#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2wbg s LYS 4 N 0.00 0.62 -0.15 7.34 1.02 -0.74 -5.01 119.74 122.82 2wbg s LYS 4 Ca 0.00 -1.06 -0.12 0.00 0.02 0.00 0.00 55.97 54.80 2wbg s LYS 4 Cb 0.00 -1.73 -0.05 0.00 -0.52 0.00 0.00 37.83 35.53 2wbg s LYS 4 CO 0.00 -1.04 0.25 0.21 -0.92 0.00 0.00 175.35 173.85 2wbg s LYS 5 N 1.54 4.13 0.76 1.68 2.47 -1.26 -1.51 119.74 127.54 2wbg s LYS 5 Ca 0.11 0.03 -0.10 0.00 -1.56 0.00 0.00 55.97 54.45 2wbg s LYS 5 Cb -0.18 -3.38 0.06 0.00 -1.46 0.00 0.00 37.83 32.86 2wbg s LYS 5 CO -0.23 0.35 1.11 -0.06 0.16 0.00 0.00 175.35 176.68 2wbg s PHE 6 N 0.16 3.03 0.75 4.03 0.40 0.07 -5.00 117.98 121.42 2wbg s PHE 6 Ca 0.15 0.74 -0.15 0.00 -0.60 0.00 0.00 56.93 57.08 2wbg s PHE 6 Cb -0.13 -3.31 0.05 0.00 0.51 0.00 0.00 43.02 40.14 2wbg s PHE 6 CO 0.03 -1.53 1.21 -2.14 0.70 0.00 0.00 175.22 173.49 2wbg s PRO 7 N -5.44 2.00 0.37 0.24 0.02 -1.26 -4.91 135.00 126.03 2wbg s PRO 7 Ca 0.60 1.76 -0.28 0.00 0.02 0.00 0.00 61.00 63.10 2wbg s PRO 7 Cb -0.11 -1.82 -0.11 0.00 0.02 0.00 0.00 34.50 32.48 2wbg s PRO 7 CO 0.48 -1.94 1.47 -0.85 -0.33 0.00 0.00 177.00 175.84 2wbg n GLU 8 N -2.87 2.60 -0.97 5.54 -0.00 -1.26 -1.63 120.64 122.05 2wbg n GLU 8 Ca 0.13 0.91 0.00 0.00 -0.00 0.00 0.00 57.16 58.21 2wbg n GLU 8 Cb 0.50 -2.63 0.00 0.00 -0.00 0.00 0.00 31.44 29.32 2wbg n GLU 8 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2wbg n GLY 9 N 0.64 0.90 3.64 -1.84 0.00 -1.26 -5.00 105.19 102.27 2wbg n GLY 9 Ca 0.02 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.60 2wbg n GLY 9 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2wbg n PHE 10 N -2.06 1.79 -3.79 1.61 7.35 -0.65 -4.94 117.46 116.77 2wbg n PHE 10 Ca 0.00 0.59 -0.36 0.00 -0.76 0.00 0.00 57.45 56.92 2wbg n PHE 10 Cb 0.00 -2.35 -0.11 0.00 0.35 0.00 0.00 39.48 37.37 2wbg n PHE 10 CO 0.00 0.00 0.00 -1.17 -0.76 0.00 0.00 176.76 174.83 2wbg s LEU 11 N -0.08 3.66 -0.22 -2.13 2.96 -0.68 -4.99 118.68 117.20 2wbg s LEU 11 Ca 0.61 -0.09 -0.07 0.00 -0.22 0.00 0.00 54.13 54.36 2wbg s LEU 11 Cb -0.66 -1.98 -0.03 0.00 0.50 0.00 0.00 46.19 44.02 2wbg s LEU 11 CO 0.58 0.02 0.07 0.26 -1.32 0.00 0.00 176.35 175.96 2wbg s TRP 12 N 1.32 3.15 0.29 5.38 0.52 -1.26 -1.10 118.94 127.24 2wbg s TRP 12 Ca 0.05 -0.19 0.03 0.00 0.02 0.00 0.00 56.10 56.02 2wbg s TRP 12 Cb -0.15 -2.18 -0.04 0.00 -1.15 0.00 0.00 33.47 29.96 2wbg s TRP 12 CO 0.04 -0.14 0.17 0.20 0.02 0.00 0.00 176.95 177.25 2wbg s GLY 13 N 1.12 1.99 0.15 0.98 0.00 -0.32 -1.45 107.32 109.78 2wbg s GLY 13 Ca 0.04 -1.80 0.05 0.00 0.00 0.00 0.00 44.72 43.02 2wbg s GLY 13 CO 0.03 -1.53 -0.12 -1.34 0.00 0.00 0.00 173.10 170.14 2wbg s VAL 14 N -3.68 1.29 0.08 1.40 -7.23 -0.97 -1.28 120.40 110.01 2wbg s VAL 14 Ca 0.37 -1.96 0.06 0.00 -1.81 0.00 0.00 61.98 58.65 2wbg s VAL 14 Cb 0.05 -1.75 -0.03 0.00 0.56 0.00 0.00 36.38 35.21 2wbg s VAL 14 CO 0.18 -0.62 -0.17 0.00 -0.31 0.00 0.00 175.10 174.19 2wbg s ALA 15 N -2.87 1.40 0.33 1.32 0.00 0.27 -0.98 121.76 121.22 2wbg s ALA 15 Ca 0.15 -1.08 0.01 0.00 0.00 0.00 0.00 51.96 51.04 2wbg s ALA 15 Cb -0.00 -0.16 -0.01 0.00 0.00 0.00 0.00 23.12 22.95 2wbg s ALA 15 CO 0.02 0.24 0.38 0.95 0.00 0.00 0.00 175.76 177.35 2wbg s THR 16 N -1.20 0.00 0.03 0.00 -4.23 0.08 -2.54 115.64 107.78 2wbg s THR 16 Ca 0.01 -1.78 0.01 0.00 -1.18 0.00 0.00 61.69 58.76 2wbg s THR 16 Cb -0.10 -2.57 -0.02 0.00 1.34 0.00 0.00 72.50 71.15 2wbg s THR 16 CO 0.03 0.00 -0.06 0.00 -0.54 0.00 0.00 174.62 174.05 2wbg s ALA 17 N -3.29 0.41 0.11 3.99 0.00 -1.26 -3.75 121.76 117.96 2wbg s ALA 17 Ca 0.35 -0.57 -0.29 0.00 0.00 0.00 0.00 51.96 51.45 2wbg s ALA 17 Cb 0.01 0.03 -0.10 0.00 0.00 0.00 0.00 23.12 23.06 2wbg s ALA 17 CO 0.22 -0.02 1.63 0.66 0.00 0.00 0.00 175.76 178.25 2wbg h SER 18 N 4.94 -0.83 0.23 0.00 4.64 -1.89 -2.32 113.55 118.32 2wbg h SER 18 Ca -0.33 0.09 -0.05 0.00 -0.47 0.00 0.00 61.79 61.03 2wbg h SER 18 Cb 1.20 0.30 -0.01 0.00 -0.31 0.00 0.00 62.40 63.58 2wbg h SER 18 CO 0.43 -0.40 -0.23 0.22 -0.87 0.00 0.00 176.83 175.97 2wbg h TYR 19 N -0.57 0.01 0.00 4.77 3.20 -1.93 -0.51 116.97 121.94 2wbg h TYR 19 Ca 0.01 -0.00 -0.05 0.00 3.14 0.00 0.00 58.73 61.83 2wbg h TYR 19 Cb 0.56 -0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.82 2wbg h TYR 19 CO -0.23 0.24 -0.23 1.96 -1.64 0.00 0.00 178.16 178.26 2wbg h GLN 20 N 0.01 0.00 0.00 1.82 4.20 -1.69 -3.38 115.11 116.07 2wbg h GLN 20 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2wbg h GLN 20 Cb 0.42 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.20 2wbg h GLN 20 CO 0.03 0.23 -0.92 0.44 -0.67 0.00 0.00 178.83 177.94 2wbg n ILE 21 N -3.30 0.00 -0.01 2.54 -5.35 -0.95 -1.78 119.36 110.51 2wbg n ILE 21 Ca 0.01 0.00 -0.16 0.00 -0.27 0.00 0.00 62.75 62.33 2wbg n ILE 21 Cb 0.49 0.08 -0.12 0.00 -1.74 0.00 0.00 39.64 38.35 2wbg n ILE 21 CO 0.00 0.00 0.00 -0.33 -1.76 0.00 0.00 176.55 174.46 2wbg h GLU 22 N 0.00 0.25 0.00 6.28 5.08 -1.28 -1.88 114.58 123.03 2wbg h GLU 22 Ca 0.00 -0.29 0.07 0.00 -1.00 0.00 0.00 59.36 58.15 2wbg h GLU 22 Cb 0.25 0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.57 2wbg h GLU 22 CO 0.00 1.02 -0.10 0.41 -1.00 0.00 0.00 179.01 179.34 2wbg n GLY 23 N 1.18 -1.44 3.82 -3.84 0.00 -1.18 -1.34 105.19 102.39 2wbg n GLY 23 Ca -0.10 -1.15 -0.23 0.00 0.00 0.00 0.00 46.02 44.54 2wbg n GLY 23 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2wbg n SER 24 N -2.30 -0.92 0.31 1.61 7.64 0.69 -4.73 113.62 115.92 2wbg n SER 24 Ca 0.00 -0.90 0.20 0.00 1.01 0.00 0.00 58.87 59.18 2wbg n SER 24 Cb 0.13 -3.63 0.93 0.00 -1.01 0.00 0.00 64.21 60.62 2wbg n SER 24 CO 0.00 0.00 0.00 1.55 -3.01 0.00 0.00 175.04 173.58 2wbg h PRO 25 N -1.86 0.00 -0.25 1.43 0.13 -1.81 -2.64 132.00 127.00 2wbg h PRO 25 Ca -0.62 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.51 2wbg h PRO 25 Cb 1.37 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.50 2wbg h PRO 25 CO 0.59 0.00 0.00 1.28 -0.23 0.00 0.00 178.00 179.65 2wbg n LEU 26 N -3.09 3.01 -4.76 1.56 4.77 -1.26 -4.67 117.00 112.55 2wbg n LEU 26 Ca -0.01 -2.33 -0.38 0.00 -0.03 0.00 0.00 56.01 53.27 2wbg n LEU 26 Cb 0.20 -0.29 0.01 0.00 -2.33 0.00 0.00 43.42 41.01 2wbg n LEU 26 CO 0.24 0.68 0.89 0.00 -1.33 0.00 0.00 177.39 177.87 2wbg s ALA 27 N -1.59 2.92 -1.43 -1.18 0.00 -1.00 -4.14 121.76 115.35 2wbg s ALA 27 Ca 0.25 1.08 -0.08 0.00 0.00 0.00 0.00 51.96 53.21 2wbg s ALA 27 Cb 0.17 -3.45 0.05 0.00 0.00 0.00 0.00 23.12 19.89 2wbg s ALA 27 CO 0.11 -0.91 0.91 -0.25 0.00 0.00 0.00 175.76 175.62 2wbg n ASP 28 N -0.68 -3.65 0.00 0.00 8.00 -1.26 -2.26 116.55 116.69 2wbg n ASP 28 Ca 0.08 -0.76 0.00 0.00 0.71 0.00 0.00 54.79 54.82 2wbg n ASP 28 Cb 0.47 -4.12 0.00 0.00 -0.02 0.00 0.00 41.12 37.45 2wbg n ASP 28 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2wbg n GLY 29 N -1.67 0.91 3.72 0.44 0.00 -1.26 -4.65 105.19 102.69 2wbg n GLY 29 Ca -0.09 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.53 2wbg n GLY 29 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wbg n ALA 30 N 0.18 1.53 -2.11 4.61 0.00 -0.96 -4.73 120.51 119.02 2wbg n ALA 30 Ca 0.00 0.25 -0.29 0.00 0.00 0.00 0.00 53.44 53.40 2wbg n ALA 30 Cb 0.00 -2.31 0.00 0.00 0.00 0.00 0.00 19.45 17.14 2wbg n ALA 30 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 2wbg s GLY 31 N -0.54 1.58 0.54 0.00 0.00 -0.08 -4.75 107.32 104.07 2wbg s GLY 31 Ca 0.62 -0.33 -0.22 0.00 0.00 0.00 0.00 44.72 44.79 2wbg s GLY 31 CO 0.57 -0.12 1.33 1.06 0.00 0.00 0.00 173.10 175.94 2wbg s MET 32 N -4.86 3.18 0.45 2.90 -1.94 -1.26 -4.65 119.30 113.12 2wbg s MET 32 Ca 0.51 2.17 0.08 0.00 -1.71 0.00 0.00 55.69 56.73 2wbg s MET 32 Cb -0.11 -2.25 0.01 0.00 2.01 0.00 0.00 34.83 34.50 2wbg s MET 32 CO 0.47 -1.14 0.53 -1.54 -0.01 0.00 0.00 175.02 173.34 2wbg s SER 33 N -1.03 5.32 0.54 3.03 1.04 -1.26 -0.68 113.70 120.66 2wbg s SER 33 Ca 0.71 -0.64 0.32 0.00 0.48 0.00 0.00 55.95 56.83 2wbg s SER 33 Cb -0.39 -0.43 1.40 0.00 0.10 0.00 0.00 66.02 66.70 2wbg s SER 33 CO 0.46 -0.83 2.00 0.16 0.98 0.00 0.00 173.24 176.01 2wbg h ILE 34 N 0.71 0.15 0.00 -1.02 3.07 -0.92 -2.71 117.51 116.79 2wbg h ILE 34 Ca -0.39 -0.57 -0.17 0.00 1.55 0.00 0.00 64.86 65.27 2wbg h ILE 34 Cb 1.28 1.49 -0.02 0.00 -0.27 0.00 0.00 36.82 39.30 2wbg h ILE 34 CO 0.49 0.05 -0.83 -0.50 -1.05 0.00 0.00 178.15 176.31 2wbg h TRP 35 N 0.00 0.00 -0.03 0.16 4.06 -1.83 -0.26 115.95 118.05 2wbg h TRP 35 Ca -0.00 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.95 2wbg h TRP 35 Cb 0.49 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.65 2wbg h TRP 35 CO 0.00 0.83 0.02 1.25 -3.56 0.00 0.00 178.44 176.98 2wbg h HIS 36 N 0.00 0.03 -0.13 0.49 2.76 -1.89 -0.66 115.15 115.75 2wbg h HIS 36 Ca -0.01 0.00 -0.22 0.00 -2.20 0.00 0.00 60.37 57.94 2wbg h HIS 36 Cb 1.57 -0.01 0.01 0.00 1.55 0.00 0.00 27.41 30.53 2wbg h HIS 36 CO 0.00 0.04 -0.80 1.79 -1.30 0.00 0.00 177.93 177.65 2wbg h THR 37 N 0.02 1.29 -0.19 6.26 1.35 -1.49 -1.43 112.91 118.72 2wbg h THR 37 Ca 0.01 -2.02 -0.01 0.00 -0.55 0.00 0.00 66.41 63.84 2wbg h THR 37 Cb 0.01 2.04 -0.01 0.00 -1.73 0.00 0.00 68.15 68.46 2wbg h THR 37 CO -0.00 0.64 0.07 0.15 -0.25 0.00 0.00 175.52 176.13 2wbg h PHE 38 N 0.50 0.29 0.00 4.73 3.57 -1.09 -2.74 116.94 122.21 2wbg h PHE 38 Ca -0.06 -0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.36 2wbg h PHE 38 Cb 1.43 -0.09 -0.01 0.00 2.79 0.00 0.00 35.95 40.07 2wbg h PHE 38 CO 0.08 0.35 -0.27 0.66 -2.23 0.00 0.00 178.31 176.90 2wbg h SER 39 N 0.15 0.00 -0.10 0.41 4.64 -1.06 -2.31 113.55 115.29 2wbg h SER 39 Ca 0.06 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.38 2wbg h SER 39 Cb 0.