.61 2wbj s ARG 119 CO 0.02 -0.31 1.93 0.34 -0.81 0.00 0.00 175.30 176.46 2wbj s ASP 120 N 1.15 6.44 0.15 -2.12 -1.08 -0.36 -4.16 116.67 116.70 2wbj s ASP 120 Ca 0.38 2.57 0.23 0.00 -0.52 0.00 0.00 52.55 55.21 2wbj s ASP 120 Cb -0.17 -2.53 0.89 0.00 -1.46 0.00 0.00 42.92 39.65 2wbj s ASP 120 CO 0.13 -1.07 1.69 0.00 0.52 0.00 0.00 175.17 176.44 2wbj n LEU 121 N 7.64 0.45 0.18 -1.34 -0.00 -1.03 -2.40 117.00 120.50 2wbj n LEU 121 Ca 0.20 0.58 0.06 0.00 -0.00 0.00 0.00 56.01 56.85 2wbj n LEU 121 Cb 0.41 -0.49 0.22 0.00 -0.00 0.00 0.00 43.42 43.56 2wbj n LEU 121 CO 0.67 -0.33 0.63 0.74 -0.00 0.00 0.00 177.39 179.10 2wbj h THR 122 N 0.00 0.71 -0.47 1.47 2.02 -1.90 -3.36 112.91 111.38 2wbj h THR 122 Ca 0.00 -1.69 -0.03 0.00 0.77 0.00 0.00 66.41 65.46 2wbj h THR 122 Cb 0.43 2.12 -0.02 0.00 -1.74 0.00 0.00 68.15 68.94 2wbj h THR 122 CO 0.00 0.36 0.18 0.28 0.37 0.00 0.00 175.52 176.70 2wbj h SER 123 N 0.00 0.65 0.00 4.18 0.02 -1.77 -3.43 113.55 113.20 2wbj h SER 123 Ca -0.00 -0.18 0.00 0.00 -0.84 0.00 0.00 61.79 60.77 2wbj h SER 123 Cb 1.09 -0.17 0.00 0.00 0.14 0.00 0.00 62.40 63.46 2wbj h SER 123 CO 0.05 0.65 0.00 0.61 -1.14 0.00 0.00 176.83 177.00 2wbj n GLY 124 N -0.76 2.87 0.32 -3.77 0.00 -1.26 -3.68 105.19 98.91 2wbj n GLY 124 Ca 0.01 -0.12 0.19 0.00 0.00 0.00 0.00 46.02 46.10 2wbj n GLY 124 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wbj h ALA 125 N -0.53 1.64 -1.58 4.61 0.00 -1.07 -3.18 119.26 119.16 2wbj h ALA 125 Ca 0.00 0.21 -0.62 0.00 0.00 0.00 0.00 54.91 54.50 2wbj h ALA 125 Cb 0.00 0.24 -0.13 0.00 0.00 0.00 0.00 17.79 17.90 2wbj h ALA 125 CO 0.00 -0.53 0.81 0.54 0.00 0.00 0.00 179.25 180.07 2wbj s ASN 126 N -4.98 6.29 -1.00 0.00 6.03 -1.24 -4.95 114.94 115.08 2wbj s ASN 126 Ca -0.11 -1.11 -0.22 0.00 -1.03 0.00 0.00 52.86 50.38 2wbj s ASN 126 Cb 0.28 -2.46 0.06 0.00 -3.03 0.00 0.00 41.25 36.10 2wbj s ASN 126 CO 0.78 -1.47 1.40 0.21 -2.03 0.00 0.00 177.10 175.99 2wbj s ASN 127 N 3.84 6.51 -0.26 3.54 2.47 -1.20 -4.76 114.94 125.08 2wbj s ASN 127 Ca 0.29 -1.52 -0.12 0.00 0.42 0.00 0.00 52.86 51.93 2wbj s ASN 127 Cb -0.11 -2.55 -0.05 0.00 -1.45 0.00 0.00 41.25 37.10 2wbj s ASN 127 CO 0.05 -1.45 0.25 -1.61 -3.72 0.00 0.00 177.10 170.63 2wbj s GLU 128 N 4.66 4.01 0.17 0.43 2.02 -1.26 -5.04 118.70 123.70 2wbj s GLU 128 Ca 0.44 -0.16 0.06 0.00 0.02 0.00 0.00 54.97 55.33 2wbj s GLU 128 Cb -0.01 -3.62 -0.04 0.00 0.10 0.00 0.00 34.13 30.56 2wbj s GLU 128 CO -0.10 -0.14 -0.12 1.14 0.02 0.00 0.00 175.26 176.06 2wbj s GLN 129 N 1.65 1.17 0.01 1.61 -2.07 -1.26 -1.22 119.66 119.56 2wbj s GLN 129 Ca 0.10 -1.50 0.01 0.00 -1.82 0.00 0.00 55.36 52.15 2wbj s GLN 129 Cb -0.15 -0.85 -0.01 0.00 -1.09 0.00 0.00 33.01 30.91 2wbj s GLN 129 CO 0.09 0.13 -0.03 -0.06 -1.32 0.00 0.00 175.29 174.10 2wbj s PHE 130 N -3.12 0.27 0.01 9.60 0.08 -0.39 -4.93 117.98 119.51 2wbj s PHE 130 Ca 0.19 -0.20 -0.03 0.00 0.12 0.00 0.00 56.93 57.01 2wbj s PHE 130 Cb 0.01 -0.18 -0.04 0.00 -0.57 0.00 0.00 43.02 42.24 2wbj s PHE 130 CO 0.03 -0.05 0.21 -0.06 -0.10 0.00 0.00 175.22 175.25 2wbj s PHE 131 N -0.51 3.55 0.75 0.36 0.40 -1.26 -1.08 117.98 120.18 2wbj s PHE 131 Ca -0.04 0.38 -0.11 0.00 -0.60 0.00 0.00 56.93 56.55 2wbj s PHE 131 Cb -0.04 -1.85 0.04 0.00 0.51 0.00 0.00 43.02 41.69 2wbj s PHE 131 CO -0.00 0.62 1.10 0.20 0.70 0.00 0.00 175.22 177.84 2wbj s GLY 132 N -2.03 1.62 0.52 4.36 0.00 0.08 -4.53 107.32 107.35 2wbj s GLY 132 Ca 0.29 -0.30 0.16 0.00 0.00 0.00 0.00 44.72 44.88 2wbj s GLY 132 CO 0.20 0.10 2.15 -0.56 0.00 0.00 0.00 173.10 175.00 2wbj h PRO 133 N -0.87 0.00 0.00 2.90 0.13 -1.90 -3.44 132.00 128.82 2wbj h PRO 133 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 2wbj h PRO 133 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 2wbj h PRO 133 CO 0.62 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.80 2wbj n GLY 134 N -1.53 2.53 3.08 1.56 0.00 -1.26 -5.05 105.19 104.52 2wbj n GLY 134 Ca -0.03 -2.09 -0.27 0.00 0.00 0.00 0.00 46.02 43.64 2wbj n GLY 134 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2wbj s THR 135 N -2.25 1.40 -0.62 2.61 2.01 0.77 -4.53 115.64 115.03 2wbj s THR 135 Ca 0.00 -0.63 -0.08 0.00 0.31 0.00 0.00 61.69 61.29 2wbj s THR 135 Cb 0.00 -1.25 0.16 0.00 0.01 0.00 0.00 72.50 71.43 2wbj s THR 135 CO 0.00 0.41 0.49 -0.60 -0.69 0.00 0.00 174.62 174.24 2wbj s ARG 136 N 0.55 2.80 -0.05 4.92 3.52 0.00 -0.69 118.95 130.02 2wbj s ARG 136 Ca -0.15 -2.25 -0.24 0.00 -0.13 0.00 0.00 55.73 52.96 2wbj s ARG 136 Cb -0.16 -3.98 -0.04 0.00 -1.56 0.00 0.00 34.95 29.21 2wbj s ARG 136 CO 0.05 -1.21 0.72 -1.17 -0.81 0.00 0.00 175.30 172.88 2wbj s LEU 137 N 0.49 4.34 -0.07 -0.88 2.96 -0.77 -2.80 118.68 121.95 2wbj s LEU 137 Ca 0.13 1.25 0.02 0.00 -0.22 0.00 0.00 54.13 55.31 2wbj s LEU 137 Cb -0.20 -3.12 0.02 0.00 0.50 0.00 0.00 46.19 43.39 2wbj s LEU 137 CO -0.04 -0.10 -0.10 0.42 -1.32 0.00 0.00 176.35 175.20 2wbj s THR 138 N 0.68 1.03 -0.11 3.68 -4.23 -0.86 -1.33 115.64 114.49 2wbj s THR 138 Ca 0.38 -0.40 -0.01 0.00 -1.18 0.00 0.00 61.69 60.48 2wbj s THR 138 