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.27 2wbg h SER 39 CO -0.00 0.27 0.00 1.41 -0.87 0.00 0.00 176.83 177.64 2wbg n HIS 40 N -3.46 0.13 -3.41 4.77 8.25 -0.54 -4.73 115.22 116.23 2wbg n HIS 40 Ca -0.00 -0.06 -0.38 0.00 -0.26 0.00 0.00 57.72 57.01 2wbg n HIS 40 Cb 0.45 0.00 -0.08 0.00 1.12 0.00 0.00 29.99 31.47 2wbg n HIS 40 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 2wbg s THR 41 N -1.87 5.20 0.28 1.59 2.01 -0.87 -5.05 115.64 116.93 2wbg s THR 41 Ca 0.24 0.62 -0.30 0.00 0.31 0.00 0.00 61.69 62.55 2wbg s THR 41 Cb 0.12 -3.70 -0.13 0.00 0.01 0.00 0.00 72.50 68.80 2wbg s THR 41 CO 0.18 0.22 1.38 -2.65 -0.69 0.00 0.00 174.62 173.06 2wbg n PRO 42 N 4.84 2.14 0.00 4.92 -0.02 -1.26 -2.81 135.00 142.81 2wbg n PRO 42 Ca -0.09 0.76 0.00 0.00 -2.02 0.00 0.00 63.50 62.15 2wbg n PRO 42 Cb 0.51 -2.40 0.00 0.00 -0.02 0.00 0.00 33.50 31.59 2wbg n PRO 42 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2wbg n GLY 43 N 1.64 2.65 0.09 -1.23 0.00 -1.26 -4.94 105.19 102.15 2wbg n GLY 43 Ca 0.09 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 46.07 2wbg n GLY 43 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2wbg h ASN 44 N 0.00 0.00 -3.83 1.61 2.35 -1.80 -3.46 115.58 110.45 2wbg h ASN 44 Ca 0.00 0.00 -0.45 0.00 -0.55 0.00 0.00 56.30 55.30 2wbg h ASN 44 Cb 0.00 0.00 -0.31 0.00 0.05 0.00 0.00 38.32 38.06 2wbg h ASN 44 CO 0.00 0.81 -0.80 -0.69 -1.65 0.00 0.00 177.43 175.10 2wbg s VAL 45 N -2.79 0.90 0.26 2.81 1.01 -1.26 -4.76 120.40 116.57 2wbg s VAL 45 Ca 0.01 -0.43 -0.30 0.00 0.00 0.00 0.00 61.98 61.26 2wbg s VAL 45 Cb 0.09 -0.80 -0.14 0.00 0.00 0.00 0.00 36.38 35.53 2wbg s VAL 45 CO 0.80 0.28 1.22 0.29 0.00 0.00 0.00 175.10 177.68 2wbg n LYS 46 N 3.26 1.67 -1.06 2.72 5.02 0.12 -1.76 118.16 128.13 2wbg n LYS 46 Ca -0.18 0.59 -0.02 0.00 -2.02 0.00 0.00 58.31 56.68 2wbg n LYS 46 Cb 0.54 -2.12 -0.01 0.00 -0.02 0.00 0.00 35.03 33.42 2wbg n LYS 46 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 2wbg n ASN 47 N 1.61 -5.66 -0.90 4.39 3.02 -1.26 -2.28 115.26 114.18 2wbg n ASN 47 Ca 0.10 0.05 -0.11 0.00 -0.03 0.00 0.00 54.58 54.60 2wbg n ASN 47 Cb 0.31 -3.36 -0.04 0.00 -0.61 0.00 0.00 39.78 36.08 2wbg n ASN 47 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2wbg n GLY 48 N 0.47 1.11 3.75 7.41 0.00 -0.72 -4.98 105.19 112.22 2wbg n GLY 48 Ca -0.02 -0.51 -0.36 0.00 0.00 0.00 0.00 46.02 45.13 2wbg n GLY 48 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2wbg s ASP 49 N -2.85 5.15 0.24 1.61 1.01 -0.97 -4.99 116.67 115.88 2wbg s ASP 49 Ca 0.00 2.45 0.01 0.00 0.71 0.00 0.00 52.55 55.72 2wbg s ASP 49 Cb 0.00 -2.60 -0.04 0.00 1.01 0.00 0.00 42.92 41.28 2wbg s ASP 49 CO 0.00 -1.62 0.14 0.42 0.21 0.00 0.00 175.17 174.32 2wbg s THR 50 N -1.54 0.15 -0.57 -1.27 -4.23 -1.26 -4.79 115.64 102.12 2wbg s THR 50 Ca 0.77 -2.00 0.06 0.00 -1.18 0.00 0.00 61.69 59.34 2wbg s THR 50 Cb -0.32 -2.53 0.37 0.00 1.34 0.00 0.00 72.50 71.36 2wbg s THR 50 CO 0.35 0.00 1.14 0.61 -0.54 0.00 0.00 174.62 176.18 2wbg n GLY 51 N -0.39 2.36 0.37 3.99 0.00 -1.26 -4.52 105.19 105.73 2wbg n GLY 51 Ca 0.02 -0.44 0.08 0.00 0.00 0.00 0.00 46.02 45.67 2wbg n GLY 51 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2wbg h ASP 52 N 1.64 0.80 0.00 1.61 3.32 -1.94 -3.32 116.42 118.54 2wbg h ASP 52 Ca 0.05 0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.13 2wbg h ASP 52 Cb 1.31 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 40.72 2wbg h ASP 52 CO 0.28 0.46 -0.91 0.52 -1.72 0.00 0.00 179.24 177.87 2wbg n VAL 53 N -4.54 0.00 0.00 -1.35 0.31 -1.26 -0.22 118.33 111.27 2wbg n VAL 53 Ca 0.16 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.49 2wbg n VAL 53 Cb 0.33 -1.30 0.00 0.00 -0.91 0.00 0.00 33.84 31.96 2wbg n VAL 53 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2wbg n ALA 54 N -2.89 0.00 0.85 3.52 0.00 -1.26 -0.50 120.51 120.24 2wbg n ALA 54 Ca 0.00 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.54 2wbg n ALA 54 Cb 0.45 0.00 0.28 0.00 0.00 0.00 0.00 19.45 20.19 2wbg n ALA 54 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2wbg n ASP 56 N 0.69 -4.43 0.30 0.00 2.03 0.35 -4.82 116.55 110.66 2wbg n ASP 56 Ca 0.16 0.06 0.16 0.00 0.52 0.00 0.00 54.79 55.69 2wbg n ASP 56 Cb 0.39 -3.72 0.92 0.00 -0.72 0.00 0.00 41.12 37.99 2wbg n ASP 56 CO 0.00 0.00 0.00 -0.74 -1.92 0.00 0.00 177.20 174.54 2wbg h HIS 57 N -0.20 0.00 -0.23 -0.67 -0.00 -0.99 0.15 115.15 113.20 2wbg h HIS 57 Ca -0.36 0.00 0.03 0.00 -0.00 0.00 0.00 60.37 60.04 2wbg h HIS 57 Cb 1.26 0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 28.66 2wbg h HIS 57 CO 0.66 0.04 0.16 -0.92 -0.00 0.00 0.00 177.93 177.86 2wbg h TYR 58 N 0.00 0.18 0.00 5.26 3.20 -1.44 -1.32 116.97 122.84 2wbg h TYR 58 Ca -0.00 0.00 -0.23 0.00 3.14 0.00 0.00 58.73 61.65 2wbg h TYR 58 Cb 0.13 -0.06 -0.04 0.00 1.54 0.00 0.00 36.73 38.30 2wbg h TYR 58 CO 0.00 0.10 -2.13 0.09 -1.64 0.00 0.00 178.16 174.59 2wbg n ASN 59 N -4.50 0.56 -1.32 -2.11 3.02 -0.64 -4.66 115.26 105.62 2wbg n ASN 59 Ca 0.01 0.00 0.09 0.00 -0.03 0.00 0.00 54.58 54.65 2wbg n ASN 59 Cb 0.18 1.24 0.31 0.00 -0.61 0.00 0.00 39.78 40.89 2wbg n ASN 59 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2wbg n ARG 60 N -2.51 3.45 -0.26 3.52 1.74 -0.05 -4.69 116.66 117.84 2wbg n ARG 60 Ca -0.21 -2.74 0.05 0.00 -0.77 0.00 0.00 57.85 54.18 2wbg n ARG 60 Cb 0.91 -1.77 0.19 0.00 -1.02 0.00 0.00 32.46 30.77 2wbg n ARG 60 CO 0.00 0.00 0.00 0.11 -1.52 0.00 0.00 177.63 176.22 2wbg h TRP 61 N 3.43 0.57 -0.63 -1.55 5.08 -1.50 -1.86 115.95 119.49 2wbg h TRP 61 Ca 0.00 0.04 -0.01 0.00 1.08 0.00 0.00 58.89 59.99 2wbg h TRP 61 Cb 1.31 -0.14 -0.03 0.00 -3.00 0.00 0.00 29.16 27.31 2wbg h TRP 61 CO 0.63 0.10 0.35 -0.22 -1.28 0.00 0.00 178.44 178.01 2wbg h LYS 62 N 0.49 0.87 -0.53 0.12 3.64 -1.88 0.12 116.57 119.41 2wbg h LYS 62 Ca 0.42 -0.10 -0.06 0.00 -1.27 0.00 0.00 60.65 59.64 2wbg h LYS 62 Cb 0.61 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 32.24 2wbg h LYS 62 CO -0.38 0.66 0.11 1.49 -2.27 0.00 0.00 179.45 179.05 2wbg h GLU 63 N 0.85 0.86 -0.62 1.90 4.81 -1.77 0.89 114.58 121.50 2wbg h GLU 63 Ca 0.22 -0.22 -0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2wbg h GLU 63 Cb 0.04 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.28 2wbg h GLU 63 CO -0.04 0.83 0.39 -0.44 -0.73 0.00 0.00 179.01 179.02 2wbg h ASP 64 N 0.75 0.73 -0.43 1.04 3.32 -0.63 -1.22 116.42 119.98 2wbg h ASP 64 Ca 0.16 -0.05 -0.09 0.00 0.02 0.00 0.00 57.03 57.08 2wbg h ASP 64 Cb 0.37 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.71 2wbg h ASP 64 CO 0.01 0.56 -0.05 0.40 -1.72 0.00 0.00 179.24 178.44 2wbg h ILE 65 N 0.84 1.25 0.00 0.35 2.04 -0.54 -2.20 117.51 119.25 2wbg h ILE 65 Ca 0.22 -1.11 -0.01 0.00 1.00 0.00 0.00 64.86 64.97 2wbg h ILE 65 Cb -0.05 0.92 -0.00 0.00 -0.74 0.00 0.00 36.82 36.95 2wbg h ILE 65 CO -0.04 0.39 -0.03 -0.33 0.00 0.00 0.00 178.15 178.14 2wbg h GLU 66 N 0.79 0.00 -0.06 2.37 5.08 -0.18 -0.56 114.58 122.01 2wbg h GLU 66 Ca 0.14 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.42 2wbg h GLU 66 Cb 0.54 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.79 2wbg h GLU 66 CO 0.03 0.03 -0.29 0.82 -1.00 0.00 0.00 179.01 178.60 2wbg h ILE 67 N 0.00 1.43 -0.60 3.13 2.04 -0.64 -0.01 117.51 122.87 2wbg h ILE 67 Ca -0.00 -1.71 0.11 0.00 1.00 0.00 0.00 64.86 64.27 2wbg h ILE 67 Cb 0.06 2.35 -0.09 0.00 -0.74 0.00 0.00 36.82 38.40 2wbg h ILE 67 CO 0.00 0.49 0.11 0.40 0.00 0.00 0.00 178.15 179.15 2wbg h ILE 68 N -0.20 0.62 -0.35 -0.67 2.04 -1.04 0.06 117.51 117.97 2wbg h ILE 68 Ca -0.02 -0.08 -0.01 0.00 1.00 0.00 0.00 64.86 65.75 2wbg h ILE 68 Cb 0.94 0.36 -0.02 0.00 -0.74 0.00 0.00 36.82 37.37 2wbg h ILE 68 CO 0.06 0.04 0.16 -0.08 0.00 0.00 0.00 178.15 178.34 2wbg h GLU 69 N 0.24 0.51 -0.13 2.37 4.81 -1.06 -2.46 114.58 118.85 2wbg h GLU 69 Ca 0.31 -0.08 -0.04 0.00 -0.13 0.00 0.00 59.36 59.43 2wbg h GLU 69 Cb 0.48 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 29.76 2wbg h GLU 69 CO -0.42 0.47 -0.10 -0.22 -0.73 0.00 0.00 179.01 178.01 2wbg h LYS 70 N 0.42 0.20 -0.00 1.92 1.63 -0.26 -1.05 116.57 119.44 2wbg h LYS 70 Ca 0.12 -0.04 0.00 0.00 -0.85 0.00 0.00 60.65 59.88 2wbg h LYS 70 Cb 0.13 -0.03 0.00 0.00 -0.60 0.00 0.00 32.23 31.73 2wbg h LYS 70 CO -0.01 0.32 -0.07 1.28 -3.45 0.00 0.00 179.45 177.51 2wbg n LEU 71 N -4.31 0.17 -0.18 5.20 4.77 -0.06 -4.91 117.00 117.67 2wbg n LEU 71 Ca -0.01 0.25 -0.02 0.00 -0.03 0.00 0.00 56.01 56.20 2wbg n LEU 71 Cb 0.24 -0.32 -0.01 0.00 -2.33 0.00 0.00 43.42 41.00 2wbg n LEU 71 CO 0.37 0.03 -0.02 0.61 -1.33 0.00 0.00 177.39 177.05 2wbg n GLY 72 N 1.37 0.57 3.75 -0.72 0.00 -0.40 -4.42 105.19 105.33 2wbg n GLY 72 Ca 0.11 -0.41 -0.41 0.00 0.00 0.00 0.00 46.02 45.31 2wbg n GLY 72 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wbg s VAL 73 N -1.97 3.38 -0.16 1.61 1.01 -0.96 -4.86 120.40 118.46 2wbg s VAL 73 Ca 0.00 1.22 0.20 0.00 0.00 0.00 0.00 61.98 63.40 2wbg s VAL 73 Cb 0.00 -3.78 -0.12 0.00 0.00 0.00 0.00 36.38 32.48 2wbg s VAL 73 CO 0.00 0.22 0.81 0.29 0.00 0.00 0.00 175.10 176.42 2wbg n LYS 74 N 2.07 0.62 -4.23 2.72 4.76 -0.54 -4.70 118.16 118.86 2wbg n LYS 74 Ca 0.03 0.11 -0.17 0.00 -2.87 0.00 0.00 58.31 55.41 2wbg n LYS 74 Cb 0.44 -1.76 -0.13 0.00 -1.84 0.00 0.00 35.03 31.74 2wbg n LYS 74 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2wbg s ALA 75 N -3.15 0.90 -0.22 7.82 0.00 -0.53 -0.44 121.76 126.13 2wbg s ALA 75 Ca -0.03 -0.73 0.00 0.00 0.00 0.00 0.00 51.96 51.20 2wbg s ALA 75 Cb 0.10 -0.11 0.06 0.00 0.00 0.00 0.00 23.12 23.17 2wbg s ALA 75 CO 0.82 0.14 -0.04 -0.47 0.00 0.00 0.00 175.76 176.21 2wbg s TYR 76 N -0.91 2.11 -0.31 0.00 5.04 -0.35 -2.28 117.35 120.65 2wbg s TYR 76 Ca -0.02 -1.56 -0.22 0.00 -2.44 0.00 0.00 57.07 52.84 2wbg s TYR 76 Cb -0.08 -1.46 -0.00 0.00 0.35 0.00 0.00 41.96 40.77 2wbg s TYR 76 CO 0.01 -0.74 0.71 0.50 -1.34 0.00 0.00 175.55 174.69 2wbg s ARG 77 N 1.49 3.91 0.20 4.97 3.52 -0.15 -1.01 118.95 131.89 2wbg s ARG 77 Ca -0.05 0.42 0.02 0.00 -0.13 0.00 0.00 55.73 55.99 2wbg s ARG 77 Cb -0.18 -3.73 -0.05 0.00 -1.56 0.00 0.00 34.95 29.42 2wbg s ARG 77 CO -0.07 -0.64 0.03 -0.59 -0.81 0.00 0.00 175.30 173.23 2wbg s PHE 78 N 2.79 1.32 0.30 5.12 -0.71 -0.71 -0.74 117.98 125.35 2wbg s PHE 78 Ca 0.29 -1.07 0.10 0.00 -1.04 0.00 0.00 56.93 55.20 2wbg s PHE 78 Cb -0.14 -0.76 -0.05 0.00 -1.21 0.00 0.00 43.02 40.86 2wbg s PHE 78 CO 0.12 -0.25 -0.01 -1.54 -1.34 0.00 0.00 175.22 172.20 2wbg s SER 79 N -3.22 4.30 -0.15 1.98 1.04 -1.25 -0.95 113.70 115.45 2wbg s SER 79 Ca 0.28 -0.82 -0.05 0.00 0.48 0.00 0.00 55.95 55.84 2wbg s SER 79 Cb 0.07 -0.65 -0.03 0.00 0.10 0.00 0.00 66.02 65.50 2wbg s SER 79 CO 0.07 -0.10 0.01 -0.63 0.98 0.00 0.00 173.24 173.57 2wbg s ILE 80 N -2.42 4.31 -0.44 -1.02 1.01 -0.97 -4.12 121.20 117.55 2wbg s ILE 80 Ca 0.33 -0.21 -0.29 0.00 0.00 0.00 0.00 60.65 60.48 2wbg s ILE 80 Cb -0.04 -2.90 0.01 0.00 0.01 0.00 0.00 42.46 39.55 2wbg s ILE 80 CO 0.19 0.50 1.39 -0.55 0.00 0.00 0.00 174.94 176.47 2wbg s SER 81 N 0.14 6.33 0.17 3.58 0.15 -1.26 -4.71 113.70 118.11 2wbg s SER 81 Ca 0.01 0.72 -0.17 0.00 0.70 0.00 0.00 55.95 57.22 2wbg s SER 81 Cb -0.13 -2.54 0.11 0.00 -1.71 0.00 0.00 66.02 61.75 2wbg s SER 81 CO 0.02 -1.46 1.66 -0.25 1.20 0.00 0.00 173.24 174.41 2wbg h TRP 82 N 10.63 -0.28 0.00 3.44 2.91 -1.85 -0.79 115.95 130.02 2wbg h TRP 82 Ca -0.27 0.04 0.00 0.00 1.13 0.00 0.00 58.89 59.79 2wbg h TRP 82 Cb 1.10 0.19 0.00 0.00 -0.51 0.00 0.00 29.16 29.94 2wbg h TRP 82 CO 0.98 -0.20 0.00 -0.35 -1.03 0.00 0.00 178.44 177.83 2wbg n PRO 83 N -5.33 0.02 0.11 2.65 -0.04 -1.26 -0.50 135.00 130.65 2wbg n PRO 83 Ca 0.03 0.20 -0.03 0.00 -0.04 0.00 0.00 63.50 63.66 2wbg n PRO 83 Cb 0.24 -1.50 0.06 0.00 -0.04 0.00 0.00 33.50 32.26 2wbg n PRO 83 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2wbg h ARG 84 N 0.00 0.00 0.01 0.54 3.08 -1.41 -0.15 114.38 116.44 2wbg h ARG 84 Ca 0.00 0.00 -0.15 0.00 0.07 0.00 0.00 59.98 59.90 2wbg h ARG 84 Cb 0.28 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.31 2wbg h ARG 84 CO 0.00 0.74 -0.83 0.82 -1.07 0.00 0.00 179.97 179.63 2wbg h ILE 85 N 0.00 1.23 -3.27 2.04 1.08 -0.59 -3.34 117.51 114.66 2wbg h ILE 85 Ca -0.01 -2.25 -0.63 0.00 -0.39 0.00 0.00 64.86 61.59 2wbg h ILE 85 Cb 1.37 2.65 -0.40 0.00 -3.07 0.00 0.00 36.82 37.37 2wbg h ILE 85 CO 0.10 0.43 -0.70 -0.76 -0.69 0.00 0.00 178.15 176.53 2wbg s LEU 86 N -7.98 3.57 0.45 1.44 1.43 0.35 -0.01 118.68 117.92 2wbg s LEU 86 Ca -0.25 -2.57 0.18 0.00 -1.03 0.00 0.00 54.13 50.46 2wbg s LEU 86 Cb 0.03 -1.33 1.13 0.00 0.03 0.00 0.00 46.19 46.04 2wbg s LEU 86 CO 0.63 -0.29 1.92 -0.65 0.23 0.00 0.00 176.35 178.20 2wbg h PRO 87 N 6.95 0.32 -0.66 1.29 0.11 -1.74 0.30 132.00 138.57 2wbg h PRO 87 Ca -0.06 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.04 2wbg h PRO 87 Cb 0.94 -0.07 0.00 0.00 0.11 0.00 0.00 31.00 31.98 2wbg h PRO 87 CO 0.56 0.21 0.00 0.39 -0.21 0.00 0.00 178.00 178.96 2wbg n GLU 88 N -4.46 3.09 0.00 1.05 -0.58 -1.26 -4.21 120.64 114.28 2wbg n GLU 88 Ca 0.14 -2.54 0.00 0.00 -0.42 0.00 0.00 57.16 54.34 2wbg n GLU 88 Cb 0.58 -1.70 0.00 0.00 -0.57 0.00 0.00 31.44 29.74 2wbg n GLU 88 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2wbg n GLY 89 N 1.30 1.41 3.52 0.62 0.00 0.10 -4.60 105.19 107.55 2wbg n GLY 89 Ca 0.23 -0.10 -0.25 0.00 0.00 0.00 0.00 46.02 45.91 2wbg n GLY 89 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2wbg s THR 90 N -0.07 0.89 0.00 2.61 -4.23 -1.26 -4.80 115.64 108.77 2wbg s THR 90 Ca 0.00 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.51 2wbg s THR 90 Cb 0.00 -2.49 0.00 0.00 1.34 0.00 0.00 72.50 71.35 2wbg s THR 90 CO 0.00 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.69 2wbg n GLY 91 N -0.87 0.43 3.71 3.99 0.00 -1.26 -4.84 105.19 106.35 2wbg n GLY 91 Ca -0.06 -0.85 -0.42 0.00 0.00 0.00 0.00 46.02 44.69 2wbg n GLY 91 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2wbg s ARG 92 N 0.00 4.19 0.16 1.61 1.70 -1.26 -4.97 118.95 120.37 2wbg s ARG 92 Ca 0.00 2.42 -0.28 0.00 -0.47 0.00 0.00 55.73 57.41 2wbg s ARG 92 Cb 0.00 -3.26 -0.07 0.00 -0.57 0.00 0.00 34.95 31.05 2wbg s ARG 92 CO 0.00 -0.68 0.86 0.08 -1.08 0.00 0.00 175.30 174.48 2wbg s VAL 93 N 1.56 4.37 -0.53 4.99 1.01 -1.26 -4.39 120.40 126.14 2wbg s VAL 93 Ca 0.73 1.88 -0.23 0.00 0.00 0.00 0.00 61.98 64.36 2wbg s VAL 93 Cb -0.44 -4.23 0.04 0.00 0.00 0.00 0.00 36.38 31.75 2wbg s VAL 93 CO 0.32 0.45 0.85 0.21 0.00 0.00 0.00 175.10 176.93 2wbg s ASN 94 N -0.73 6.31 0.28 3.32 2.47 0.98 -4.94 114.94 122.63 2wbg s ASN 94 Ca 0.40 -0.48 0.01 0.00 0.42 0.00 0.00 52.86 53.21 2wbg s ASN 94 Cb -0.24 -2.40 0.52 0.00 -1.45 0.00 0.00 41.25 37.69 2wbg s ASN 94 CO 0.28 -1.12 1.85 -0.61 -3.72 0.00 0.00 177.10 173.78 2wbg h GLN 95 N 9.21 1.01 0.00 0.43 5.75 -1.90 -1.59 115.11 128.03 2wbg h GLN 95 Ca -0.26 -0.06 -0.03 0.00 -0.15 0.00 0.00 58.65 58.14 2wbg h GLN 95 Cb 1.08 -0.23 -0.00 0.00 1.07 0.00 0.00 27.48 29.40 2wbg h GLN 95 CO 1.05 0.67 -0.15 0.87 -2.65 0.00 0.00 178.83 178.61 2wbg h LYS 96 N 1.04 0.00 -0.13 1.69 1.57 -1.90 0.77 116.57 119.61 2wbg h LYS 96 Ca 0.48 0.00 -0.22 0.00 -1.87 0.00 0.00 60.65 59.03 2wbg h LYS 96 Cb 0.40 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.72 2wbg h LYS 96 CO -0.23 0.15 -0.79 0.78 -0.57 0.00 0.00 179.45 178.78 2wbg h GLY 97 N 1.19 0.85 0.82 3.86 0.00 -1.41 -2.16 103.07 106.22 2wbg h GLY 97 Ca -0.00 -1.23 0.03 0.00 0.00 0.00 0.00 47.33 46.12 2wbg h GLY 97 CO 0.02 1.10 0.18 1.41 0.00 0.00 0.00 176.54 179.24 2wbg h LEU 98 N 0.49 0.26 -0.25 3.11 3.38 -1.27 -2.34 115.31 118.69 2wbg h LEU 98 Ca -0.06 0.02 0.05 0.00 0.09 0.00 0.00 57.88 57.98 2wbg h LEU 98 Cb 1.43 -0.03 -0.05 0.00 0.09 0.00 0.00 40.66 42.10 2wbg h LEU 98 CO 0.16 0.19 -0.07 0.44 0.09 0.00 0.00 178.44 179.25 2wbg h ASP 99 N 0.36 -0.25 -0.21 -0.43 3.32 -0.79 0.13 116.42 118.56 2wbg h ASP 99 Ca 0.15 0.08 0.06 0.00 0.02 0.00 0.00 57.03 57.34 2wbg h ASP 99 Cb 0.06 0.16 -0.06 0.00 0.22 0.00 0.00 39.33 39.71 2wbg h ASP 99 CO -0.11 -0.09 -0.21 0.15 -1.72 0.00 0.00 179.24 177.26 2wbg h PHE 100 N -0.01 -0.55 0.00 4.55 3.57 -1.20 -1.84 116.94 121.45 2wbg h PHE 100 Ca 0.12 0.03 -0.11 0.00 3.53 0.00 0.00 57.97 61.54 2wbg h PHE 100 Cb 0.20 0.28 -0.02 0.00 2.79 0.00 0.00 35.95 39.20 2wbg h PHE 100 CO -0.26 -0.29 -0.54 1.88 -2.23 0.00 0.00 178.31 176.87 2wbg h TYR 101 N -0.23 0.00 -0.64 0.41 0.05 -1.10 -3.05 116.97 112.41 2wbg h TYR 101 Ca 0.13 0.00 -0.03 0.00 0.05 0.00 0.00 58.73 58.88 2wbg h TYR 101 Cb 0.42 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 38.13 2wbg h TYR 101 CO -0.36 0.54 0.28 -0.91 -1.05 0.00 0.00 178.16 176.66 2wbg h ASN 102 N 0.00 0.85 -0.30 3.88 2.35 0.04 -1.42 115.58 120.98 2wbg h ASN 102 Ca -0.01 -0.10 -0.16 0.00 -0.55 0.00 0.00 56.30 55.49 2wbg h ASN 102 Cb 1.14 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 39.28 2wbg h ASN 102 CO 0.07 0.74 -0.39 0.03 -1.65 0.00 0.00 177.43 176.23 2wbg h ARG 103 N 0.92 0.85 -0.05 0.81 3.08 -1.29 0.15 114.38 118.87 2wbg h ARG 103 Ca 0.22 -0.45 -0.00 0.00 0.07 0.00 0.00 59.98 59.82 2wbg h ARG 103 Cb 0.15 0.02 -0.00 0.00 0.08 0.00 0.00 29.97 30.21 2wbg h ARG 103 CO -0.02 1.09 0.03 0.82 -1.07 0.00 0.00 179.97 180.81 2wbg h ILE 104 N 0.70 1.07 0.06 2.04 2.04 -1.43 0.08 117.51 122.06 2wbg h ILE 104 Ca 0.06 -0.19 -0.00 0.00 1.00 0.00 0.00 64.86 65.72 2wbg h ILE 104 Cb 0.97 1.11 0.00 0.00 -0.74 0.00 0.00 36.82 38.16 2wbg h ILE 104 CO 0.09 0.06 -0.03 0.40 0.00 0.00 0.00 178.15 178.67 2wbg h ILE 105 N -0.00 1.02 -0.70 -0.67 2.04 -1.07 0.10 117.51 118.23 2wbg h ILE 105 Ca 0.02 -0.26 0.08 0.00 1.00 0.00 0.00 64.86 65.69 2wbg h ILE 105 Cb 0.07 1.20 -0.06 0.00 -0.74 0.00 0.00 36.82 37.28 2wbg h ILE 105 CO -0.00 0.07 0.37 0.44 0.00 0.00 0.00 178.15 179.02 2wbg h ASP 106 N -0.19 0.51 -0.56 1.72 3.32 -0.64 -1.78 116.42 118.79 2wbg h ASP 106 Ca -0.01 0.05 -0.10 0.00 0.02 0.00 0.00 57.03 56.99 2wbg h ASP 106 Cb 0.17 -0.05 -0.02 0.00 0.22 0.00 0.00 39.33 39.65 2wbg h ASP 106 CO 0.01 0.31 -0.04 0.74 -1.72 0.00 0.00 179.24 178.54 2wbg h THR 107 N 0.65 1.27 -0.33 0.35 2.02 -0.73 -1.86 112.91 114.27 2wbg h THR 107 Ca 0.33 -1.19 0.01 0.00 0.77 0.00 0.00 66.41 66.33 2wbg h THR 107 Cb 0.29 0.90 -0.02 0.00 -1.74 0.00 0.00 68.15 67.59 2wbg h THR 107 CO -0.23 0.43 0.21 -0.07 0.37 0.00 0.00 175.52 176.23 2wbg h LEU 108 N 0.91 0.37 -0.32 2.58 3.38 -0.67 -2.83 115.31 118.73 2wbg h LEU 108 Ca 0.15 -0.01 -0.05 0.00 0.09 0.00 0.00 57.88 58.06 2wbg h LEU 108 Cb 0.60 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.25 2wbg h LEU 108 CO 0.04 0.27 -0.01 -0.07 0.09 0.00 0.00 178.44 178.75 2wbg h LEU 109 N 0.44 0.57 -1.35 1.67 -0.00 -1.20 -0.37 115.31 115.07 2wbg h LEU 109 Ca 0.12 -0.32 0.00 0.00 -0.00 0.00 0.00 57.88 57.68 2wbg h LEU 109 Cb -0.04 -0.15 0.00 