Cb -0.18 -0.97 -0.03 0.00 1.34 0.00 0.00 72.50 72.67 2wbj s THR 138 CO 0.19 0.34 -0.07 0.54 -0.54 0.00 0.00 174.62 175.08 2wbj s VAL 139 N 0.84 3.61 0.17 2.29 0.11 -1.26 -3.13 120.40 123.03 2wbj s VAL 139 Ca -0.12 -0.48 0.09 0.00 -2.93 0.00 0.00 61.98 58.54 2wbj s VAL 139 Cb -0.15 -2.52 -0.04 0.00 -1.53 0.00 0.00 36.38 32.13 2wbj s VAL 139 CO 0.02 0.54 -0.19 0.28 -3.33 0.00 0.00 175.10 172.42 2wbj s THR 140 N -0.13 1.93 0.28 5.04 -1.32 -0.77 -4.28 115.64 116.40 2wbj s THR 140 Ca 0.01 -1.94 0.15 0.00 -1.21 0.00 0.00 61.69 58.70 2wbj s THR 140 Cb -0.13 -1.90 0.08 0.00 -1.51 0.00 0.00 72.50 69.04 2wbj s THR 140 CO 0.03 -0.27 1.74 -0.08 -2.21 0.00 0.00 174.62 173.83 2wbj h GLU 141 N 3.25 0.00 -3.26 7.08 4.57 -1.94 -1.24 114.58 123.03 2wbj h GLU 141 Ca -0.43 0.00 -0.20 0.00 -1.18 0.00 0.00 59.36 57.55 2wbj h GLU 141 Cb 1.21 0.00 -0.28 0.00 -0.16 0.00 0.00 28.75 29.51 2wbj h GLU 141 CO 0.50 0.43 -0.54 0.34 -1.18 0.00 0.00 179.01 178.57 2wbj s ASP 142 N -6.70 -0.17 0.03 1.04 -1.08 -1.26 -4.63 116.67 103.90 2wbj s ASP 142 Ca -0.01 0.36 0.11 0.00 -0.52 0.00 0.00 52.55 52.48 2wbj s ASP 142 Cb 0.13 0.31 0.49 0.00 -1.46 0.00 0.00 42.92 42.38 2wbj s ASP 142 CO 0.72 -0.10 1.36 0.18 0.52 0.00 0.00 175.17 177.84 2wbj n LEU 143 N 3.51 0.06 0.02 -1.34 4.77 -1.26 -1.60 117.00 121.15 2wbj n LEU 143 Ca -0.18 0.52 0.20 0.00 -0.03 0.00 0.00 56.01 56.52 2wbj n LEU 143 Cb 0.56 -0.51 0.70 0.00 -2.33 0.00 0.00 43.42 41.84 2wbj n LEU 143 CO 0.19 -0.36 1.18 0.50 -1.33 0.00 0.00 177.39 177.57 2wbj h LYS 144 N 0.00 0.00 0.00 3.23 3.64 -1.95 -2.89 116.57 118.60 2wbj h LYS 144 Ca 0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 2wbj h LYS 144 Cb 0.18 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.00 2wbj h LYS 144 CO 0.00 0.00 0.00 0.09 -2.27 0.00 0.00 179.45 177.27 2wbj n ASN 145 N -4.30 0.00 -4.66 4.20 5.03 -0.63 -4.83 115.26 110.07 2wbj n ASN 145 Ca 0.09 -0.06 -0.41 0.00 0.87 0.00 0.00 54.58 55.07 2wbj n ASN 145 Cb 0.59 -0.29 -0.04 0.00 -1.02 0.00 0.00 39.78 39.02 2wbj n ASN 145 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 2wbj s VAL 146 N -2.58 4.87 -0.05 2.41 1.01 -1.10 -4.64 120.40 120.33 2wbj s VAL 146 Ca 0.23 1.60 0.03 0.00 0.00 0.00 0.00 61.98 63.84 2wbj s VAL 146 Cb 0.17 -4.12 0.00 0.00 0.00 0.00 0.00 36.38 32.43 2wbj s VAL 146 CO 0.38 0.00 -0.14 -0.36 0.00 0.00 0.00 175.10 174.99 2wbj s PHE 147 N 2.33 1.47 0.54 5.22 0.08 0.02 -4.74 117.98 122.88 2wbj s PHE 147 Ca 0.37 -0.46 -0.18 0.00 0.12 0.00 0.00 56.93 56.79 2wbj s PHE 147 Cb -0.16 -1.03 -0.06 0.00 -0.57 0.00 0.00 43.02 41.20 2wbj s PHE 147 CO 0.11 -0.19 1.03 -1.25 -0.10 0.00 0.00 175.22 174.82 2wbj s PRO 148 N 0.30 3.63 0.30 0.24 0.04 -1.26 -0.95 135.00 137.30 2wbj s PRO 148 Ca -0.08 1.20 -0.28 0.00 0.04 0.00 0.00 61.00 61.89 2wbj s PRO 148 Cb -0.12 -2.08 -0.09 0.00 0.04 0.00 0.00 34.50 32.24 2wbj s PRO 148 CO 0.02 -0.55 1.07 -1.25 0.04 0.00 0.00 177.00 176.33 2wbj s PRO 149 N -3.76 4.56 -0.03 0.56 0.04 -1.26 -4.53 135.00 130.57 2wbj s PRO 149 Ca 0.64 1.70 -0.21 0.00 0.04 0.00 0.00 61.00 63.17 2wbj s PRO 149 Cb -0.15 -3.05 -0.05 0.00 0.04 0.00 0.00 34.50 31.29 2wbj s PRO 149 CO 0.29 0.17 0.61 -2.00 0.04 0.00 0.00 177.00 176.11 2wbj s GLU 150 N -1.65 4.35 -0.09 4.56 2.12 0.38 -4.83 118.70 123.53 2wbj s GLU 150 Ca 0.47 0.74 0.00 0.00 0.36 0.00 0.00 54.97 56.54 2wbj s GLU 150 Cb -0.29 -3.37 0.02 0.00 0.26 0.00 0.00 34.13 30.75 2wbj s GLU 150 CO 0.37 0.28 -0.08 0.54 -0.54 0.00 0.00 175.26 175.83 2wbj s VAL 151 N 0.10 1.00 0.09 3.70 0.11 -1.26 0.10 120.40 124.24 2wbj s VAL 151 Ca 0.32 -0.31 0.07 0.00 -2.93 0.00 0.00 61.98 59.13 2wbj s VAL 151 Cb -0.18 -0.99 -0.03 0.00 -1.53 0.00 0.00 36.38 33.64 2wbj s VAL 151 CO 0.17 0.35 -0.19 0.00 -3.33 0.00 0.00 175.10 172.10 2wbj s ALA 152 N 1.40 1.60 -0.09 1.54 0.00 -0.74 -4.37 121.76 121.09 2wbj s ALA 152 Ca -0.01 -1.15 0.04 0.00 0.00 0.00 0.00 51.96 50.84 2wbj s ALA 152 Cb -0.13 -0.20 -0.01 0.00 0.00 0.00 0.00 23.12 22.78 2wbj s ALA 152 CO -0.05 0.30 -0.23 0.54 0.00 0.00 0.00 175.76 176.33 2wbj s VAL 153 N -1.17 2.21 -0.19 0.00 0.11 -1.26 -0.91 120.40 119.18 2wbj s VAL 153 Ca 0.04 -0.98 -0.03 0.00 -2.93 0.00 0.00 61.98 58.08 2wbj s VAL 153 Cb -0.10 -1.84 -0.01 0.00 -1.53 0.00 0.00 36.38 32.90 2wbj s VAL 153 CO 0.03 0.56 -0.06 -0.36 -3.33 0.00 0.00 175.10 171.95 2wbj s PHE 154 N 0.20 2.94 0.34 1.54 0.08 0.25 -4.94 117.98 118.38 2wbj s PHE 154 Ca -0.14 -0.79 -0.26 0.00 0.12 0.00 0.00 56.93 55.86 2wbj s PHE 154 Cb -0.17 -2.04 -0.09 0.00 -0.57 0.00 0.00 43.02 40.16 2wbj s PHE 154 CO 0.07 -0.41 1.06 -1.21 -0.10 0.00 0.00 175.22 174.62 2wbj s GLU 155 N 1.11 4.40 0.63 0.44 2.02 -1.26 -2.62 118.70 123.42 2wbj s GLU 155 Ca 0.01 1.61 -0.18 0.00 0.02 0.00 0.00 54.97 56.43 2wbj s GLU 155 Cb -0.15 -2.84 -0.02 0.00 0.10 0.00 0.00 34.13 31.23 2wbj s GLU 155 CO -0.01 0.05 1.24 -1.25 0.02 0.00 0.00 175.26 175.31 2wbj s PRO 156 N -2.01 2.72 0.44 0.39 0.04 -1.26 -4.95 135.00 130.37 2wbj s PRO 156 Ca 0.52 1.91 -0.25 0.00 0.04 0.00 0.00 61.00 63.22 2wbj s PRO 156 Cb -0.26 -1.89 -0.08 0.00 0.04 0.00 0.00 34.50 32.32 2wbj s PRO 156 CO 0.33 -1.42 1.35 0.45 0.04 0.00 0.00 177.00 177.75 2wbj s SER 157 N -1.56 6.03 0.38 6.66 0.15 -1.26 -4.93 113.70 119.16 2wbj s SER 157 Ca 0.79 2.76 0.20 0.00 0.70 0.00 0.00 55.95 60.40 2wbj s SER 157 Cb -0.33 -2.64 0.59 0.00 -1.71 0.00 0.00 66.02 61.93 2wbj s SER 157 CO 0.37 -1.05 1.69 -0.08 1.20 0.00 0.00 173.24 175.36 2wbj h GLU 158 N 2.39 0.00 -0.64 5.44 4.57 -1.99 -2.91 114.58 121.45 2wbj h GLU 158 Ca -0.50 0.00 -0.07 0.00 -1.18 0.00 0.00 59.36 57.61 2wbj h GLU 158 Cb 1.26 0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 29.82 2wbj h GLU 158 CO 0.61 0.34 0.14 0.00 -1.18 0.00 0.00 179.01 178.92 2wbj h ALA 159 N 1.66 0.84 0.19 2.92 0.00 -2.00 -2.80 119.26 120.07 2wbj h ALA 159 Ca -0.00 -0.25 0.01 0.00 0.00 0.00 0.00 54.91 54.67 2wbj h ALA 159 Cb 0.98 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.50 2wbj h ALA 159 CO 0.04 0.57 -0.26 1.49 0.00 0.00 0.00 179.25 181.09 2wbj h GLU 160 N 0.95 -0.49 -0.42 0.00 4.81 -1.83 -2.47 114.58 115.13 2wbj h GLU 160 Ca 0.20 0.03 -0.06 0.00 -0.13 0.00 0.00 59.36 59.40 2wbj h GLU 160 Cb 0.39 0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.86 2wbj h GLU 160 CO 0.01 -0.33 0.02 0.82 -0.73 0.00 0.00 179.01 178.80 2wbj h ILE 161 N -0.51 1.22 -0.31 2.32 2.04 -1.55 0.39 117.51 121.10 2wbj h ILE 161 Ca 0.01 -0.85 -0.06 0.00 1.00 0.00 0.00 64.86 64.96 2wbj h ILE 161 Cb 0.50 0.88 -0.02 0.00 -0.74 0.00 0.00 36.82 37.44 2wbj h ILE 161 CO -0.10 0.30 -0.06 0.28 0.00 0.00 0.00 178.15 178.57 2wbj h SER 162 N 0.62 0.47 0.00 1.72 0.02 -1.37 -2.78 113.55 112.23 2wbj h SER 162 Ca 0.13 -0.10 -0.06 0.00 -0.84 0.00 0.00 61.79 60.92 2wbj h SER 162 Cb 0.36 -0.12 -0.01 0.00 0.14 0.00 0.00 62.40 62.76 2wbj h SER 162 CO 0.01 0.58 -1.31 1.57 -1.14 0.00 0.00 176.83 176.55 2wbj n HIS 163 N -4.25 0.00 0.28 3.45 -0.00 -0.91 -4.61 115.22 109.18 2wbj n HIS 163 Ca 0.01 0.00 0.03 0.00 -0.00 0.00 0.00 57.72 57.76 2wbj n HIS 163 Cb 0.28 -0.20 -0.04 0.00 -0.00 0.00 0.00 29.99 30.03 2wbj n HIS 163 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.34 176.59 2wbj n THR 164 N -1.99 0.00 -3.91 3.57 -2.24 0.13 -5.01 114.28 104.83 2wbj n THR 164 Ca -0.05 -0.33 -0.28 0.00 -2.27 0.00 0.00 64.05 61.12 2wbj n THR 164 Cb 0.46 0.95 0.01 0.00 -2.10 0.00 0.00 70.33 69.65 2wbj n THR 164 CO 0.00 0.00 0.00 1.67 -0.57 0.00 0.00 175.07 176.17 2wbj n GLN 165 N -1.20 -4.67 -3.72 -0.78 -0.06 -1.05 -4.98 117.38 100.92 2wbj n GLN 165 Ca 0.01 0.54 -0.13 0.00 -2.00 0.00 0.00 57.00 55.42 2wbj n GLN 165 Cb 0.11 -5.19 -0.07 0.00 -4.06 0.00 0.00 30.24 21.02 2wbj n GLN 165 CO 0.00 0.00 0.00 0.15 -0.20 0.00 0.00 177.06 177.01 2wbj s LYS 166 N -6.49 0.83 -0.14 3.69 1.02 -1.26 -4.12 119.74 113.26 2wbj s LYS 166 Ca 0.39 -0.37 -0.00 0.00 0.02 0.00 0.00 55.97 56.01 2wbj s LYS 166 Cb -0.20 0.36 0.03 0.00 -0.52 0.00 0.00 37.83 37.50 2wbj s LYS 166 CO 0.85 -0.26 -0.08 0.00 -0.92 0.00 0.00 175.35 174.93 2wbj s ALA 167 N -2.23 1.55 -0.38 5.17 0.00 -0.18 -3.38 121.76 122.31 2wbj s ALA 167 Ca -0.07 -0.77 -0.08 0.00 0.00 0.00 0.00 51.96 51.04 2wbj s ALA 167 Cb -0.02 -1.04 0.05 0.00 0.00 0.00 0.00 23.12 22.12 2wbj s ALA 167 CO -0.01 -0.56 0.19 0.99 0.00 0.00 0.00 175.76 176.37 2wbj s THR 168 N 1.61 4.11 0.24 0.00 2.01 -1.26 -3.52 115.64 118.84 2wbj s THR 168 Ca 0.03 -1.19 -0.30 0.00 0.31 0.00 0.00 61.69 60.55 2wbj s THR 168 Cb -0.14 -3.40 -0.09 0.00 0.01 0.00 0.00 72.50 68.88 2wbj s THR 168 CO -0.09 -0.32 1.04 -0.76 -0.69 0.00 0.00 174.62 173.80 2wbj s LEU 169 N 1.44 4.57 -0.08 4.42 1.43 0.23 -4.01 118.68 126.68 2wbj s LEU 169 Ca 0.01 2.12 0.05 0.00 -1.03 0.00 0.00 54.13 55.28 2wbj s LEU 169 Cb -0.21 -3.62 -0.00 0.00 0.03 0.00 0.00 46.19 42.39 2wbj s LEU 169 CO 0.03 -0.05 -0.23 0.54 0.23 0.00 0.00 176.35 176.87 2wbj s VAL 170 N -0.98 1.97 0.03 -1.59 0.11 -1.08 -1.08 120.40 117.79 2wbj s VAL 170 Ca 0.44 -0.99 0.01 0.00 -2.93 0.00 0.00 61.98 58.52 2wbj s VAL 170 Cb -0.29 -1.69 -0.04 0.00 -1.53 0.00 0.00 36.38 32.83 2wbj s VAL 170 CO 0.37 0.54 0.08 0.00 -3.33 0.00 0.00 175.10 172.76 2wbj s LEU 172 N -1.99 0.92 -0.27 0.00 2.96 -0.09 -1.44 118.68 118.76 2wbj s LEU 172 Ca 0.25 -1.24 -0.14 0.00 -0.22 0.00 0.00 54.13 52.79 2wbj s LEU 172 Cb -0.12 -0.46 -0.04 0.00 0.50 0.00 0.00 46.19 46.06 2wbj s LEU 172 CO 0.17 -0.41 0.31 0.00 -1.32 0.00 0.00 176.35 175.10 2wbj s ALA 173 N 1.98 3.55 -0.07 5.97 0.00 -0.36 -1.79 121.76 131.05 2wbj s ALA 173 Ca 0.08 -0.91 0.04 0.00 0.00 0.00 0.00 51.96 51.16 2wbj s ALA 173 Cb -0.16 -2.63 0.00 0.00 0.00 0.00 0.00 23.12 20.33 2wbj s ALA 173 CO -0.29 -0.62 -0.18 0.99 0.00 0.00 0.00 175.76 175.66 2wbj s THR 174 N 1.96 1.55 -0.46 0.00 2.01 0.28 -0.87 115.64 120.12 2wbj s THR 174 Ca 0.12 -0.74 -0.00 0.00 0.31 0.00 0.00 61.69 61.38 2wbj s THR 174 Cb -0.16 -1.36 0.00 0.00 0.01 0.00 0.00 72.50 70.99 2wbj s THR 174 CO 0.10 0.45 0.38 0.61 -0.69 0.00 0.00 174.62 175.47 2wbj n GLY 175 N 3.50 0.15 3.41 4.40 0.00 0.26 -0.47 105.19 116.45 2wbj n GLY 175 Ca -0.20 -0.26 -0.32 0.00 0.00 0.00 0.00 46.02 45.23 2wbj