0.00 -0.00 0.00 0.00 40.66 40.46 2wbg h LEU 109 CO -0.03 0.75 0.00 1.05 -0.00 0.00 0.00 178.44 180.21 2wbg h GLU 110 N 0.37 0.00 -0.43 1.13 4.11 -1.31 -2.02 114.58 116.44 2wbg h GLU 110 Ca 0.09 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.52 2wbg h GLU 110 Cb 0.47 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.72 2wbg h GLU 110 CO 0.02 0.00 0.00 1.63 0.07 0.00 0.00 179.01 180.73 2wbg n LYS 111 N -2.43 2.45 -1.23 1.06 5.02 -0.85 -4.97 118.16 117.21 2wbg n LYS 111 Ca -0.00 -2.22 -0.01 0.00 -2.02 0.00 0.00 58.31 54.06 2wbg n LYS 111 Cb 0.14 -1.44 -0.00 0.00 -0.02 0.00 0.00 35.03 33.70 2wbg n LYS 111 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2wbg n GLY 112 N 1.23 0.42 3.60 0.72 0.00 -0.76 -5.00 105.19 105.41 2wbg n GLY 112 Ca 0.18 -1.02 -0.34 0.00 0.00 0.00 0.00 46.02 44.84 2wbg n GLY 112 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2wbg s ILE 113 N -2.03 4.39 -0.25 -0.61 1.01 -0.21 -4.90 121.20 118.60 2wbg s ILE 113 Ca 0.00 -0.19 -0.24 0.00 0.00 0.00 0.00 60.65 60.22 2wbg s ILE 113 Cb 0.00 -2.93 -0.01 0.00 0.01 0.00 0.00 42.46 39.53 2wbg s ILE 113 CO 0.00 0.50 0.81 -0.89 0.00 0.00 0.00 174.94 175.37 2wbg s THR 114 N 0.10 4.84 0.29 2.92 2.01 0.41 -3.99 115.64 122.22 2wbg s THR 114 Ca 0.02 1.52 -0.28 0.00 0.31 0.00 0.00 61.69 63.27 2wbg s THR 114 Cb -0.13 -4.11 -0.09 0.00 0.01 0.00 0.00 72.50 68.18 2wbg s THR 114 CO 0.02 -0.08 0.97 -2.16 -0.69 0.00 0.00 174.62 172.68 2wbg s PRO 115 N 2.83 4.67 -0.19 4.92 0.04 -1.26 -1.22 135.00 144.79 2wbg s PRO 115 Ca 0.34 1.46 -0.00 0.00 0.04 0.00 0.00 61.00 62.84 2wbg s PRO 115 Cb -0.15 -3.01 0.05 0.00 0.04 0.00 0.00 34.50 31.42 2wbg s PRO 115 CO 0.08 0.34 -0.05 -0.06 0.04 0.00 0.00 177.00 177.34 2wbg s PHE 116 N -1.40 1.92 -0.23 0.56 0.40 -0.18 -4.18 117.98 114.87 2wbg s PHE 116 Ca 0.46 -1.32 -0.09 0.00 -0.60 0.00 0.00 56.93 55.38 2wbg s PHE 116 Cb -0.23 -1.40 -0.04 0.00 0.51 0.00 0.00 43.02 41.86 2wbg s PHE 116 CO 0.29 -0.68 0.12 0.08 0.70 0.00 0.00 175.22 175.73 2wbg s VAL 117 N 1.56 4.98 -0.36 -0.44 1.01 -0.39 -1.75 120.40 125.02 2wbg s VAL 117 Ca -0.02 0.05 -0.22 0.00 0.00 0.00 0.00 61.98 61.80 2wbg s VAL 117 Cb -0.17 -3.31 0.01 0.00 0.00 0.00 0.00 36.38 32.91 2wbg s VAL 117 CO -0.07 0.37 0.69 -0.89 0.00 0.00 0.00 175.10 175.20 2wbg s THR 118 N 1.03 4.83 0.16 3.92 2.01 -0.13 -0.63 115.64 126.84 2wbg s THR 118 Ca 0.06 0.70 -0.11 0.00 0.31 0.00 0.00 61.69 62.66 2wbg s THR 118 Cb -0.14 -4.13 0.03 0.00 0.01 0.00 0.00 72.50 68.28 2wbg s THR 118 CO 0.04 -0.36 1.60 0.40 -0.69 0.00 0.00 174.62 175.61 2wbg h ILE 119 N 5.70 1.27 -3.36 1.82 2.04 -0.72 -2.58 117.51 121.68 2wbg h ILE 119 Ca -0.26 -1.20 -0.54 0.00 1.00 0.00 0.00 64.86 63.87 2wbg h ILE 119 Cb 1.10 0.95 -0.39 0.00 -0.74 0.00 0.00 36.82 37.74 2wbg h ILE 119 CO 0.87 0.42 -0.77 -0.47 0.00 0.00 0.00 178.15 178.20 2wbg s TYR 120 N -4.91 1.35 -0.43 1.37 5.04 -0.74 -4.42 117.35 114.61 2wbg s TYR 120 Ca -0.12 -1.06 0.07 0.00 -2.44 0.00 0.00 57.07 53.53 2wbg s TYR 120 Cb 0.12 -1.15 0.42 0.00 0.35 0.00 0.00 41.96 41.70 2wbg s TYR 120 CO 0.85 -0.64 1.07 1.58 -1.34 0.00 0.00 175.55 177.07 2wbg n HIS 121 N 4.96 3.06 0.00 4.97 -0.00 -1.26 -0.96 115.22 125.98 2wbg n HIS 121 Ca -0.10 -3.11 0.00 0.00 0.46 0.00 0.00 57.72 54.97 2wbg n HIS 121 Cb 0.46 -0.15 0.00 0.00 -0.12 0.00 0.00 29.99 30.19 2wbg n HIS 121 CO 0.00 0.00 0.00 0.91 0.46 0.00 0.00 176.34 177.71 2wbg n TRP 122 N -0.40 0.00 -2.35 1.57 7.02 -1.26 -4.85 117.44 117.17 2wbg n TRP 122 Ca 0.34 0.00 -0.42 0.00 -1.02 0.00 0.00 57.50 56.39 2wbg n TRP 122 Cb 0.67 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.57 2wbg n TRP 122 CO 0.00 0.00 0.00 -0.40 -2.02 0.00 0.00 177.69 175.27 2wbg n ASP 123 N 0.00 5.29 -4.75 -0.99 5.75 -1.26 -4.69 116.55 115.89 2wbg n ASP 123 Ca 0.00 -3.13 -0.41 0.00 -0.01 0.00 0.00 54.79 51.24 2wbg n ASP 123 Cb 0.00 -1.46 -0.02 0.00 -1.03 0.00 0.00 41.12 38.61 2wbg n ASP 123 CO 0.00 0.00 0.00 -0.22 -0.11 0.00 0.00 177.20 176.87 2wbg s LEU 124 N -0.40 4.41 0.21 -2.12 2.96 -1.26 -4.24 118.68 118.24 2wbg s LEU 124 Ca 0.40 2.63 -0.32 0.00 -0.22 0.00 0.00 54.13 56.62 2wbg s LEU 124 Cb 0.10 -3.63 -0.14 0.00 0.50 0.00 0.00 46.19 43.02 2wbg s LEU 124 CO 0.01 -0.60 1.47 -2.65 -1.32 0.00 0.00 176.35 173.25 2wbg n PRO 125 N 1.73 2.07 0.09 0.98 -0.02 -1.26 -0.28 135.00 138.30 2wbg n PRO 125 Ca 0.04 0.74 0.05 0.00 -2.02 0.00 0.00 63.50 62.31 2wbg n PRO 125 Cb 0.41 -2.44 0.50 0.00 -0.02 0.00 0.00 33.50 31.95 2wbg n PRO 125 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 2wbg h PHE 126 N 4.79 0.34 -0.16 6.00 3.57 -1.13 -1.57 116.94 128.78 2wbg h PHE 126 Ca -0.45 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.05 2wbg h PHE 126 Cb 1.27 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 39.88 2wbg h PHE 126 CO 0.58 0.22 0.06 0.00 -2.23 0.00 0.00 178.31 176.95 2wbg h ALA 127 N 1.83 1.82 0.09 2.41 0.00 -1.84 -1.78 119.26 121.80 2wbg h ALA 127 Ca 0.10 -0.04 -0.26 0.00 0.00 0.00 0.00 54.91 54.71 2wbg h ALA 127 Cb -0.04 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 2wbg h ALA 127 CO -0.02 0.15 -1.16 -0.07 0.00 0.00 0.00 179.25 178.15 2wbg h LEU 128 N 0.22 0.36 -1.27 0.00 3.38 -1.54 -3.21 115.31 113.25 2wbg h LEU 128 Ca 0.06 -0.37 0.00 0.00 0.09 0.00 0.00 57.88 57.66 2wbg h LEU 128 Cb 0.04 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 40.64 2wbg h LEU 128 CO -0.01 1.27 0.44 -0.61 0.09 0.00 0.00 178.44 179.62 2wbg h GLN 129 N 0.08 0.94 0.00 1.13 5.75 -1.13 0.71 115.11 122.59 2wbg h GLN 129 Ca -0.11 -0.07 0.00 0.00 -0.15 0.00 0.00 58.65 58.33 2wbg h GLN 129 Cb 1.88 -0.20 0.00 0.00 1.07 0.00 0.00 27.48 30.23 2wbg h GLN 129 CO 0.19 0.64 0.00 -0.07 -2.65 0.00 0.00 178.83 176.94 2wbg h LEU 130 N 0.96 0.00 -3.32 -2.39 3.38 -1.43 0.28 115.31 112.79 2wbg h LEU 130 Ca 0.25 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.22 2wbg h LEU 130 Cb -0.07 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.68 2wbg h LEU 130 CO -0.05 0.00 0.00 0.29 0.09 0.00 0.00 178.44 178.77 2wbg n LYS 131 N -2.83 3.83 0.00 1.13 5.02 -0.60 -4.94 118.16 119.77 2wbg n LYS 131 Ca -0.01 -2.92 0.00 0.00 -2.02 0.00 0.00 58.31 53.36 2wbg n LYS 131 Cb 0.14 -1.97 0.00 0.00 -0.02 0.00 0.00 35.03 33.18 2wbg n LYS 131 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2wbg n GLY 132 N 0.33 1.91 7.00 0.72 0.00 0.09 -4.73 105.19 110.51 2wbg n GLY 132 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.26 2wbg n GLY 132 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2wbg n GLY 133 N -1.25 2.85 0.09 -0.02 0.00 0.14 -1.61 105.19 105.39 2wbg n GLY 133 Ca 0.00 -0.19 0.09 0.00 0.00 0.00 0.00 46.02 45.92 2wbg n GLY 133 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 2wbg n TRP 134 N 14.00 0.50 0.25 1.61 7.02 -1.26 -1.57 117.44 137.99 2wbg n TRP 134 Ca 0.00 0.22 0.14 0.00 -1.02 0.00 0.00 57.50 56.84 2wbg n TRP 134 Cb 0.00 -0.86 0.47 0.00 -2.42 0.00 0.00 31.31 28.50 2wbg n TRP 134 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2wbg h ALA 135 N 2.20 0.99 -2.88 6.99 0.00 -1.61 -3.34 119.26 121.61 2wbg h ALA 135 Ca 0.00 -0.06 -0.63 0.00 0.00 0.00 0.00 54.91 54.22 2wbg h ALA 135 Cb 0.19 -0.01 -0.16 0.00 0.00 0.00 0.00 17.79 17.81 2wbg h ALA 135 CO 0.00 0.08 -0.43 1.21 0.00 0.00 0.00 179.25 180.11 2wbg s ASN 136 N -5.96 6.11 0.58 0.00 3.84 -0.61 -4.87 114.94 114.04 2wbg s ASN 136 Ca 0.03 0.11 0.29 0.00 0.21 0.00 0.00 52.86 53.49 2wbg s ASN 136 Cb 0.08 -2.15 1.49 0.00 -0.55 0.00 0.00 41.25 40.13 2wbg s ASN 136 CO 0.61 -0.07 1.93 0.03 -2.79 0.00 0.00 177.10 176.80 2wbg h ARG 137 N 8.15 0.00 0.00 0.43 3.08 -1.86 -0.88 114.38 123.31 2wbg h ARG 137 Ca -0.35 0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.70 2wbg h ARG 137 Cb 1.18 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.23 2wbg h ARG 137 CO 0.60 0.00 0.00 0.39 -1.07 0.00 0.00 179.97 179.89 2wbg n GLU 138 N -3.79 0.05 0.25 0.04 1.02 -1.26 -2.56 120.64 114.39 2wbg n GLU 138 Ca 0.08 0.39 0.11 0.00 -0.02 0.00 0.00 57.16 57.73 2wbg n GLU 138 Cb 0.64 -1.62 0.63 0.00 -0.02 0.00 0.00 31.44 31.06 2wbg n GLU 138 CO 0.00 0.00 0.00 0.97 1.18 0.00 0.00 177.13 179.28 2wbg h ILE 139 N 0.00 0.59 -0.96 -3.67 2.10 -1.43 -0.28 117.51 113.86 2wbg h ILE 139 Ca 0.00 -0.75 0.06 0.00 1.08 0.00 0.00 64.86 65.25 2wbg h ILE 139 Cb 0.18 1.49 -0.06 0.00 -1.09 0.00 0.00 36.82 37.33 2wbg h ILE 139 CO 0.00 0.16 0.63 0.00 -1.08 0.00 0.00 178.15 177.86 2wbg h ALA 140 N 1.84 1.44 -0.31 0.18 0.00 -1.73 0.13 119.26 120.79 2wbg h ALA 140 Ca -0.00 -0.03 -0.13 0.00 0.00 0.00 0.00 54.91 54.75 2wbg h ALA 140 Cb 0.47 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 2wbg h ALA 140 CO 0.02 0.43 -0.30 -0.44 0.00 0.00 0.00 179.25 178.96 2wbg h ASP 141 N 1.14 0.81 -0.58 0.00 3.32 -1.30 -1.89 116.42 117.91 2wbg h ASP 141 Ca 0.41 -0.47 -0.08 0.00 0.02 0.00 0.00 57.03 56.91 2wbg h ASP 141 Cb 0.15 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.45 2wbg h ASP 141 CO -0.15 1.11 0.07 -0.50 -1.72 0.00 0.00 179.24 178.04 2wbg h TRP 142 N 0.52 1.05 -0.30 4.55 6.55 -0.76 -0.96 115.95 126.61 2wbg h TRP 142 Ca 0.05 -0.16 -0.15 0.00 0.95 0.00 0.00 58.89 59.59 2wbg h TRP 142 Cb 0.88 -0.28 -0.01 0.00 -0.86 0.00 0.00 29.16 28.88 2wbg h TRP 142 CO 0.07 0.92 -0.41 0.35 -1.05 0.00 0.00 178.44 178.33 2wbg h PHE 143 N 0.88 0.86 -0.45 0.49 3.57 -0.79 -1.24 116.94 120.26 2wbg h PHE 143 Ca 0.17 -0.26 -0.02 0.00 3.53 0.00 0.00 57.97 61.39 2wbg h PHE 143 Cb 0.46 -0.18 -0.02 0.00 2.79 0.00 0.00 35.95 39.00 2wbg h PHE 