n GLY 175 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2wbj s PHE 176 N -3.14 2.56 -0.03 1.61 -0.71 -0.77 -4.61 117.98 112.90 2wbj s PHE 176 Ca 0.01 -0.27 0.01 0.00 -1.04 0.00 0.00 56.93 55.63 2wbj s PHE 176 Cb -0.00 -1.58 0.02 0.00 -1.21 0.00 0.00 43.02 40.24 2wbj s PHE 176 CO 0.28 0.09 -0.02 -0.47 -1.34 0.00 0.00 175.22 173.76 2wbj s TYR 177 N -0.67 0.45 0.00 3.49 5.04 -0.12 -0.77 117.35 124.77 2wbj s TYR 177 Ca 0.10 -0.07 0.00 0.00 -2.44 0.00 0.00 57.07 54.66 2wbj s TYR 177 Cb -0.10 -0.45 0.00 0.00 0.35 0.00 0.00 41.96 41.76 2wbj s TYR 177 CO 0.00 -0.12 0.00 -0.35 -1.34 0.00 0.00 175.55 173.74 2wbj n PRO 178 N 3.86 1.60 -0.82 4.97 -0.04 -1.26 -0.80 135.00 142.50 2wbj n PRO 178 Ca -0.24 0.00 -0.10 0.00 -0.04 0.00 0.00 63.50 63.12 2wbj n PRO 178 Cb 0.52 0.00 -0.02 0.00 -0.04 0.00 0.00 33.50 33.96 2wbj n PRO 178 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2wbj n ASP 179 N 0.00 5.82 -3.86 3.54 2.03 -1.26 -4.79 116.55 118.03 2wbj n ASP 179 Ca 0.00 -2.73 -0.31 0.00 0.52 0.00 0.00 54.79 52.27 2wbj n ASP 179 Cb 0.00 -1.17 -0.09 0.00 -0.72 0.00 0.00 41.12 39.15 2wbj n ASP 179 CO 0.00 0.00 0.00 1.41 -1.92 0.00 0.00 177.20 176.69 2wbj n HIS 180 N 1.22 3.60 -4.24 -0.67 8.25 -1.26 -5.03 115.22 117.09 2wbj n HIS 180 Ca 0.22 -4.12 -0.16 0.00 -0.26 0.00 0.00 57.72 53.41 2wbj n HIS 180 Cb 0.60 -0.81 -0.10 0.00 1.12 0.00 0.00 29.99 30.80 2wbj n HIS 180 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 2wbj s VAL 181 N -1.77 1.22 -0.11 1.59 -7.23 -1.26 -2.05 120.40 110.79 2wbj s VAL 181 Ca 0.30 -1.92 -0.04 0.00 -1.81 0.00 0.00 61.98 58.51 2wbj s VAL 181 Cb -0.00 -1.71 0.05 0.00 0.56 0.00 0.00 36.38 35.29 2wbj s VAL 181 CO -0.10 -0.62 0.14 -1.83 -0.31 0.00 0.00 175.10 172.38 2wbj s GLU 182 N -3.32 0.05 0.02 4.82 -1.05 -0.87 -4.99 118.70 113.36 2wbj s GLU 182 Ca 0.13 0.37 -0.18 0.00 -0.15 0.00 0.00 54.97 55.15 2wbj s GLU 182 Cb -0.00 -0.71 -0.06 0.00 -0.44 0.00 0.00 34.13 32.92 2wbj s GLU 182 CO 0.02 -0.43 0.51 -1.17 0.95 0.00 0.00 175.26 175.14 2wbj s LEU 183 N 2.26 4.48 -0.06 1.83 0.20 -1.26 -2.20 118.68 123.92 2wbj s LEU 183 Ca 0.04 1.12 -0.03 0.00 0.69 0.00 0.00 54.13 55.95 2wbj s LEU 183 Cb -0.13 -2.78 0.04 0.00 -0.43 0.00 0.00 46.19 42.88 2wbj s LEU 183 CO -0.07 0.24 0.13 -0.94 -0.29 0.00 0.00 176.35 175.42 2wbj s SER 184 N -0.82 -0.09 0.15 3.68 1.04 -0.20 -5.01 113.70 112.45 2wbj s SER 184 Ca 0.27 0.26 -0.20 0.00 0.48 0.00 0.00 55.95 56.76 2wbj s SER 184 Cb -0.18 0.16 -0.08 0.00 0.10 0.00 0.00 66.02 66.02 2wbj s SER 184 CO 0.16 -0.14 0.67 0.26 0.98 0.00 0.00 173.24 175.17 2wbj s TRP 185 N 1.07 3.75 -0.13 5.02 0.52 -1.26 -1.31 118.94 126.61 2wbj s TRP 185 Ca -0.08 1.37 -0.01 0.00 0.02 0.00 0.00 56.10 57.40 2wbj s TRP 185 Cb -0.11 -2.59 0.03 0.00 -1.15 0.00 0.00 33.47 29.66 2wbj s TRP 185 CO -0.05 0.47 -0.05 -1.58 0.02 0.00 0.00 176.95 175.76 2wbj s TRP 186 N -1.30 1.43 -0.20 -1.98 0.52 0.48 -2.16 118.94 115.74 2wbj s TRP 186 Ca 0.36 -0.81 -0.05 0.00 0.02 0.00 0.00 56.10 55.63 2wbj s TRP 186 Cb -0.19 -1.20 -0.02 0.00 -1.15 0.00 0.00 33.47 30.92 2wbj s TRP 186 CO 0.21 -0.54 -0.01 0.54 0.02 0.00 0.00 176.95 177.18 2wbj s VAL 187 N 1.72 3.80 -1.46 4.03 0.11 0.14 -1.15 120.40 127.60 2wbj s VAL 187 Ca 0.03 -0.36 -0.03 0.00 -2.93 0.00 0.00 61.98 58.69 2wbj s VAL 187 Cb -0.14 -2.72 0.03 0.00 -1.53 0.00 0.00 36.38 32.02 2wbj s VAL 187 CO -0.08 0.43 0.48 0.59 -3.33 0.00 0.00 175.10 173.19 2wbj n ASN 188 N 4.36 -0.86 0.00 3.54 3.02 -0.36 -2.62 115.26 122.35 2wbj n ASN 188 Ca -0.17 -1.00 0.00 0.00 -0.03 0.00 0.00 54.58 53.37 2wbj n ASN 188 Cb 0.52 -3.02 0.00 0.00 -0.61 0.00 0.00 39.78 36.67 2wbj n ASN 188 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2wbj n GLY 189 N -1.90 2.84 3.79 7.41 0.00 -1.26 -5.01 105.19 111.05 2wbj n GLY 189 Ca -0.25 -0.03 -0.33 0.00 0.00 0.00 0.00 46.02 45.42 2wbj n GLY 189 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2wbj s LYS 190 N 0.00 3.07 0.30 1.61 2.20 -1.08 -5.08 119.74 120.76 2wbj s LYS 190 Ca 0.00 -0.49 -0.26 0.00 -0.36 0.00 0.00 55.97 54.85 2wbj s LYS 190 Cb 0.00 -2.86 -0.10 0.00 -1.51 0.00 0.00 37.83 33.36 2wbj s LYS 190 CO 0.00 0.64 0.93 -1.83 -0.36 0.00 0.00 175.35 174.73 2wbj s GLU 191 N -1.81 4.61 -0.01 4.03 -1.05 -1.26 -0.68 118.70 122.53 2wbj s GLU 191 Ca 0.24 1.33 0.08 0.00 -0.15 0.00 0.00 54.97 56.47 2wbj s GLU 191 Cb -0.12 -2.90 -0.02 0.00 -0.44 0.00 0.00 34.13 30.65 2wbj s GLU 191 CO 0.15 0.34 -0.26 0.14 0.95 0.00 0.00 175.26 176.58 2wbj s VAL 192 N -1.52 2.06 -1.99 1.83 -7.23 -0.92 -4.88 120.40 107.76 2wbj s VAL 192 Ca 0.48 -1.14 0.16 0.00 -1.81 0.00 0.00 61.98 59.67 2wbj s VAL 192 Cb -0.20 -1.71 0.17 0.00 0.56 0.00 0.00 36.38 35.20 2wbj s VAL 192 CO 0.25 0.55 1.06 1.41 -0.31 0.00 0.00 175.10 178.07 2wbj n HIS 193 N 2.36 0.08 -0.13 2.82 -0.00 -1.26 -4.46 115.22 114.63 2wbj n HIS 193 Ca -0.16 -0.06 -0.04 0.00 -0.00 0.00 0.00 57.72 57.46 2wbj n HIS 193 Cb 0.51 -0.00 0.16 0.00 -0.00 0.00 0.00 29.99 30.66 2wbj n HIS 193 CO 0.00 0.00 0.00 0.43 -0.00 0.00 0.00 176.34 176.77 2wbj n SER 194 N 