143 CO 0.03 1.01 0.19 0.00 -2.23 0.00 0.00 178.31 177.31 2wbg h ALA 144 N 0.95 0.58 -0.22 2.41 0.00 -1.04 0.33 119.26 122.28 2wbg h ALA 144 Ca 0.05 -0.14 -0.10 0.00 0.00 0.00 0.00 54.91 54.72 2wbg h ALA 144 Cb 0.95 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 2wbg h ALA 144 CO 0.09 0.17 -0.29 0.93 0.00 0.00 0.00 179.25 180.16 2wbg h GLU 145 N 0.58 0.44 -0.31 0.00 4.39 -0.97 -1.13 114.58 117.58 2wbg h GLU 145 Ca 0.15 -0.17 -0.06 0.00 0.34 0.00 0.00 59.36 59.61 2wbg h GLU 145 Cb 0.18 -0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.79 2wbg h GLU 145 CO -0.01 0.68 -0.06 -0.92 -1.16 0.00 0.00 179.01 177.54 2wbg h TYR 146 N 0.38 0.65 -0.82 4.33 3.20 -0.92 -2.43 116.97 121.37 2wbg h TYR 146 Ca 0.05 -0.13 -0.01 0.00 3.14 0.00 0.00 58.73 61.78 2wbg h TYR 146 Cb 0.70 -0.16 -0.04 0.00 1.54 0.00 0.00 36.73 38.77 2wbg h TYR 146 CO 0.02 0.76 0.46 0.77 -1.64 0.00 0.00 178.16 178.53 2wbg h SER 147 N 0.36 1.01 -0.20 -2.11 0.02 -0.69 -2.01 113.55 109.93 2wbg h SER 147 Ca 0.08 -0.08 -0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2wbg h SER 147 Cb 0.53 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.81 2wbg h SER 147 CO 0.03 0.80 0.12 -0.09 -1.14 0.00 0.00 176.83 176.55 2wbg h ARG 148 N 1.14 0.27 -0.65 3.45 2.43 -1.04 0.83 114.38 120.83 2wbg h ARG 148 Ca 0.29 -0.03 0.12 0.00 -0.81 0.00 0.00 59.98 59.55 2wbg h ARG 148 Cb 0.00 -0.06 -0.09 0.00 -0.42 0.00 0.00 29.97 29.41 2wbg h ARG 148 CO -0.05 0.23 0.20 0.28 -1.51 0.00 0.00 179.97 179.12 2wbg h VAL 149 N 0.24 0.67 -0.22 0.20 2.07 -0.92 0.13 116.25 118.41 2wbg h VAL 149 Ca 0.07 -0.12 -0.06 0.00 0.82 0.00 0.00 66.70 67.41 2wbg h VAL 149 Cb 0.03 0.30 -0.01 0.00 -1.52 0.00 0.00 31.29 30.09 2wbg h VAL 149 CO -0.01 0.06 -0.11 -0.07 0.02 0.00 0.00 177.57 177.46 2wbg h LEU 150 N 0.34 0.48 -0.51 2.57 3.38 -0.75 -1.94 115.31 118.87 2wbg h LEU 150 Ca 0.34 -0.41 -0.03 0.00 0.09 0.00 0.00 57.88 57.88 2wbg h LEU 150 Cb 0.50 -0.13 -0.02 0.00 0.09 0.00 0.00 40.66 41.09 2wbg h LEU 150 CO -0.39 0.78 0.21 -0.26 0.09 0.00 0.00 178.44 178.88 2wbg h PHE 151 N 0.18 0.77 -0.72 1.13 0.04 -0.46 0.65 116.94 118.53 2wbg h PHE 151 Ca 0.05 -0.05 -0.02 0.00 2.80 0.00 0.00 57.97 60.75 2wbg h PHE 151 Cb 0.60 -0.23 -0.03 0.00 2.20 0.00 0.00 35.95 38.48 2wbg h PHE 151 CO 0.06 0.63 0.37 0.93 -0.60 0.00 0.00 178.31 179.71 2wbg h GLU 152 N 0.69 1.00 0.00 1.51 3.07 -0.99 -0.21 114.58 119.65 2wbg h GLU 152 Ca 0.17 -0.12 -0.24 0.00 -0.50 0.00 0.00 59.36 58.68 2wbg h GLU 152 Cb 0.18 -0.19 -0.04 0.00 -0.84 0.00 0.00 28.75 27.86 2wbg h GLU 152 CO -0.02 0.75 -1.46 -0.91 -1.40 0.00 0.00 179.01 175.97 2wbg h ASN 153 N 1.01 0.00 0.00 1.42 2.35 -1.10 -3.42 115.58 115.84 2wbg h ASN 153 Ca 0.25 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 56.00 2wbg h ASN 153 Cb 0.06 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.43 2wbg h ASN 153 CO -0.04 0.85 -0.63 0.49 -1.65 0.00 0.00 177.43 176.46 2wbg n PHE 154 N -3.05 0.00 0.38 1.19 3.72 0.20 -4.68 117.46 115.21 2wbg n PHE 154 Ca -0.12 0.00 0.09 0.00 -0.05 0.00 0.00 57.45 57.37 2wbg n PHE 154 Cb 0.96 0.00 0.38 0.00 -0.94 0.00 0.00 39.48 39.88 2wbg n PHE 154 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2wbg n GLY 155 N 1.84 -1.06 0.24 1.37 0.00 -0.09 -0.44 105.19 107.05 2wbg n GLY 155 Ca 0.00 0.03 0.10 0.00 0.00 0.00 0.00 46.02 46.15 2wbg n GLY 155 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 2wbg h ASP 156 N 0.00 0.00 0.00 1.61 2.03 -1.84 -3.38 116.42 114.84 2wbg h ASP 156 Ca 0.00 0.00 -0.08 0.00 -0.73 0.00 0.00 57.03 56.22 2wbg h ASP 156 Cb 0.25 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 38.74 2wbg h ASP 156 CO 0.00 0.20 -1.28 0.54 -1.03 0.00 0.00 179.24 177.67 2wbg n ARG 157 N -3.63 0.12 -3.06 4.15 1.74 -0.48 -4.99 116.66 110.52 2wbg n ARG 157 Ca -0.01 0.03 -0.40 0.00 -0.77 0.00 0.00 57.85 56.70 2wbg n ARG 157 Cb 0.33 -1.04 -0.05 0.00 -1.02 0.00 0.00 32.46 30.68 2wbg n ARG 157 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2wbg s VAL 158 N -2.10 5.00 -0.54 1.55 1.01 0.42 -4.95 120.40 120.79 2wbg s VAL 158 Ca -0.07 1.32 0.04 0.00 0.00 0.00 0.00 61.98 63.27 2wbg s VAL 158 Cb 0.02 -4.00 0.04 0.00 0.00 0.00 0.00 36.38 32.44 2wbg s VAL 158 CO 0.11 0.12 0.65 0.29 0.00 0.00 0.00 175.10 176.27 2wbg n LYS 159 N 4.87 -0.33 -3.91 2.72 4.76 -1.26 -4.40 118.16 120.61 2wbg n LYS 159 Ca -0.00 -0.78 -0.29 0.00 -2.87 0.00 0.00 58.31 54.37 2wbg n LYS 159 Cb 0.50 -1.08 -0.16 0.00 -1.84 0.00 0.00 35.03 32.44 2wbg n LYS 159 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 2wbg s ASN 160 N -0.38 3.05 0.06 4.39 0.01 -1.26 -0.08 114.94 120.73 2wbg s ASN 160 Ca 0.05 -0.76 0.06 0.00 -0.71 0.00 0.00 52.86 51.50 2wbg s ASN 160 Cb 0.04 -1.00 -0.03 0.00 0.41 0.00 0.00 41.25 40.67 2wbg s ASN 160 CO 0.05 -0.18 -0.16 0.26 -1.51 0.00 0.00 177.10 175.56 2wbg s TRP 161 N 1.57 1.37 -0.07 2.20 0.52 -0.28 -1.26 118.94 122.98 2wbg s TRP 161 Ca -0.00 -0.40 0.02 0.00 0.02 0.00 0.00 56.10 55.74 2wbg s TRP 161 Cb -0.16 -0.79 0.02 0.00 -1.15 0.00 0.00 33.47 31.39 2wbg s TRP 161 CO -0.08 0.07 -0.11 0.42 0.02 0.00 0.00 176.95 177.27 2wbg s ILE 162 N -1.01 1.09 -0.03 2.03 1.01 0.20 -0.43 121.20 124.05 2wbg s ILE 162 Ca 0.02 -0.43 -0.20 0.00 0.00 0.00 0.00 60.65 60.04 2wbg s ILE 162 Cb -0.09 -1.02 -0.13 0.00 0.01 0.00 0.00 42.46 41.23 2wbg s ILE 162 CO 0.02 0.35 0.85 0.71 0.00 0.00 0.00 174.94 176.87 2wbg h THR 163 N 6.01 0.50 -3.81 2.92 1.35 -1.42 0.18 112.91 118.64 2wbg h THR 163 Ca -0.31 -0.84 -0.44 0.00 -0.55 0.00 0.00 66.41 64.27 2wbg h THR 163 Cb 1.18 0.81 -0.31 0.00 -1.73 0.00 0.00 68.15 68.10 2wbg h THR 163 CO 0.46 0.12 -0.79 -0.76 -0.25 0.00 0.00 175.52 174.30 2wbg s LEU 164 N -9.13 1.79 -0.26 3.87 1.43 -1.26 -1.79 118.68 113.33 2wbg s LEU 164 Ca -0.11 -0.21 -0.22 0.00 -1.03 0.00 0.00 54.13 52.56 2wbg s LEU 164 Cb 0.01 -0.60 -0.01 0.00 0.03 0.00 0.00 46.19 45.62 2wbg s LEU 164 CO 0.40 0.07 0.70 0.21 0.23 0.00 0.00 176.35 177.97 2wbg s ASN 165 N 0.20 6.66 -0.98 2.29 2.47 -0.14 -2.11 114.94 123.33 2wbg s ASN 165 Ca -0.04 0.80 -0.12 0.00 0.42 0.00 0.00 52.86 53.92 2wbg s ASN 165 Cb -0.09 -2.37 -0.01 0.00 -1.45 0.00 0.00 41.25 37.33 2wbg s ASN 165 CO 0.01 -0.44 0.73 -0.62 -3.72 0.00 0.00 177.10 173.07 2wbg n GLU 166 N 5.84 -1.30 0.22 0.43 1.02 -0.01 -4.73 120.64 122.11 2wbg n GLU 166 Ca 0.02 0.74 0.15 0.00 -0.02 0.00 0.00 57.16 58.05 2wbg n GLU 166 Cb 0.48 -4.05 0.81 0.00 -0.02 0.00 0.00 31.44 28.66 2wbg n GLU 166 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 2wbg h PRO 167 N -1.04 0.00 -0.86 3.49 0.13 -1.83 -0.59 132.00 131.30 2wbg h PRO 167 Ca -0.52 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.62 2wbg h PRO 167 Cb 1.29 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.38 2wbg h PRO 167 CO 0.42 0.00 0.57 2.35 -0.23 0.00 0.00 178.00 181.11 2wbg h TRP 168 N 0.00 1.09 -0.12 1.56 7.01 -1.91 -0.32 115.95 123.25 2wbg h TRP 168 Ca 0.06 0.02 -0.05 0.00 2.11 0.00 0.00 58.89 61.04 2wbg h TRP 168 Cb 0.32 -0.37 -0.00 0.00 -2.10 0.00 0.00 29.16 27.01 2wbg h TRP 168 CO 0.00 0.69 -0.11 0.28 -2.79 0.00 0.00 178.44 176.51 2wbg h VAL 169 N 1.17 1.35 -0.54 2.65 2.07 -1.48 0.19 116.25 121.66 2wbg h VAL 169 Ca 0.32 -1.24 0.11 0.00 0.82 0.00 0.00 66.70 66.71 2wbg h VAL 169 Cb -0.13 1.89 -0.09 0.00 -1.52 0.00 0.00 31.29 31.43 2wbg h VAL 169 CO -0.07 0.36 -0.01 0.58 0.02 0.00 0.00 177.57 178.45 2wbg h VAL 170 N -0.09 0.56 0.22 2.57 2.07 -1.19 -0.69 116.25 119.71 2wbg h VAL 170 Ca 0.02 -0.04 -0.01 0.00 0.82 0.00 0.00 66.70 67.50 2wbg h VAL 170 Cb 0.62 0.45 0.00 0.00 -1.52 0.00 0.00 31.29 30.84 2wbg h VAL 170 CO 0.03 0.02 -0.11 0.00 0.02 0.00 0.00 177.57 177.53 2wbg h ALA 171 N 1.49 -0.30 0.11 1.67 0.00 -0.96 -3.08 119.26 118.19 2wbg h ALA 171 Ca 0.27 -0.13 -0.17 0.00 0.00 0.00 0.00 54.91 54.88 2wbg h ALA 171 Cb 0.42 0.12 0.01 0.00 0.00 0.00 0.00 17.79 18.34 2wbg h ALA 171 CO -0.46 -0.30 -0.81 0.82 0.00 0.00 0.00 179.25 178.50 2wbg h ILE 172 N -1.03 1.45 -0.02 0.00 1.08 -0.61 -0.96 117.51 117.42 2wbg h ILE 172 Ca -0.03 -2.47 -0.17 0.00 -0.39 0.00 0.00 64.86 61.80 2wbg h ILE 172 Cb 0.36 3.11 -0.01 0.00 -3.07 0.00 0.00 36.82 37.21 2wbg h ILE 172 CO 0.05 0.68 -0.76 0.58 -0.69 0.00 0.00 178.15 178.02 2wbg h VAL 173 N -0.49 1.47 0.00 1.67 2.07 -1.24 0.12 116.25 119.86 2wbg h VAL 173 Ca -0.16 -2.41 -0.15 0.00 0.82 0.00 0.00 66.70 64.81 2wbg h VAL 173 Cb 1.55 2.30 -0.02 0.00 -1.52 0.00 0.00 31.29 33.60 2wbg h VAL 173 CO 0.10 0.70 -0.94 1.23 0.02 0.00 0.00 177.57 178.68 2wbg h GLY 174 N 1.85 0.00 0.00 2.17 0.00 -1.33 -1.94 103.07 103.82 2wbg h GLY 174 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.31 2wbg h GLY 174 CO 0.11 0.00 -0.23 1.42 0.00 0.00 0.00 176.54 177.84 2wbg n HIS 175 N -3.13 0.00 -0.08 5.60 8.25 -0.36 -1.32 115.22 124.18 2wbg n HIS 175 Ca -0.03 0.00 -0.17 0.00 -0.26 0.00 0.00 57.72 57.26 2wbg n HIS 175 Cb 0.82 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.87 2wbg n HIS 175 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 2wbg n LEU 176 N -0.91 1.22 0.18 2.41 7.94 -0.14 -0.81 117.00 126.89 2wbg n LEU 176 Ca 0.00 0.21 0.12 0.00 -1.11 0.00 0.00 56.01 55.23 2wbg n LEU 176 Cb 0.00 -0.50 0.11 0.00 0.53 0.00 0.00 43.42 43.56 2wbg n LEU 176 CO 0.00 0.28 0.56 1.88 -1.11 0.00 0.00 177.39 179.00 2wbg h TYR 177 N -0.60 0.00 -0.24 1.96 0.05 -1.22 -3.38 116.97 113.54 2wbg h TYR 177 Ca -0.39 0.00 -0.10 0.00 0.05 0.00 0.00 58.73 58.29 2wbg h TYR 177 Cb 1.30 0.00 -0.04 0.00 1.01 0.00 0.00 36.73 39.00 2wbg h TYR 177 CO -0.07 0.01 -0.09 0.41 -1.05 0.00 0.00 178.16 177.37 2wbg n GLY 178 N 1.13 0.61 0.13 3.88 0.00 -0.39 -4.87 105.19 105.67 2wbg n GLY 178 Ca 0.03 -0.11 0.02 0.00 0.00 0.00 0.00 46.02 45.96 2wbg n GLY 178 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2wbg h VAL 179 N 0.00 0.82 -2.15 1.61 2.07 -1.66 -3.40 116.25 113.53 2wbg h VAL 179 Ca -0.10 -2.20 -0.56 0.00 0.82 0.00 0.00 66.70 64.66 2wbg h VAL 179 Cb 0.79 2.36 -0.10 0.00 -1.52 0.00 0.00 31.29 32.82 2wbg h VAL 179 CO 0.15 0.47 -0.64 -1.00 0.02 0.00 0.00 177.57 176.57 2wbg s HIS 180 N -2.95 2.67 0.31 1.57 3.76 -1.00 -4.73 115.29 114.92 2wbg s HIS 180 Ca 0.03 -0.26 -0.28 0.00 -0.15 0.00 0.00 55.06 54.40 2wbg s HIS 180 Cb 0.08 -1.25 -0.13 0.00 1.11 0.00 0.00 32.58 32.39 2wbg s HIS 180 CO 0.76 0.59 1.11 0.00 -0.85 0.00 0.00 174.74 176.35 2wbg n ALA 181 N -0.91 0.33 0.43 -1.40 0.00 -1.26 -0.44 120.51 117.26 2wbg n ALA 181 Ca -0.06 0.38 0.06 0.00 0.00 0.00 0.00 53.44 53.82 2wbg n ALA 181 Cb 0.59 -2.11 0.20 0.00 0.00 0.00 0.00 19.45 18.14 2wbg n ALA 181 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2wbg n PRO 182 N 0.66 2.36 -2.36 0.00 -0.04 -1.23 -4.53 135.00 129.87 2wbg n PRO 182 Ca 0.08 -1.60 -0.01 0.00 -0.04 0.00 0.00 63.50 61.93 2wbg n PRO 182 Cb 0.33 -1.52 0.00 0.00 -0.04 0.00 0.00 33.50 32.28 2wbg n PRO 182 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2wbg n GLY 183 N 0.92 0.73 3.83 0.55 0.00 0.41 -5.02 105.19 106.61 2wbg n GLY 183 Ca 0.15 -0.72 -0.24 0.00 0.00 0.00 0.00 46.02 45.21 2wbg n GLY 183 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2wbg s MET 184 N -4.70 2.98 -0.44 1.61 -1.94 -0.43 -4.73 119.30 111.64 2wbg s MET 184 Ca 0.01 -0.94 0.03 0.00 -1.71 0.00 0.00 55.69 53.07 2wbg s MET 184 Cb -0.00 -2.64 0.15 0.00 2.01 0.00 0.00 34.83 34.35 2wbg s MET 184 CO 0.01 0.44 0.30 1.03 -0.01 0.00 0.00 175.02 176.80 2wbg s ARG 185 N -3.55 1.11 -0.24 2.03 0.52 -1.16 -1.26 118.95 116.40 2wbg s ARG 185 Ca 0.32 -2.05 -0.04 0.00 -0.52 0.00 0.00 55.73 53.44 2wbg s ARG 185 Cb -0.09 -1.88 0.13 0.00 0.52 0.00 0.00 34.95 33.63 2wbg s ARG 185 CO 0.25 -1.27 0.40 0.34 0.02 0.00 0.00 175.30 175.04 2wbg s ASP 186 N 0.19 -0.01 0.44 0.23 -1.08 0.01 -4.95 116.67 111.50 2wbg s ASP 186 Ca 0.24 0.48 0.24 0.00 -0.52 0.00 0.00 52.55 52.99 2wbg s ASP 186 Cb -0.11 1.25 0.92 0.00 -1.46 0.00 0.00 42.92 43.52 2wbg s ASP 186 CO -0.09 -0.28 1.82 -0.29 0.52 0.00 0.00 175.17 176.85 2wbg h ILE 187 N 6.17 0.55 0.02 4.11 2.10 -1.92 -0.21 117.51 128.33 2wbg h ILE 187 Ca -0.19 -1.12 -0.26 0.00 1.08 0.00 0.00 64.86 64.37 2wbg h ILE 187 Cb 1.14 1.77 0.02 0.00 -1.09 0.00 0.00 36.82 38.66 2wbg h ILE 187 CO 0.23 0.22 -1.02 1.88 -1.08 0.00 0.00 178.15 178.38 2wbg h TYR 188 N 0.00 1.00 -0.62 2.19 -1.99 -1.94 -2.58 116.97 113.03 2wbg h TYR 188 Ca -0.00 -0.55 -0.02 0.00 2.00 0.00 0.00 58.73 60.16 2wbg h TYR 188 Cb 0.75 -0.11 -0.03 0.00 2.00 0.00 0.00 36.73 39.34 2wbg h TYR 188 CO 0.00 1.39 0.32 0.28 -0.00 0.00 0.00 178.16 180.15 2wbg h VAL 189 N 0.32 1.21 -0.67 -2.88 2.07 -1.82 -2.35 116.25 112.13 2wbg h VAL 189 Ca -0.13 -0.56 0.02 0.00 0.82 0.00 0.00 66.70 66.85 2wbg h VAL 189 Cb 1.68 0.45 -0.04 0.00 -1.52 0.00 0.00 31.29 31.86 2wbg h VAL 189 CO 0.20 0.23 0.42 0.00 0.02 0.00 0.00 177.57 178.45 2wbg h ALA 190 N 1.14 0.86 0.00 1.67 0.00 -0.96 -0.24 119.26 121.73 2wbg h ALA 190 Ca 0.21 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 55.02 2wbg h ALA 190 Cb 0.09 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 2wbg h ALA 190 CO -0.03 0.20 -0.39 0.74 0.00 0.00 0.00 179.25 179.78 2wbg h PHE 191 N 0.84 0.00 -0.36 0.00 0.04 -1.42 -0.99 116.94 115.05 2wbg h PHE 191 Ca 0.26 0.00 -0.10 0.00 2.80 0.00 0.00 57.97 60.94 2wbg h PHE 191 Cb -0.02 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.12 2wbg h PHE 191 CO -0.04 0.39 -0.17 0.00 -0.60 0.00 0.00 178.31 177.88 2wbg h ARG 192 N 0.00 0.67 -0.44 1.51 3.08 -0.91 -2.14 114.38 116.14 2wbg h ARG 192 Ca -0.00 -0.24 -0.04 0.00 0.07 0.00 0.00 59.98 59.77 2wbg h ARG 192 Cb 1.15 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 31.13 2wbg h ARG 192 CO 0.05 0.80 0.12 0.00 -1.07 0.00 0.00 179.97 179.87 2wbg h ALA 193 N 1.21 0.58 -0.54 0.04 0.00 -0.64 0.78 119.26 120.70 2wbg h ALA 193 Ca 0.10 -0.19 0.10 0.00 0.00 0.00 0.00 54.91 54.91 2wbg h ALA 193 Cb 0.63 -0.17 -0.08 0.00 0.00 0.00 0.00 17.79 18.17 2wbg h ALA 193 CO 0.04 0.26 0.06 0.28 0.00 0.00 0.00 179.25 179.89 2wbg h VAL 194 N 0.58 0.64 -0.19 0.00 2.07 -0.99 0.11 116.25 118.47 2wbg h VAL 194 Ca 0.14 -0.06 -0.06 0.00 0.82 0.00 0.00 66.70 67.54 2wbg h VAL 194 Cb 0.30 0.44 -0.00 0.00 -1.52 0.00 0.00 31.29 30.50 2wbg h VAL 194 CO -0.00 0.03 -0.12 -0.74 0.02 0.00 0.00 177.57 176.77 2wbg h HIS 195 N 0.18 0.47 -0.29 1.57 6.17 -1.10 -2.16 115.15 119.99 2wbg h HIS 195 Ca 0.27 -0.13 -0.04 0.00 0.71 0.00 0.00 60.37 61.19 2wbg h HIS 195 Cb 0.41 -0.11 -0.02 0.00 2.52 0.00 0.00 27.41 30.21 2wbg h HIS 195 CO -0.28 0.73 0.01 -0.91 0.71 0.00 0.00 177.93 178.19 2wbg h ASN 196 N 0.08 0.40 -0.03 3.26 2.35 -0.66 -0.82 115.58 120.17 2wbg h ASN 196 Ca 0.04 -0.06 -0.00 0.00 -0.55 0.00 0.00 56.30 55.72 2wbg h ASN 196 Cb 0.62 -0.10 -0.00 0.00 0.05 0.00 0.00 38.32 38.88 2wbg h ASN 196 CO 0.03 0.46 0.01 -0.07 -1.65 0.00 0.00 177.43 176.22 2wbg h LEU 197 N 0.42 0.04 -0.33 1.61 3.38 -0.80 0.92 115.31 120.55 2wbg h LEU 197 Ca 0.09 -0.14 0.04 0.00 0.09 0.00 0.00 57.88 57.96 2wbg h LEU 197 Cb 0.27 -0.01 -0.04 0.00 0.09 0.00 0.00 40.66 40.97 2wbg h LEU 197 CO 0.01 0.17 0.12 -0.07 0.09 0.00 0.00 178.44 178.75 2wbg h LEU 198 N -0.09 0.13 -0.68 1.67 3.38 -1.05 -0.40 115.31 118.26 2wbg h LEU 198 Ca 0.01 0.04 0.06 0.00 0.09 0.00 0.00 57.88 58.07 2wbg h LEU 198 Cb 0.14 0.02 -0.05 0.00 0.09 0.00 0.00 40.66 40.86 2wbg h LEU 198 CO -0.00 0.11 0.38 0.03 0.09 0.00 0.00 178.44 179.05 2wbg h ARG 199 N 0.26 0.69 -0.27 1.13 3.08 -0.96 -1.02 114.38 117.30 2wbg h ARG 199 Ca 0.15 -0.04 -0.09 0.00 0.07 0.00 0.00 59.98 60.06 2wbg h ARG 199 Cb 0.12 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.01 2wbg h ARG 199 CO -0.15 0.46 -0.20 0.00 -1.07 0.00 0.00 179.97 179.01 2wbg h ALA 200 N 1.34 0.38 -0.52 0.04 0.00 -0.62 -2.01 119.26 117.87 2wbg h ALA 200 Ca 0.30 -0.35 0.09 0.00 0.00 0.00 0.00 54.91 54.94 2wbg h ALA 200 Cb 0.17 -0.09 -0.07 0.00 0.00 0.00 0.00 17.79 17.80 2wbg h ALA 200 CO -0.17 0.32 0.12 1.25 0.00 0.00 0.00 179.25 180.77 2wbg h HIS 201 N 0.33 0.19 -0.38 0.00 -0.00 -0.79 -0.67 115.15 113.83 2wbg h HIS 201 Ca 0.05 0.03 -0.13 0.00 -0.00 0.00 0.00 60.37 60.32 2wbg h HIS 201 Cb 0.74 -0.01 -0.01 0.00 -0.00 0.00 0.00 27.41 28.13 2wbg h HIS 201 CO 0.07 0.01 -0.29 0.00 -0.00 0.00 0.00 177.93 177.72 2wbg h ALA 202 N 1.40 0.77 -0.51 5.26 0.00 -1.10 -1.65 119.26 123.43 2wbg h ALA 202 Ca 0.26 -0.41 -0.04 0.00 0.00 0.00 0.00 54.91 54.73 2wbg h ALA 202 Cb 0.35 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 2wbg h ALA 202 CO -0.33 0.65 0.16 0.00 0.00 0.00 0.00 179.25 179.74 2wbg h ARG 203 N 0.69 0.79 -0.92 0.00 2.47 -1.03 -0.82 114.38 115.56 2wbg h ARG 203 Ca 0.08 -0.17 0.01 0.00 -1.26 0.00 0.00 59.98 58.64 2wbg h ARG 203 Cb 0.83 -0.11 -0.05 0.00 -1.65 0.00 0.00 29.97 28.99 2wbg h ARG 203 CO 0.07 0.73 0.61 0.00 0.56 0.00 0.00 179.97 181.94 2wbg h ALA 204 N 1.02 1.16 -0.41 0.04 0.00 -0.92 -1.11 119.26 119.04 2wbg h ALA 204 Ca 0.16 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 54.96 2wbg h ALA 204 Cb 0.27 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 2wbg h ALA 204 CO -0.01 0.56 0.05 0.28 0.00 0.00 0.00 179.25 180.14 2wbg h VAL 205 N 1.24 1.25 -0.54 0.00 2.07 -0.90 0.14 116.25 119.51 2wbg h VAL 205 Ca 0.34 -0.92 0.07 0.00 0.82 0.00 0.00 66.70 67.01 2wbg h VAL 205 Cb -0.14 1.04 -0.06 0.00 -1.52 0.00 0.00 31.29 30.60 2wbg h VAL 205 CO -0.07 0.32 0.20 0.50 0.02 0.00 0.00 177.57 178.53 2wbg h LYS 206 N 0.55 0.38 -0.85 1.57 3.64 -0.88 -0.87 116.57 120.11 2wbg h LYS 206 Ca 0.12 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.46 2wbg h LYS 206 Cb 0.40 -0.08 -0.04 0.00 -0.41 0.00 0.00 32.23 32.10 2wbg h LYS 206 CO 0.01 0.25 0.44 0.28 -2.27 0.00 0.00 179.45 178.16 2wbg h VAL 207 N 0.39 1.25 -0.77 2.00 2.07 -0.81 -2.77 116.25 117.61 2wbg h VAL 207 Ca 0.26 -0.65 0.12 0.00 0.82 0.00 0.00 66.70 67.25 2wbg h VAL 207 Cb 0.29 0.13 -0.08 0.00 -1.52 0.00 0.00 31.29 30.10 2wbg h VAL 207 CO -0.26 0.29 0.38 0.15 0.02 0.00 0.00 177.57 178.15 2wbg h PHE 208 N 1.19 0.67 0.00 1.57 3.57 0.58 -2.16 116.94 122.36 2wbg h PHE 208 Ca 0.30 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.79 2wbg h PHE 208 Cb 0.06 -0.18 -0.01 0.00 2.79 0.00 0.00 35.95 38.61 2wbg h PHE 208 CO 0.01 0.19 -0.19 0.00 -2.23 0.00 0.00 178.31 176.09 2wbg h ARG 209 N 0.59 0.00 0.00 1.11 2.47 -0.96 -0.50 114.38 117.08 2wbg h ARG 209 Ca 0.40 0.00 -0.04 0.00 -1.26 0.00 0.00 59.98 59.08 2wbg h ARG 209 Cb 0.52 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.83 2wbg h ARG 209 CO -0.33 0.19 -0.20 0.93 0.56 0.00 0.00 179.97 181.12 2wbg h GLU 210 N 0.00 0.00 0.00 0.04 5.08 -1.40 -3.42 114.58 114.88 2wbg h GLU 210 Ca -0.00 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.31 2wbg h GLU 210 Cb 0.49 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.74 2wbg h GLU 210 CO 0.02 0.20 -1.16 0.25 -1.00 0.00 0.00 179.01 177.33 2wbg n THR 211 N -3.17 0.16 -3.71 1.13 -2.24 -0.66 -4.88 114.28 100.92 2wbg n THR 211 Ca 0.03 -0.05 -0.36 0.00 -2.27 0.00 0.00 64.05 61.40 2wbg n THR 211 Cb 0.58 -1.02 -0.09 0.00 -2.10 0.00 0.00 70.33 67.71 