0.94 3.51 -1.30 0.41 7.64 -1.26 -3.26 113.62 120.30 2wbj n SER 194 Ca 0.11 -2.69 -0.00 0.00 1.01 0.00 0.00 58.87 57.29 2wbj n SER 194 Cb 0.42 -0.64 0.01 0.00 -1.01 0.00 0.00 64.21 62.99 2wbj n SER 194 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2wbj n GLY 195 N -0.02 -0.62 3.49 0.23 0.00 -1.26 -4.99 105.19 102.02 2wbj n GLY 195 Ca 0.24 -0.01 -0.33 0.00 0.00 0.00 0.00 46.02 45.92 2wbj n GLY 195 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wbj s VAL 196 N 0.01 3.16 -0.19 1.61 1.01 -1.20 -1.79 120.40 123.00 2wbj s VAL 196 Ca 0.01 -0.70 -0.04 0.00 0.00 0.00 0.00 61.98 61.25 2wbj s VAL 196 Cb 0.03 -2.25 0.06 0.00 0.00 0.00 0.00 36.38 34.22 2wbj s VAL 196 CO -0.01 0.58 0.06 -0.55 0.00 0.00 0.00 175.10 175.18 2wbj s SER 197 N -0.78 2.76 -0.21 3.32 0.15 -0.14 -5.01 113.70 113.80 2wbj s SER 197 Ca 0.12 -0.79 -0.10 0.00 0.70 0.00 0.00 55.95 55.88 2wbj s SER 197 Cb -0.11 -0.47 -0.05 0.00 -1.71 0.00 0.00 66.02 63.68 2wbj s SER 197 CO 0.01 -0.33 0.13 -0.89 1.20 0.00 0.00 173.24 173.36 2wbj s THR 198 N 1.96 5.36 0.31 6.45 2.01 -1.26 -0.27 115.64 130.19 2wbj s THR 198 Ca 0.01 0.17 -0.30 0.00 0.31 0.00 0.00 61.69 61.88 2wbj s THR 198 Cb -0.17 -3.46 -0.12 0.00 0.01 0.00 0.00 72.50 68.77 2wbj s THR 198 CO -0.10 0.42 1.58 -0.90 -0.69 0.00 0.00 174.62 174.94 2wbj n ASP 199 N 3.68 3.85 -0.27 3.53 5.75 -1.13 -4.89 116.55 127.08 2wbj n ASP 199 Ca -0.16 1.16 -0.02 0.00 -0.01 0.00 0.00 54.79 55.76 2wbj n ASP 199 Cb 0.52 -1.60 0.15 0.00 -1.03 0.00 0.00 41.12 39.16 2wbj n ASP 199 CO 0.00 0.00 0.00 -0.65 -0.11 0.00 0.00 177.20 176.44 2wbj h PRO 200 N 4.52 1.12 -5.56 0.11 0.11 -1.98 -3.42 132.00 126.91 2wbj h PRO 200 Ca -0.47 -0.13 -0.51 0.00 0.11 0.00 0.00 66.00 65.00 2wbj h PRO 200 Cb 1.23 -0.22 -0.28 0.00 0.11 0.00 0.00 31.00 31.84 2wbj h PRO 200 CO 0.77 0.82 -0.82 -0.65 -0.21 0.00 0.00 178.00 177.91 2wbj s GLN 201 N -5.74 1.23 0.56 1.05 -0.21 -1.26 -5.16 119.66 110.13 2wbj s GLN 201 Ca -0.12 -0.67 -0.09 0.00 0.02 0.00 0.00 55.36 54.50 2wbj s GLN 201 Cb 0.17 -1.23 0.13 0.00 1.00 0.00 0.00 33.01 33.08 2wbj s GLN 201 CO 0.81 0.33 0.65 -0.35 -2.12 0.00 0.00 175.29 174.61 2wbj n PRO 202 N 2.38 -1.20 -4.18 2.91 -0.04 -1.26 -4.98 135.00 128.63 2wbj n PRO 202 Ca -0.16 -1.02 -0.19 0.00 -0.04 0.00 0.00 63.50 62.09 2wbj n PRO 202 Cb 0.54 -0.77 -0.16 0.00 -0.04 0.00 0.00 33.50 33.07 2wbj n PRO 202 CO 0.00 0.00 0.00 -0.48 -0.04 0.00 0.00 175.50 174.98 2wbj s LEU 203 N 0.00 1.42 0.17 1.53 2.34 -0.50 -4.96 118.68 118.69 2wbj s LEU 203 Ca 0.39 -0.12 -0.33 0.00 0.06 0.00 0.00 54.13 54.13 2wbj s LEU 203 Cb -0.02 -0.43 -0.13 0.00 -0.56 0.00 0.00 46.19 45.06 2wbj s LEU 203 CO 0.28 -0.04 1.69 0.29 -1.06 0.00 0.00 176.35 177.51 2wbj n LYS 204 N 3.88 2.54 0.16 1.48 5.02 -1.26 -1.74 118.16 128.25 2wbj n LYS 204 Ca -0.24 0.92 0.04 0.00 -2.02 0.00 0.00 58.31 57.01 2wbj n LYS 204 Cb 0.52 -2.74 0.09 0.00 -0.02 0.00 0.00 35.03 32.87 2wbj n LYS 204 CO 0.00 0.00 0.00 1.05 -0.52 0.00 0.00 177.40 177.93 2wbj h GLU 205 N 6.74 0.00 -2.74 1.97 4.11 -1.54 -3.35 114.58 119.77 2wbj h GLU 205 Ca -0.44 0.00 -0.61 0.00 0.07 0.00 0.00 59.36 58.38 2wbj h GLU 205 Cb 1.22 0.00 -0.41 0.00 0.50 0.00 0.00 28.75 30.07 2wbj h GLU 205 CO 0.93 0.41 -0.71 1.04 0.07 0.00 0.00 179.01 180.75 2wbj n GLN 206 N -3.23 1.39 -0.24 1.06 6.02 -1.26 -5.01 117.38 116.11 2wbj n GLN 206 Ca 0.02 -4.08 0.15 0.00 -0.01 0.00 0.00 57.00 53.07 2wbj n GLN 206 Cb 0.68 -2.06 0.44 0.00 1.02 0.00 0.00 30.24 30.31 2wbj n GLN 206 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 177.06 174.70 2wbj h PRO 207 N 5.27 0.54 -0.93 -1.09 0.11 -1.95 0.27 132.00 134.23 2wbj h PRO 207 Ca 0.18 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 66.26 2wbj h PRO 207 Cb 0.79 -0.12 -0.05 0.00 0.11 0.00 0.00 31.00 31.73 2wbj h PRO 207 CO 0.62 0.36 0.58 0.00 -0.21 0.00 0.00 178.00 179.35 2wbj h ALA 208 N 1.61 1.26 -2.36 -0.75 0.00 -1.95 -3.44 119.26 113.64 2wbj h ALA 208 Ca 0.44 -0.09 -0.54 0.00 0.00 0.00 0.00 54.91 54.72 2wbj h ALA 208 Cb 0.88 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 2wbj h ALA 208 CO -0.19 0.65 0.83 -1.17 0.00 0.00 0.00 179.25 179.37 2wbj s LEU 209 N -10.00 4.31 0.37 0.00 1.98 0.96 -4.90 118.68 111.40 2wbj s LEU 209 Ca -0.13 2.08 0.18 0.00 -2.89 0.00 0.00 54.13 53.37 2wbj s LEU 209 Cb 0.18 -3.56 1.11 0.00 0.66 0.00 0.00 46.19 44.58 2wbj s LEU 209 CO 0.82 -0.71 1.71 -1.13 -1.89 0.00 0.00 176.35 175.14 2wbj h ASN 210 N 7.86 0.47 -1.59 3.68 -0.73 -1.85 -2.64 115.58 120.77 2wbj h ASN 210 Ca -0.37 0.13 -0.45 0.00 1.87 0.00 0.00 56.30 57.48 2wbj h ASN 210 Cb 1.17 0.07 -0.40 0.00 0.27 0.00 0.00 38.32 39.43 2wbj h ASN 210 CO 0.90 -0.02 -1.12 -0.90 -0.37 0.00 0.00 177.43 175.93 2wbj n ASP 211 N -4.80 1.65 -4.62 1.15 5.75 -1.26 -5.11 116.55 109.31 2wbj n ASP 211 Ca 0.29 -3.00 -0.29 0.00 -0.01 0.00 0.00 54.79 51.78 2wbj n ASP 211 Cb 0.98 -0.57 0.19 0.00 -1.03 0.00 0.00 41.12 40.69 2wbj n ASP 211 CO 0.00 0.00 0.00 -0.94 -0.11 0.00 0.00 177.20 176.15 2wbj s SER 212 N -2.87 2.33 0.86 -1.12 1.04 -1.00 -5.04 113.70 107.91 2wbj s SER 212 Ca 0.36 1.65 -0.12 0.00 0.48 0.00 0.00 55.95 58.32 2wbj s SER 212 Cb 0.39 -2.30 0.11 0.00 0.10 0.00 0.00 66.02 64.32 2wbj s SER 212 CO -0.05 -3.38 1.12 -0.13 0.98 0.00 0.00 173.24 171.78 2wbj s ARG 213 N -4.69 1.58 0.25 4.02 0.52 -1.26 -4.88 118.95 114.49 2wbj s ARG 213 Ca 0.66 0.48 0.11 0.00 -0.52 0.00 0.00 55.73 56.46 2wbj s ARG 213 Cb -0.22 -1.87 -0.05 0.00 0.52 0.00 0.00 34.95 33.33 2wbj s ARG 213 CO 0.60 -1.93 -0.18 0.71 0.02 0.00 0.00 175.30 174.52 2wbj s TYR 214 N -3.20 2.37 0.01 -0.53 2.02 0.05 -1.32 117.35 116.74 2wbj s TYR 214 Ca 0.62 -0.32 0.01 0.00 -0.37 0.00 0.00 57.07 57.02 2wbj s TYR 214 Cb -0.15 -1.07 -0.01 0.00 -0.40 0.00 0.00 41.96 40.33 2wbj s TYR 214 CO 0.54 0.64 -0.04 -1.54 -1.57 0.00 0.00 175.55 173.58 2wbj s SER 215 N -3.29 0.49 0.06 2.29 1.04 -0.71 -0.57 113.70 113.02 2wbj s SER 215 Ca 0.28 -0.18 0.04 0.00 0.48 0.00 0.00 55.95 56.57 2wbj s SER 215 Cb -0.06 -0.02 -0.03 0.00 0.10 0.00 0.00 66.02 66.01 2wbj s SER 215 CO 0.14 -0.02 -0.13 -0.22 0.98 0.00 0.00 173.24 174.00 2wbj s LEU 216 N -0.43 2.26 0.23 2.42 1.98 -0.05 -1.41 118.68 123.68 2wbj s LEU 216 Ca -0.02 -0.58 0.06 0.00 -2.89 0.00 0.00 54.13 50.70 2wbj s LEU 216 Cb -0.03 -0.43 -0.05 0.00 0.66 0.00 0.00 46.19 46.33 2wbj s LEU 216 CO -0.00 -0.10 -0.09 -0.94 -1.89 0.00 0.00 176.35 173.34 2wbj s SER 217 N -1.64 2.41 0.02 3.68 1.04 -1.26 -1.22 113.70 116.72 2wbj s SER 217 Ca -0.04 -1.11 -0.11 0.00 0.48 0.00 0.00 55.95 55.17 2wbj s SER 217 Cb -0.10 -0.11 0.01 0.00 0.10 0.00 0.00 66.02 65.93 2wbj s SER 217 CO 0.02 -0.31 0.23 -0.55 0.98 0.00 0.00 173.24 173.61 2wbj s SER 218 N -3.34 -0.06 -0.10 7.02 0.15 -0.52 -2.82 113.70 114.03 2wbj s SER 218 Ca 0.25 -0.17 0.04 0.00 0.70 0.00 0.00 55.95 56.77 2wbj s SER 218 Cb 0.02 0.29 0.00 0.00 -1.71 0.00 0.00 66.02 64.62 2wbj s SER 218 CO 0.08 -0.49 -0.23 0.00 1.20 0.00 0.00 173.24 173.80 2wbj s ARG 219 N -1.93 2.92 -0.27 5.44 3.03 0.63 0.37 118.95 129.13 2wbj s ARG 219 Ca -0.10 -0.83 -0.10 0.00 2.03 0.00 0.00 55.73 56.73 2wbj s ARG 219 Cb -0.04 -2.22 -0.05 0.00 -1.03 0.00 0.00 34.95 31.61 2wbj s ARG 219 CO -0.00 0.15 0.17 -1.17 -1.13 0.00 0.00 175.30 173.31 2wbj s LEU 220 N 0.41 3.91 -0.46 -1.89 0.20 -0.24 -0.96 118.68 119.66 2wbj s LEU 220 Ca -0.18 -0.04 0.03 0.00 0.69 0.00 0.00 54.13 54.63 2wbj s LEU 220 Cb -0.18 -2.08 0.13 0.00 -0.43 0.00 0.00 46.19 43.63 2wbj s LEU 220 CO 0.08 -0.04 0.23 -0.60 -0.29 0.00 0.00 176.35 175.72 2wbj s ARG 221 N 1.71 1.50 0.18 1.98 3.52 -0.74 -0.60 118.95 126.49 2wbj s ARG 221 Ca 0.07 -2.16 0.09 0.00 -0.13 0.00 0.00 55.73 53.60 2wbj s ARG 221 Cb -0.16 -2.68 -0.04 0.00 -1.56 0.00 0.00 34.95 30.51 2wbj s ARG 221 CO 0.09 -1.13 -0.20 0.54 -0.81 0.00 0.00 175.30 173.80 2wbj s VAL 222 N 0.22 1.99 0.07 7.11 0.11 -1.23 -4.76 120.40 123.90 2wbj s VAL 222 Ca 0.17 -1.98 0.00 0.00 -2.93 0.00 0.00 61.98 57.24 2wbj s VAL 222 Cb -0.25 -1.94 0.00 0.00 -1.53 0.00 0.00 36.38 32.66 2wbj s VAL 222 CO -0.01 -0.28 0.00 -1.54 -3.33 0.00 0.00 175.10 169.94 2wbj n SER 223 N 0.22 -0.87 0.00 3.54 3.41 -1.26 -4.28 113.62 114.38 2wbj n SER 223 Ca -0.12 0.18 -0.02 0.00 -0.26 0.00 0.00 58.87 58.65 2wbj n SER 223 Cb 0.57 -0.18 -0.01 0.00 -0.26 0.00 0.00 64.21 64.33 2wbj n SER 223 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2wbj n ALA 224 N -2.00 2.23 0.10 7.33 0.00 -1.26 -1.01 120.51 125.91 2wbj n ALA 224 Ca -0.01 -0.18 0.16 0.00 0.00 0.00 0.00 53.44 53.41 2wbj n ALA 224 Cb 0.07 0.11 0.67 0.00 0.00 0.00 0.00 19.45 20.30 2wbj n ALA 224 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 2wbj h THR 225 N -0.18 0.83 -0.46 0.00 1.35 -1.96 -3.06 112.91 109.44 2wbj h THR 225 Ca 0.00 0.00 -0.09 0.00 -0.55 0.00 0.00 66.41 65.77 2wbj h THR 225 Cb 0.18 0.84 -0.01 0.00 -1.73 0.00 0.00 68.15 67.42 2wbj h THR 225 CO 0.00 0.00 -0.07 0.15 -0.25 0.00 0.00 175.52 175.35 2wbj h PHE 226 N 0.00 0.95 0.00 4.73 3.57 -1.91 -2.09 116.94 122.19 2wbj h PHE 226 Ca 0.16 -0.19 -0.03 0.00 3.53 0.00 0.00 57.97 61.44 2wbj h PHE 226 Cb 0.63 -0.24 -0.00 0.00 2.79 0.00 0.00 35.95 39.13 2wbj h PHE 226 CO 0.00 0.93 -0.14 2.35 -2.23 0.00 0.00 178.31 179.23 2wbj h TRP 227 N 0.70 0.00 -0.56 0.41 2.91 -1.80 -3.28 115.95 114.33 2wbj h TRP 227 Ca 0.12 0.00 -0.14 0.00 1.13 0.00 0.00 58.89 60.00 2wbj h TRP 227 Cb 0.60 0.00 -0.08 0.00 -0.51 0.00 0.00 29.16 29.17 2wbj h TRP 227 CO 0.05 0.14 0.18 1.04 -1.03 0.00 0.00 178.44 178.81 2wbj n GLN 228 N -3.77 3.36 -4.50 2.65 6.02 -0.79 -2.33 117.38 118.01 2wbj n GLN 228 Ca -0.02 -2.43 -0.27 0.00 -0.01 0.00 0.00 57.00 54.27 2wbj n GLN 228 Cb 0.24 -2.04 -0.17 0.00 1.02 0.00 0.00 30.24 29.29 2wbj n GLN 228 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 2wbj s ASN 229 N -0.67 2.21 0.00 1.08 4.22 -1.23 -4.72 114.94 115.83 2wbj s ASN 229 Ca 0.43 -0.38 0.18 0.00 -2.14 0.00 0.00 52.86 50.95 2wbj s ASN 229 Cb 0.34 -0.99 1.06 0.00 1.28 0.00 0.00 41.25 42.95 2wbj s ASN 229 CO 0.11 0.02 1.47 -2.65 -2.04 0.00 0.00 177.10 174.01 2wbj n PRO 230 N 4.08 0.62 0.15 3.55 -0.02 -1.26 -2.36 135.00 139.76 2wbj n PRO 230 Ca -0.20 0.00 0.13 