2wbg n THR 211 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2wbg s VAL 212 N -2.05 3.87 0.32 2.28 1.01 -0.29 -4.95 120.40 120.59 2wbg s VAL 212 Ca -0.04 -3.43 0.17 0.00 0.00 0.00 0.00 61.98 58.68 2wbg s VAL 212 Cb 0.01 -3.48 0.13 0.00 0.00 0.00 0.00 36.38 33.05 2wbg s VAL 212 CO 0.06 -0.97 1.83 0.11 0.00 0.00 0.00 175.10 176.13 2wbg h LYS 213 N 6.49 0.00 -0.44 2.72 1.79 -1.84 -2.93 116.57 122.36 2wbg h LYS 213 Ca 0.06 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.53 2wbg h LYS 213 Cb 0.88 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.53 2wbg h LYS 213 CO 0.76 0.34 0.00 -0.40 -1.08 0.00 0.00 179.45 179.07 2wbg n ASP 214 N -3.84 3.88 -4.98 0.86 5.75 -1.26 -5.01 116.55 111.94 2wbg n ASP 214 Ca -0.01 -2.44 -0.19 0.00 -0.01 0.00 0.00 54.79 52.13 2wbg n ASP 214 Cb 0.42 -0.45 0.04 0.00 -1.03 0.00 0.00 41.12 40.10 2wbg n ASP 214 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 2wbg s GLY 215 N -1.23 1.84 -0.03 6.12 0.00 -1.11 -5.01 107.32 107.90 2wbg s GLY 215 Ca 0.39 -1.79 0.04 0.00 0.00 0.00 0.00 44.72 43.36 2wbg s GLY 215 CO 0.17 -1.46 -0.16 0.54 0.00 0.00 0.00 173.10 172.19 2wbg s LYS 216 N -4.59 1.49 -0.01 2.90 1.02 0.88 -5.03 119.74 116.40 2wbg s LYS 216 Ca 0.59 -0.55 0.03 0.00 0.02 0.00 0.00 55.97 56.06 2wbg s LYS 216 Cb -0.08 -1.35 -0.01 0.00 -0.52 0.00 0.00 37.83 35.87 2wbg s LYS 216 CO 0.37 0.26 -0.11 -1.50 -0.92 0.00 0.00 175.35 173.45 2wbg s ILE 217 N -0.10 0.90 0.00 2.17 2.07 -1.26 -1.13 121.20 123.86 2wbg s ILE 217 Ca 0.00 -0.47 0.00 0.00 -1.41 0.00 0.00 60.65 58.77 2wbg s ILE 217 Cb -0.09 -0.76 0.00 0.00 0.13 0.00 0.00 42.46 41.74 2wbg s ILE 217 CO 0.01 0.26 0.00 0.61 -1.91 0.00 0.00 174.94 173.91 2wbg n GLY 218 N 2.92 4.88 3.29 1.50 0.00 0.43 -0.95 105.19 117.26 2wbg n GLY 218 Ca -0.15 -1.31 -0.14 0.00 0.00 0.00 0.00 46.02 44.42 2wbg n GLY 218 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2wbg s ILE 219 N -1.18 0.04 -0.07 -0.61 2.07 -1.24 -1.13 121.20 119.09 2wbg s ILE 219 Ca 0.00 -0.37 0.05 0.00 -1.41 0.00 0.00 60.65 58.92 2wbg s ILE 219 Cb 0.00 -0.68 -0.02 0.00 0.13 0.00 0.00 42.46 41.89 2wbg s ILE 219 CO 0.00 -0.20 -0.20 -0.69 -1.91 0.00 0.00 174.94 171.93 2wbg s VAL 220 N -1.23 2.47 -0.03 4.00 1.01 -0.90 -0.40 120.40 125.33 2wbg s VAL 220 Ca -0.12 -0.92 0.05 0.00 0.00 0.00 0.00 61.98 60.99 2wbg s VAL 220 Cb -0.04 -1.94 -0.01 0.00 0.00 0.00 0.00 36.38 34.39 2wbg s VAL 220 CO 0.05 0.57 -0.18 -0.36 0.00 0.00 0.00 175.10 175.18 2wbg s PHE 221 N -0.24 1.64 0.55 5.22 0.08 -0.22 -0.83 117.98 124.19 2wbg s PHE 221 Ca -0.00 -0.38 -0.18 0.00 0.12 0.00 0.00 56.93 56.49 2wbg s PHE 221 Cb -0.13 -1.08 -0.06 0.00 -0.57 0.00 0.00 43.02 41.18 2wbg s PHE 221 CO 0.03 -0.08 1.05 0.54 -0.10 0.00 0.00 175.22 176.66 2wbg s ASN 222 N -0.24 6.00 -0.19 1.36 4.22 -1.26 -0.41 114.94 124.43 2wbg s ASN 222 Ca 0.03 1.87 -0.19 0.00 -2.14 0.00 0.00 52.86 52.43 2wbg s ASN 222 Cb -0.09 -2.55 0.05 0.00 1.28 0.00 0.00 41.25 39.95 2wbg s ASN 222 CO 0.00 -1.02 0.53 0.20 -2.04 0.00 0.00 177.10 174.77 2wbg s ASN 223 N -2.44 -0.55 0.17 3.54 0.01 -1.01 -4.13 114.94 110.54 2wbg s ASN 223 Ca 0.65 1.03 0.08 0.00 -0.71 0.00 0.00 52.86 53.91 2wbg s ASN 223 Cb -0.16 1.04 -0.04 0.00 0.41 0.00 0.00 41.25 42.49 2wbg s ASN 223 CO 0.30 -0.21 -0.16 -0.83 -1.51 0.00 0.00 177.10 174.70 2wbg s GLY 224 N 0.18 1.34 -0.50 0.66 0.00 -1.26 -4.14 107.32 103.59 2wbg s GLY 224 Ca -0.01 -1.52 -0.17 0.00 0.00 0.00 0.00 44.72 43.02 2wbg s GLY 224 CO 0.01 -1.59 0.54 -0.47 0.00 0.00 0.00 173.10 171.59 2wbg s TYR 225 N -2.47 3.13 -0.14 1.90 5.04 -0.88 -4.96 117.35 118.98 2wbg s TYR 225 Ca 0.17 -0.78 -0.15 0.00 -2.44 0.00 0.00 57.07 53.87 2wbg s TYR 225 Cb -0.03 -3.46 -0.04 0.00 0.35 0.00 0.00 41.96 38.77 2wbg s TYR 225 CO 0.06 -0.97 0.36 -0.06 -1.34 0.00 0.00 175.55 173.60 2wbg s PHE 226 N 2.19 3.48 0.13 4.97 0.08 -1.26 -0.91 117.98 126.67 2wbg s PHE 226 Ca 0.10 0.71 0.09 0.00 0.12 0.00 0.00 56.93 57.95 2wbg s PHE 226 Cb -0.22 -2.42 -0.04 0.00 -0.57 0.00 0.00 43.02 39.77 2wbg s PHE 226 CO 0.09 0.21 -0.21 -1.21 -0.10 0.00 0.00 175.22 174.00 2wbg s GLU 227 N 0.51 1.23 0.14 0.44 2.02 -0.44 -4.97 118.70 117.63 2wbg s GLU 227 Ca 0.20 -1.29 -0.30 0.00 0.02 0.00 0.00 54.97 53.60 2wbg s GLU 227 Cb -0.14 -1.45 -0.07 0.00 0.10 0.00 0.00 34.13 32.57 2wbg s GLU 227 CO 0.06 0.32 0.96 -1.25 0.02 0.00 0.00 175.26 175.38 2wbg s PRO 228 N -2.29 4.73 0.50 0.39 0.04 -1.26 -0.97 135.00 136.14 2wbg s PRO 228 Ca 0.11 1.47 0.25 0.00 0.04 0.00 0.00 61.00 62.87 2wbg s PRO 228 Cb -0.08 -3.35 1.34 0.00 0.04 0.00 0.00 34.50 32.44 2wbg s PRO 228 CO 0.06 0.28 2.04 0.00 0.04 0.00 0.00 177.00 179.42 2wbg h ALA 229 N 5.23 1.34 -2.97 8.56 0.00 -1.26 -3.45 119.26 126.71 2wbg h ALA 229 Ca -0.43 -0.13 -0.06 0.00 0.00 0.00 0.00 54.91 54.28 2wbg h ALA 229 Cb 1.21 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.94 2wbg h ALA 229 CO 0.71 0.18 0.13 -1.54 0.00 0.00 0.00 179.25 178.72 2wbg s SER 230 N -6.32 0.14 -0.10 0.00 1.04 -1.26 -5.04 113.70 102.16 2wbg s SER 230 Ca -0.03 -1.10 0.13 0.00 0.48 0.00 0.00 55.95 55.43 2wbg s SER 230 Cb 0.13 0.76 0.55 0.00 0.10 0.00 0.00 66.02 67.57 2wbg s SER 230 CO 0.61 -1.49 1.41 -1.84 0.98 0.00 0.00 173.24 172.91 2wbg n GLU 231 N -0.51 3.20 -1.68 4.02 0.00 -1.26 -4.49 120.64 119.92 2wbg n GLU 231 Ca -0.05 -2.18 -0.39 0.00 0.00 0.00 0.00 57.16 54.54 2wbg n GLU 231 Cb 0.60 -1.80 0.03 0.00 0.00 0.00 0.00 31.44 30.28 2wbg n GLU 231 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 2wbg n LYS 232 N 0.73 1.48 0.12 3.44 5.02 -1.26 -4.84 118.16 122.85 2wbg n LYS 232 Ca 0.20 0.54 0.02 0.00 -2.02 0.00 0.00 58.31 57.04 2wbg n LYS 232 Cb 0.74 -2.33 0.36 0.00 -0.02 0.00 0.00 35.03 33.78 2wbg n LYS 232 CO 0.00 0.00 0.00 1.49 -0.52 0.00 0.00 177.40 178.37 2wbg h GLU 233 N 1.35 0.22 0.00 1.97 4.57 -2.00 -2.14 114.58 118.55 2wbg h GLU 233 Ca -0.48 -0.06 -0.00 0.00 -1.18 0.00 0.00 59.36 57.63 2wbg h GLU 233 Cb 1.32 -0.02 -0.00 0.00 -0.16 0.00 0.00 28.75 29.89 2wbg h GLU 233 CO 0.56 0.42 -0.02 1.05 -1.18 0.00 0.00 179.01 179.84 2wbg h GLU 234 N 0.20 0.00 0.21 1.92 9.09 -1.96 -1.54 114.58 122.50 2wbg h GLU 234 Ca 0.04 0.00 -0.29 0.00 0.05 0.00 0.00 59.36 59.16 2wbg h GLU 234 Cb 0.48 0.00 0.03 0.00 -1.65 0.00 0.00 28.75 27.61 2wbg h GLU 234 CO 0.03 0.02 -1.27 -0.44 0.05 0.00 0.00 179.01 177.41 2wbg h ASP 235 N 0.00 0.71 -0.11 3.06 3.32 -1.70 -2.14 116.42 119.56 2wbg h ASP 235 Ca -0.00 -0.93 -0.08 0.00 0.02 0.00 0.00 57.03 56.04 2wbg h ASP 235 Cb 0.67 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.97 2wbg h ASP 235 CO 0.00 1.61 -0.17 0.40 -1.72 0.00 0.00 179.24 179.36 2wbg h ILE 236 N -0.04 1.24 -0.10 0.35 2.04 -1.31 -2.03 117.51 117.66 2wbg h ILE 236 Ca -0.22 -1.11 -0.16 0.00 1.00 0.00 0.00 64.86 64.36 2wbg h ILE 236 Cb 1.99 1.22 -0.01 0.00 -0.74 0.00 0.00 36.82 39.28 2wbg h ILE 236 CO 0.23 0.36 -0.63 -0.09 0.00 0.00 0.00 178.15 178.02 2wbg h ARG 237 N 0.45 0.37 -0.65 2.37 9.65 -1.36 -2.18 114.38 123.03 2wbg h ARG 237 Ca 0.08 -0.26 0.00 0.00 -1.10 0.00 0.00 59.98 58.70 2wbg h ARG 237 Cb 0.56 0.04 -0.03 0.00 -1.39 0.00 0.00 29.97 29.15 2wbg h ARG 237 CO 0.04 0.88 0.41 0.00 2.80 0.00 0.00 179.97 184.10 2wbg h ALA 238 N 1.06 0.82 -0.29 2.80 0.00 -0.88 0.52 119.26 123.29 2wbg h ALA 238 Ca -0.01 -0.06 0.04 0.00 0.00 0.00 0.00 54.91 54.88 2wbg h ALA 238 Cb 1.16 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 18.66 2wbg h ALA 238 CO 0.11 0.27 0.06 0.28 0.00 0.00 0.00 179.25 179.97 2wbg h VAL 239 N 0.88 0.87 -0.62 0.00 2.07 -1.27 0.24 116.25 118.42 2wbg h VAL 239 Ca 0.24 -0.06 0.05 0.00 0.82 0.00 0.00 66.70 67.75 2wbg h VAL 239 Cb -0.07 0.69 -0.05 0.00 -1.52 0.00 0.00 31.29 30.34 2wbg h VAL 239 CO -0.05 0.03 0.34 0.03 0.02 0.00 0.00 177.57 177.94 2wbg h ARG 240 N 0.17 0.61 -0.15 1.57 3.08 -0.73 0.61 114.38 119.54 2wbg h ARG 240 Ca 0.13 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.14 2wbg h ARG 240 Cb 0.14 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.04 2wbg h ARG 240 CO -0.17 0.41 0.06 0.35 -1.07 0.00 0.00 179.97 179.55 2wbg h PHE 241 N 0.63 0.23 -0.30 3.04 3.57 -0.55 -0.48 116.94 123.08 2wbg h PHE 241 Ca 0.27 -0.02 0.02 0.00 3.53 0.00 0.00 57.97 61.77 2wbg h PHE 241 Cb 0.16 -0.07 -0.02 0.00 2.79 0.00 0.00 35.95 38.81 2wbg h PHE 241 CO -0.08 0.29 0.16 0.52 -2.23 0.00 0.00 178.31 176.97 2wbg h MET 242 N 0.10 0.32 -0.43 1.11 2.86 -0.39 0.34 114.93 118.84 2wbg h MET 242 Ca 0.05 -0.02 0.09 0.00 -2.06 0.00 0.00 59.70 57.76 2wbg h MET 242 Cb 0.16 -0.07 -0.08 0.00 0.06 0.00 0.00 31.60 31.67 2wbg h MET 242 CO -0.00 0.21 -0.06 1.25 1.06 0.00 0.00 176.91 179.37 2wbg h HIS 243 N 0.33 -0.14 -0.08 -0.22 -0.00 -0.82 0.38 115.15 114.60 2wbg h HIS 243 Ca 0.12 0.04 -0.11 0.00 -0.00 0.00 0.00 60.37 60.42 2wbg h HIS 243 Cb 0.02 0.13 -0.01 0.00 -0.00 0.00 0.00 27.41 27.55 2wbg h HIS 243 CO -0.09 -0.15 -0.45 1.96 -0.00 0.00 0.00 177.93 179.21 2wbg h GLN 244 N 0.04 0.18 0.07 5.26 4.20 -0.17 -2.67 115.11 122.03 2wbg h GLN 244 Ca 0.21 -0.09 -0.30 0.00 0.06 0.00 0.00 58.65 58.53 2wbg h GLN 244 Cb 0.32 0.00 -0.02 0.00 0.30 0.00 0.00 27.48 28.08 2wbg h GLN 244 CO -0.41 0.60 -1.62 0.35 -0.67 0.00 0.00 178.83 177.07 2wbg h PHE 245 N 0.15 0.27 0.00 2.96 3.57 -0.85 -2.50 116.94 120.53 2wbg h PHE 245 Ca 0.01 -0.20 -0.08 0.00 3.53 0.00 0.00 57.97 61.23 2wbg h PHE 245 Cb 0.85 -0.01 -0.01 0.00 2.79 0.00 0.00 35.95 39.57 2wbg h PHE 245 CO 0.01 1.64 -1.14 -0.91 -2.23 0.00 0.00 178.31 175.68 2wbg h ASN 246 N -0.43 0.00 -3.75 0.41 