0.00 -2.02 0.00 0.00 63.50 61.41 2wbj n PRO 230 Cb 0.51 -1.45 0.29 0.00 -0.02 0.00 0.00 33.50 32.83 2wbj n PRO 230 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2wbj h ARG 231 N 0.00 0.00 -6.32 -0.52 3.08 -1.96 -3.41 114.38 105.25 2wbj h ARG 231 Ca 0.00 0.00 -0.55 0.00 0.07 0.00 0.00 59.98 59.50 2wbj h ARG 231 Cb 0.00 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.01 2wbj h ARG 231 CO 0.00 0.00 0.13 -0.80 -1.07 0.00 0.00 179.97 178.23 2wbj s ASN 232 N -5.20 7.21 -0.27 7.04 0.01 -1.00 -5.02 114.94 117.72 2wbj s ASN 232 Ca 0.09 1.45 0.03 0.00 -0.71 0.00 0.00 52.86 53.71 2wbj s ASN 232 Cb 0.09 -2.45 0.06 0.00 0.41 0.00 0.00 41.25 39.36 2wbj s ASN 232 CO 0.64 0.09 -0.09 -2.28 -1.51 0.00 0.00 177.10 173.95 2wbj s HIS 233 N -0.41 3.22 -0.14 2.20 5.65 -1.26 -2.69 115.29 121.86 2wbj s HIS 233 Ca 0.36 -2.33 -0.07 0.00 0.25 0.00 0.00 55.06 53.27 2wbj s HIS 233 Cb -0.21 -1.99 -0.04 0.00 -1.18 0.00 0.00 32.58 29.17 2wbj s HIS 233 CO 0.23 -0.88 0.11 -0.06 -0.65 0.00 0.00 174.74 173.49 2wbj s PHE 234 N 1.12 3.45 -0.08 3.88 0.40 -1.00 -1.22 117.98 124.53 2wbj s PHE 234 Ca -0.07 0.38 -0.04 0.00 -0.60 0.00 0.00 56.93 56.61 2wbj s PHE 234 Cb -0.20 -1.97 0.04 0.00 0.51 0.00 0.00 43.02 41.40 2wbj s PHE 234 CO -0.06 0.54 0.18 0.50 0.70 0.00 0.00 175.22 177.08 2wbj s ARG 235 N -0.58 0.11 -0.21 0.44 3.52 -0.30 -0.93 118.95 121.00 2wbj s ARG 235 Ca 0.12 0.46 -0.12 0.00 -0.13 0.00 0.00 55.73 56.06 2wbj s ARG 235 Cb -0.12 -0.17 -0.05 0.00 -1.56 0.00 0.00 34.95 33.05 2wbj s ARG 235 CO 0.02 -0.20 0.22 0.00 -0.81 0.00 0.00 175.30 174.53 2wbj s GLN 237 N 0.81 2.56 -0.28 0.00 0.74 -0.42 -1.27 119.66 121.79 2wbj s GLN 237 Ca 0.11 -0.69 0.03 0.00 0.05 0.00 0.00 55.36 54.86 2wbj s GLN 237 Cb -0.13 -2.09 0.07 0.00 1.10 0.00 0.00 33.01 31.96 2wbj s GLN 237 CO 0.03 -0.00 -0.06 0.08 -0.55 0.00 0.00 175.29 174.79 2wbj s VAL 238 N 0.81 2.25 -0.23 1.34 1.01 -0.35 -1.04 120.40 124.19 2wbj s VAL 238 Ca -0.09 -1.81 -0.29 0.00 0.00 0.00 0.00 61.98 59.78 2wbj s VAL 238 Cb -0.16 -2.41 -0.01 0.00 0.00 0.00 0.00 36.38 33.80 2wbj s VAL 238 CO 0.00 -0.19 1.27 -1.58 0.00 0.00 0.00 175.10 174.61 2wbj s GLN 239 N 1.06 4.09 -0.09 2.72 2.00 -0.94 -1.90 119.66 126.61 2wbj s GLN 239 Ca -0.04 1.46 -0.02 0.00 -2.00 0.00 0.00 55.36 54.77 2wbj s GLN 239 Cb -0.20 -3.81 -0.03 0.00 0.80 0.00 0.00 33.01 29.77 2wbj s GLN 239 CO -0.06 -0.89 -0.01 0.12 -0.50 0.00 0.00 175.29 173.96 2wbj s PHE 240 N 3.87 3.12 -0.37 1.67 5.36 0.45 -2.06 117.98 130.02 2wbj s PHE 240 Ca 0.55 0.14 -0.03 0.00 -0.96 0.00 0.00 56.93 56.63 2wbj s PHE 240 Cb -0.19 -1.79 0.09 0.00 -0.34 0.00 0.00 43.02 40.79 2wbj s PHE 240 CO 0.18 0.42 0.14 0.71 -1.46 0.00 0.00 175.22 175.20 2wbj s TYR 241 N -0.79 3.48 0.00 10.12 2.02 -0.87 -1.59 117.35 129.72 2wbj s TYR 241 Ca 0.12 -2.21 0.00 0.00 -0.37 0.00 0.00 57.07 54.61 2wbj s TYR 241 Cb -0.11 -2.85 0.00 0.00 -0.40 0.00 0.00 41.96 38.60 2wbj s TYR 241 CO 0.02 -0.91 0.00 0.41 -1.57 0.00 0.00 175.55 173.50 2wbj n GLY 242 N 4.61 5.17 3.77 0.71 0.00 -1.26 -4.78 105.19 113.41 2wbj n GLY 242 Ca -0.06 -1.64 -0.37 0.00 0.00 0.00 0.00 46.02 43.95 2wbj n GLY 242 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wbj s LEU 243 N 0.00 4.11 0.73 0.99 1.43 0.16 -4.31 118.68 121.78 2wbj s LEU 243 Ca 0.00 2.24 -0.12 0.00 -1.03 0.00 0.00 54.13 55.23 2wbj s LEU 243 Cb 0.00 -4.15 0.03 0.00 0.03 0.00 0.00 46.19 42.10 2wbj s LEU 243 CO 0.00 -0.72 1.11 -0.55 0.23 0.00 0.00 176.35 176.43 2wbj s SER 244 N -1.34 5.18 0.51 2.29 0.15 -1.26 -3.50 113.70 115.72 2wbj s SER 244 Ca 0.60 1.08 0.34 0.00 0.70 0.00 0.00 55.95 58.67 2wbj s SER 244 Cb -0.27 -1.82 1.58 0.00 -1.71 0.00 0.00 66.02 63.80 2wbj s SER 244 CO 0.34 -1.51 2.02 1.05 1.20 0.00 0.00 173.24 176.34 2wbj h GLU 245 N -0.77 0.00 -0.01 5.44 9.09 -2.01 -2.40 114.58 123.91 2wbj h GLU 245 Ca -0.45 0.00 0.00 0.00 0.05 0.00 0.00 59.36 58.96 2wbj h GLU 245 Cb 1.27 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.37 2wbj h GLU 245 CO 0.64 0.00 -0.10 -1.71 0.05 0.00 0.00 179.01 177.89 2wbj n ASN 246 N -2.87 1.20 -4.83 3.06 5.15 -1.26 -4.92 115.26 110.80 2wbj n ASN 246 Ca -0.00 -1.20 -0.33 0.00 -0.60 0.00 0.00 54.58 52.45 2wbj n ASN 246 Cb 0.20 0.04 -0.06 0.00 -0.53 0.00 0.00 39.78 39.43 2wbj n ASN 246 CO 0.00 0.00 0.00 -1.81 1.40 0.00 0.00 177.26 176.85 2wbj s ASP 247 N -2.21 6.88 0.04 1.20 1.11 -0.91 -5.04 116.67 117.75 2wbj s ASP 247 Ca 0.33 1.62 -0.30 0.00 0.18 0.00 0.00 52.55 54.38 2wbj s ASP 247 Cb 0.20 -2.51 -0.05 0.00 1.07 0.00 0.00 42.92 41.63 2wbj s ASP 247 CO 0.41 -0.37 1.13 -0.70 1.18 0.00 0.00 175.17 176.83 2wbj s GLU 248 N -3.27 4.47 -0.09 8.23 2.56 -1.26 -4.98 118.70 124.36 2wbj s GLU 248 Ca 0.61 1.67 -0.04 0.00 0.00 0.00 0.00 54.97 57.20 2wbj s GLU 248 Cb -0.09 -3.38 0.05 0.00 2.00 0.00 0.00 34.13 32.70 2wbj s GLU 248 CO 0.16 -0.20 0.20 -0.46 -0.56 0.00 0.00 175.26 174.40 2wbj s TRP 249 N 1.05 -0.25 0.00 5.30 -0.11 -1.26 -5.02 118.94 118.64 2wbj s TRP 249 Ca 0.57 0.66 0.00 0.00 1.22 0.00 0.00 56.10 58.55 2wbj s TRP 249 Cb -0.27 -0.05 0.00 0.00 -1.50 0.00 0.00 33.47 31.65 2wbj s TRP 249 CO 0.29 -0.22 0.21 0.25 -4.62 0.00 0.00 176.95 172.86 2wbj n THR 250 N 4.46 0.00 -1.40 5.86 -2.24 -1.26 -5.08 114.28 114.62 2wbj n THR 250 Ca -0.22 -0.24 -0.30 0.00 -2.27 0.00 0.00 64.05 61.02 2wbj n THR 250 Cb 0.52 1.46 0.10 0.00 -2.10 0.00 0.00 70.33 70.31 2wbj n THR 250 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 2wbj s GLN 251 N -0.05 1.87 -0.00 -0.78 1.11 -1.26 -5.00 119.66 115.55 2wbj s GLN 251 Ca 0.00 0.79 -0.25 0.00 0.01 0.00 0.00 55.36 55.91 2wbj s GLN 251 Cb 0.00 -1.88 -0.19 0.00 -1.01 0.00 0.00 33.01 29.93 2wbj s GLN 251 CO 0.00 -1.81 1.35 -0.44 0.01 0.00 0.00 175.29 174.40 2wbj h ASP 252 N -1.23 0.01 -4.13 5.90 5.19 -2.06 -3.46 116.42 116.65 2wbj h ASP 252 Ca -0.47 -0.41 -0.50 0.00 -0.62 0.00 0.00 57.03 55.03 2wbj h ASP 252 Cb 1.26 -0.00 0.18 0.00 0.18 0.00 0.00 39.33 40.95 2wbj h ASP 252 CO 0.56 0.42 0.22 0.00 -3.12 0.00 0.00 179.24 177.33 2wbj s ARG 253 N -4.57 1.09 0.25 3.56 1.70 -1.26 -4.89 118.95 114.83 2wbj s ARG 253 Ca -0.15 1.28 -0.31 0.00 -0.47 0.00 0.00 55.73 56.07 2wbj s ARG 253 Cb 0.02 -1.76 -0.13 0.00 -0.57 0.00 0.00 34.95 32.52 2wbj s ARG 253 CO 0.67 -2.49 1.52 0.00 -1.08 0.00 0.00 175.30 173.92 2wbj n ALA 254 N -4.11 1.80 -1.64 7.88 0.00 -1.26 -4.91 120.51 118.27 2wbj n ALA 254 Ca 0.09 0.40 -0.50 0.00 0.00 0.00 0.00 53.44 53.43 2wbj n ALA 254 Cb 0.53 -2.37 -0.05 0.00 0.00 0.00 0.00 19.45 17.55 2wbj n ALA 254 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2wbj n LYS 255 N 2.38 1.63 -1.15 0.00 4.81 -1.26 -4.86 118.16 119.71 2wbj n LYS 255 Ca 0.11 0.59 -0.34 0.00 -0.87 0.00 0.00 58.31 57.80 2wbj n LYS 255 Cb 0.33 -2.31 -0.03 0.00 0.02 0.00 0.00 35.03 33.05 2wbj n LYS 255 CO 0.00 0.00 0.00 -2.30 1.17 0.00 0.00 177.40 176.27 2wbj n PRO 256 N 3.72 2.52 -1.89 1.64 -0.02 -1.26 -4.94 135.00 134.77 2wbj n PRO 256 Ca 0.19 -1.93 -0.36 0.00 -2.02 0.00 0.00 63.50 59.39 2wbj n PRO 256 Cb 0.23 -2.79 0.05 0.00 -0.02 0.00 0.00 33.50 30.97 2wbj n PRO 256 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2wbj s VAL 257 N 3.38 2.52 0.08 -1.45 1.01 -1.26 -0.67 120.40 124.01 2wbj s VAL 257 Ca 0.52 0.31 -0.33 0.00 0.00 0.00 0.00 61.98 62.48 2wbj s VAL 257 Cb 0.14 -3.07 -0.12 0.00 0.00 0.00 0.00 36.38 33.32 2wbj s VAL 257 CO -0.02 -0.08 1.77 1.07 0.00 0.00 0.00 175.10 177.84 2wbj n THR 258 N -1.82 0.31 -3.93 3.92 5.66 -1.23 -4.45 114.28 112.75 2wbj n THR 258 Ca 0.14 -0.06 -0.08 0.00 -3.05 0.00 0.00 64.05 61.00 2wbj n THR 258 Cb 0.50 -1.87 -0.03 0.00 -1.55 0.00 0.00 70.33 67.38 2wbj n THR 258 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2wbj s GLN 259 N 2.53 1.73 -0.31 1.09 -2.07 -0.62 -4.88 119.66 117.13 2wbj s GLN 259 Ca 0.84 -1.18 -0.03 0.00 -1.82 0.00 0.00 55.36 53.17 2wbj s GLN 259 Cb -0.60 0.54 0.04 0.00 -1.09 0.00 0.00 33.01 31.90 2wbj s GLN 259 CO 0.41 -0.76 0.03 0.42 -1.32 0.00 0.00 175.29 174.07 2wbj s ILE 260 N -3.78 3.24 -0.16 3.63 1.01 -1.26 -0.41 121.20 123.48 2wbj s ILE 260 Ca 0.17 -1.26 -0.07 0.00 0.00 0.00 0.00 60.65 59.50 2wbj s ILE 260 Cb -0.03 -2.83 -0.04 0.00 0.01 0.00 0.00 42.46 39.57 2wbj s ILE 260 CO 0.09 -0.09 0.07 0.68 0.00 0.00 0.00 174.94 175.69 2wbj s VAL 261 N 1.31 4.91 0.04 2.92 -7.23 -0.80 -4.94 120.40 116.62 2wbj s VAL 261 Ca -0.04 0.00 0.03 0.00 -1.81 0.00 0.00 61.98 60.16 2wbj s VAL 261 Cb -0.19 -3.18 -0.02 0.00 0.56 0.00 0.00 36.38 33.54 2wbj s VAL 261 CO -0.00 0.51 -0.09 -0.94 -0.31 0.00 0.00 175.10 174.28 2wbj s SER 262 N -0.10 0.96 0.08 4.85 1.04 -1.26 -1.21 113.70 118.05 2wbj s SER 262 Ca 0.07 -0.54 0.06 0.00 0.48 0.00 0.00 55.95 56.02 2wbj s SER 262 Cb -0.12 0.02 -0.03 0.00 0.10 0.00 0.00 66.02 65.99 2wbj s SER 262 CO 0.01 -0.18 -0.17 0.00 0.98 0.00 0.00 173.24 173.88 2wbj s ALA 263 N -1.33 1.47 0.10 5.32 0.00 -0.40 -4.91 121.76 122.02 2wbj s ALA 263 Ca -0.09 -1.08 0.06 0.00 0.00 0.00 0.00 51.96 50.86 2wbj s ALA 263 Cb -0.10 -0.19 -0.03 0.00 0.00 0.00 0.00 23.12 22.80 2wbj s ALA 263 CO 0.01 0.27 -0.15 -1.83 0.00 0.00 0.00 175.76 174.05 2wbj s GLU 264 N -1.67 0.97 0.26 0.00 -1.05 -1.26 -0.68 118.70 115.26 2wbj s GLU 264 Ca 0.03 -1.11 0.01 0.00 -0.15 0.00 0.00 54.97 53.74 2wbj s GLU 264 Cb -0.10 -0.97 -0.05 0.00 -0.44 0.00 0.00 34.13 32.57 2wbj s GLU 264 CO 0.03 0.21 0.11 0.00 0.95 0.00 0.00 175.26 176.56 2wbj s ALA 265 N -1.60 1.67 0.04 -0.84 0.00 -0.11 -4.86 121.76 116.06 2wbj s ALA 265 Ca 0.04 -1.82 0.02 0.00 0.00 0.00 0.00 51.96 50.20 2wbj s ALA 265 Cb -0.08 1.13 -0.03 0.00 0.00 0.00 0.00 23.12 24.14 2wbj s ALA 265 CO 0.03 -0.49 -0.07 -1.58 0.00 0.00 0.00 175.76 173.65 2wbj s TRP 266 N -3.80 0.63 0.63 0.00 0.52 -1.26 -2.37 118.94 113.28 2wbj s TRP 266 Ca 0.38 -0.56 -0.18 0.00 0.02 0.00 0.00 56.10 55.75 2wbj s TRP 266 Cb 0.07 -0.38 -0.02 0.00 -1.15 0.00 0.00 33.47 31.99 2wbj s TRP 266 CO 0.14 -0.12 1.19 0.41 0.02 0.00 0.00 176.95 178.60 2wbj n GLY 267 N 1.29 0.29 0.14 0.98 0.00 -1.09 -5.01 105.19 101.79 2wbj n GLY 267 Ca -0.22 -0.14 0.02 0.00 0.00 0.00 0.00 46.02 45.68 2wbj n GLY 267 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86