2.35 -0.33 -3.43 115.58 110.40 2wbg h ASN 246 Ca -0.38 0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.34 2wbg h ASN 246 Cb 1.69 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 40.06 2wbg h ASN 246 CO -0.05 0.29 -0.01 0.59 -1.65 0.00 0.00 177.43 176.60 2wbg n ASN 247 N -2.81 0.87 0.01 5.81 3.02 -1.01 -4.51 115.26 116.64 2wbg n ASN 247 Ca -0.04 -1.10 0.21 0.00 -0.03 0.00 0.00 54.58 53.62 2wbg n ASN 247 Cb 0.69 -0.01 0.72 0.00 -0.61 0.00 0.00 39.78 40.57 2wbg n ASN 247 CO 0.00 0.00 0.00 0.10 -2.62 0.00 0.00 177.26 174.74 2wbg h TYR 248 N 0.39 0.00 -0.28 3.10 -0.00 -1.79 -2.94 116.97 115.45 2wbg h TYR 248 Ca -0.02 0.00 0.08 0.00 0.00 0.00 0.00 58.73 58.79 2wbg h TYR 248 Cb 0.07 0.00 -0.01 0.00 0.00 0.00 0.00 36.73 36.79 2wbg h TYR 248 CO 0.00 0.00 0.22 -1.35 -0.00 0.00 0.00 178.16 177.03 2wbg h PRO 249 N 0.00 0.00 -0.49 0.10 0.11 -1.77 0.20 132.00 130.15 2wbg h PRO 249 Ca 0.25 0.00 0.05 0.00 0.11 0.00 0.00 66.00 66.41 2wbg h PRO 249 Cb 1.08 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.16 2wbg h PRO 249 CO -0.00 0.00 0.33 1.25 -0.21 0.00 0.00 178.00 179.36 2wbg h LEU 250 N 0.00 0.39 0.00 2.35 5.85 -1.25 -0.09 115.31 122.56 2wbg h LEU 250 Ca 0.13 -0.00 -0.28 0.00 0.84 0.00 0.00 57.88 58.57 2wbg h LEU 250 Cb 0.56 -0.09 -0.05 0.00 0.37 0.00 0.00 40.66 41.45 2wbg h LEU 250 CO -0.00 0.26 -2.07 0.49 -0.34 0.00 0.00 178.44 176.78 2wbg n PHE 251 N -4.48 0.00 0.15 1.25 3.72 -0.56 -4.43 117.46 113.12 2wbg n PHE 251 Ca 0.06 0.00 0.03 0.00 -0.05 0.00 0.00 57.45 57.49 2wbg n PHE 251 Cb 0.22 -0.76 0.08 0.00 -0.94 0.00 0.00 39.48 38.08 2wbg n PHE 251 CO 0.00 0.00 0.00 -0.07 -0.05 0.00 0.00 176.76 176.64 2wbg h LEU 252 N 0.00 0.00 -0.20 4.37 3.38 -0.48 -1.90 115.31 120.48 2wbg h LEU 252 Ca -0.41 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.53 2wbg h LEU 252 Cb 1.93 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 42.67 2wbg h LEU 252 CO 0.02 0.48 0.03 -1.13 0.09 0.00 0.00 178.44 177.93 2wbg h ASN 253 N 0.00 0.33 -0.12 -0.43 -1.24 -1.23 0.26 115.58 113.15 2wbg h ASN 253 Ca -0.00 -0.27 0.02 0.00 0.71 0.00 0.00 56.30 56.76 2wbg h ASN 253 Cb 1.31 -0.09 -0.02 0.00 0.73 0.00 0.00 38.32 40.25 2wbg h ASN 253 CO 0.06 0.52 -0.02 -0.65 -1.29 0.00 0.00 177.43 176.05 2wbg h PRO 254 N 0.12 0.01 -0.44 6.67 0.11 -1.19 0.46 132.00 137.75 2wbg h PRO 254 Ca 0.06 -0.00 -0.04 0.00 0.11 0.00 0.00 66.00 66.13 2wbg h PRO 254 Cb 0.33 -0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.42 2wbg h PRO 254 CO 0.01 0.01 0.13 0.82 -0.21 0.00 0.00 178.00 178.75 2wbg h ILE 255 N 0.01 1.22 0.00 4.15 2.04 -1.10 -1.31 117.51 122.53 2wbg h ILE 255 Ca 0.06 -0.75 -0.33 0.00 1.00 0.00 0.00 64.86 64.83 2wbg h ILE 255 Cb 0.08 0.88 -0.06 0.00 -0.74 0.00 0.00 36.82 36.98 2wbg h ILE 255 CO -0.11 0.27 -2.01 -1.22 0.00 0.00 0.00 178.15 175.07 2wbg n TYR 256 N -4.55 0.58 0.31 1.37 4.01 0.88 -4.38 117.16 115.38 2wbg n TYR 256 Ca 0.00 0.20 0.03 0.00 -0.16 0.00 0.00 57.90 57.98 2wbg n TYR 256 Cb 0.19 -1.11 -0.02 0.00 -0.31 0.00 0.00 39.34 38.10 2wbg n TYR 256 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 2wbg n ARG 257 N -2.95 3.51 -1.38 -0.72 1.74 0.15 -5.03 116.66 111.99 2wbg n ARG 257 Ca -0.25 -0.26 -0.03 0.00 -0.77 0.00 0.00 57.85 56.54 2wbg n ARG 257 Cb 1.09 -0.90 -0.01 0.00 -1.02 0.00 0.00 32.46 31.62 2wbg n ARG 257 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2wbg n GLY 258 N 0.95 0.52 3.57 -0.13 0.00 -0.49 -4.94 105.19 104.67 2wbg n GLY 258 Ca 0.02 -0.87 -0.09 0.00 0.00 0.00 0.00 46.02 45.07 2wbg n GLY 258 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2wbg s ASP 259 N -2.93 -0.42 0.79 1.61 -1.08 -1.22 -4.84 116.67 108.57 2wbg s ASP 259 Ca 0.00 -0.18 -0.11 0.00 -0.52 0.00 0.00 52.55 51.74 2wbg s ASP 259 Cb 0.00 0.58 0.07 0.00 -1.46 0.00 0.00 42.92 42.11 2wbg s ASP 259 CO 0.00 -0.98 1.11 -0.31 0.52 0.00 0.00 175.17 175.51 2wbg s TYR 260 N -3.62 2.33 0.74 -5.34 2.02 -1.26 -1.32 117.35 110.90 2wbg s TYR 260 Ca 0.05 1.61 -0.14 0.00 -0.37 0.00 0.00 57.07 58.23 2wbg s TYR 260 Cb -0.02 -3.16 0.05 0.00 -0.40 0.00 0.00 41.96 38.42 2wbg s TYR 260 CO -0.06 -2.07 1.16 -2.14 -1.57 0.00 0.00 175.55 170.87 2wbg s PRO 261 N -4.66 2.16 0.12 -1.71 0.02 -1.26 -4.78 135.00 124.88 2wbg s PRO 261 Ca 0.64 1.57 -0.25 0.00 0.02 0.00 0.00 61.00 62.98 2wbg s PRO 261 Cb -0.20 -1.86 -0.06 0.00 0.02 0.00 0.00 34.50 32.41 2wbg s PRO 261 CO 0.54 -1.78 1.65 1.49 -0.33 0.00 0.00 177.00 178.57 2wbg h GLU 262 N -0.53 -0.36 -0.36 5.54 4.81 -1.99 -1.31 114.58 120.39 2wbg h GLU 262 Ca -0.46 0.02 -0.01 0.00 -0.13 0.00 0.00 59.36 58.78 2wbg h GLU 262 Cb 1.27 0.08 -0.02 0.00 0.63 0.00 0.00 28.75 30.71 2wbg h GLU 262 CO 0.50 -0.24 0.18 -0.07 -0.73 0.00 0.00 179.01 178.65 2wbg h LEU 263 N -0.37 0.43 -0.23 1.64 3.38 -1.95 -0.04 115.31 118.17 2wbg h LEU 263 Ca 0.06 -0.03 -0.05 0.00 0.09 0.00 0.00 57.88 57.94 2wbg h LEU 263 Cb 0.44 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 2wbg h LEU 263 CO -0.19 0.37 -0.06 0.58 0.09 0.00 0.00 178.44 179.22 2wbg h VAL 264 N 0.50 1.29 -0.82 1.22 2.07 -1.81 -2.25 116.25 116.44 2wbg h VAL 264 Ca 0.13 -1.07 -0.02 0.00 0.82 0.00 0.00 66.70 66.55 2wbg h VAL 264 Cb 0.04 1.51 -0.04 0.00 -1.52 0.00 0.00 31.29 31.28 2wbg h VAL 264 CO -0.02 0.33 0.42 -0.07 0.02 0.00 0.00 177.57 178.26 2wbg h LEU 265 N 0.19 1.03 -0.90 2.57 3.38 -0.95 0.14 115.31 120.77 2wbg h LEU 265 Ca 0.06 -0.10 0.02 0.00 0.09 0.00 0.00 57.88 57.94 2wbg h LEU 265 Cb 0.53 -0.26 -0.05 0.00 0.09 0.00 0.00 40.66 40.97 2wbg h LEU 265 CO 0.02 0.85 0.59 -0.08 0.09 0.00 0.00 178.44 179.91 2wbg h GLU 266 N 1.15 1.16 0.18 1.13 4.81 -0.92 -1.70 114.58 120.38 2wbg h GLU 266 Ca 0.29 -0.07 -0.31 0.00 -0.13 0.00 0.00 59.36 59.14 2wbg h GLU 266 Cb 0.06 -0.26 0.02 0.00 0.63 0.00 0.00 28.75 29.20 2wbg h GLU 266 CO -0.04 0.77 -1.34 0.35 -0.73 0.00 0.00 179.01 178.01 2wbg h PHE 267 N 1.19 0.80 0.00 0.92 3.57 -0.89 -3.41 116.94 119.13 2wbg h PHE 267 Ca 0.34 -0.57 0.00 0.00 3.53 0.00 0.00 57.97 61.27 2wbg h PHE 267 Cb -0.10 -0.04 0.00 0.00 2.79 0.00 0.00 35.95 38.60 2wbg h PHE 267 CO -0.01 1.44 0.00 0.00 -2.23 0.00 0.00 178.31 177.51 2wbg n ALA 268 N -2.64 1.98 -0.33 2.41 0.00 0.45 -4.68 120.51 117.71 2wbg n ALA 268 Ca -0.13 -0.76 0.15 0.00 0.00 0.00 0.00 53.44 52.71 2wbg n ALA 268 Cb 1.05 0.00 0.31 0.00 0.00 0.00 0.00 19.45 20.81 2wbg n ALA 268 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.50 177.41 2wbg h ARG 269 N 0.00 0.04 -0.37 0.00 2.43 -1.47 0.94 114.38 115.95 2wbg h ARG 269 Ca 0.00 -0.00 0.02 0.00 -0.81 0.00 0.00 59.98 59.18 2wbg h ARG 269 Cb 0.39 -0.01 -0.02 0.00 -0.42 0.00 0.00 29.97 29.91 2wbg h ARG 269 CO 0.00 0.03 0.25 1.49 -1.51 0.00 0.00 179.97 180.22 2wbg h GLU 270 N 0.04 0.43 0.00 0.20 4.57 -1.86 -3.09 114.58 114.87 2wbg h GLU 270 Ca 0.61 -0.03 -0.04 0.00 -1.18 0.00 0.00 59.36 58.72 2wbg h GLU 270 Cb 1.28 -0.10 -0.01 0.00 -0.16 0.00 0.00 28.75 29.77 2wbg h GLU 270 CO -0.85 0.29 -1.14 0.66 -1.18 0.00 0.00 179.01 176.78 2wbg n TYR 271 N -4.48 0.94 -2.38 0.92 4.01 0.30 -4.88 117.16 111.58 2wbg n TYR 271 Ca 0.03 0.28 -0.33 0.00 -0.16 0.00 0.00 57.90 57.72 2wbg n TYR 271 Cb 0.11 -0.98 -0.02 0.00 -0.31 0.00 0.00 39.34 38.14 2wbg n TYR 271 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 2wbg s LEU 272 N -5.43 3.70 0.37 7.72 1.43 -1.05 -4.38 118.68 121.05 2wbg s LEU 272 Ca -0.01 1.81 -0.25 0.00 -1.03 0.00 0.00 54.13 54.64 2wbg s LEU 272 Cb 0.09 -4.54 -0.12 0.00 0.03 0.00 0.00 46.19 41.65 2wbg s LEU 272 CO 0.80 -0.84 0.96 -2.65 0.23 0.00 0.00 176.35 174.85 2wbg n PRO 273 N -1.40 1.26 -0.08 1.29 -0.02 -1.26 -4.88 135.00 129.92 2wbg n PRO 273 Ca 0.08 0.45 -0.04 0.00 -2.02 0.00 0.00 63.50 61.97 2wbg n PRO 273 Cb 0.53 -1.91 0.17 0.00 -0.02 0.00 0.00 33.50 32.27 2wbg n PRO 273 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 2wbg h GLU 274 N 1.62 0.72 -1.00 -0.52 4.57 -1.94 -2.81 114.58 115.22 2wbg h GLU 274 Ca -0.42 -0.22 -0.56 0.00 -1.18 0.00 0.00 59.36 56.99 2wbg h GLU 274 Cb 1.35 -0.07 -0.30 0.00 -0.16 0.00 0.00 28.75 29.56 2wbg h GLU 274 CO 0.58 0.78 0.71 0.09 -1.18 0.00 0.00 179.01 179.99 2wbg n ASN 275 N -4.19 4.85 -0.01 1.04 5.03 -1.26 -4.60 115.26 116.12 2wbg n ASN 275 Ca 0.02 -3.64 0.03 0.00 0.87 0.00 0.00 54.58 51.86 2wbg n ASN 275 Cb 0.33 -0.88 0.40 0.00 -1.02 0.00 0.00 39.78 38.62 2wbg n ASN 275 CO 0.00 0.00 0.00 0.10 -1.83 0.00 0.00 177.26 175.53 2wbg h TYR 276 N 1.27 0.54 0.00 3.10 -0.00 -1.86 -2.41 116.97 117.60 2wbg h TYR 276 Ca 0.62 0.00 -0.01 0.00 0.00 0.00 0.00 58.73 59.34 2wbg h TYR 276 Cb 2.27 -0.18 -0.00 0.00 0.00 0.00 0.00 36.73 38.82 2wbg h TYR 276 CO 1.53 0.36 -0.06 -0.22 -0.00 0.00 0.00 178.16 179.78 2wbg h LYS 277 N 0.57 0.00 -0.27 0.10 3.64 -1.86 0.03 116.57 118.79 2wbg h LYS 277 Ca 0.15 0.00 0.08 0.00 -1.27 0.00 0.00 60.65 59.61 2wbg h LYS 277 Cb -0.02 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.79 2wbg h LYS 277 CO -0.03 0.06 0.43 -0.44 -2.27 0.00 0.00 179.45 177.20 2wbg h ASP 278 N 0.00 0.00 0.40 4.20 3.32 -1.81 -0.94 116.42 121.59 2wbg h ASP 278 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2wbg h ASP 278 Cb 0.12 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.67 2wbg h ASP 278 CO 0.01 0.00 -0.70 0.47 -1.72 0.00 0.00 179.24 177.30 2wbg n ASP 279 N -3.39 0.63 -0.02 6.45 8.00 -0.00 -4.41 116.55 123.81 2wbg n ASP 279 Ca 0.04 -0.38 -0.02 0.00 0.71 0.00 0.00 54.79 55.15 2wbg n ASP 279 Cb 0.56 0.50 0.25 0.00 -0.02 0.00 0.00 41.12 42.41 2wbg n ASP 279 CO 0.00 0.00 0.00 0.24 -0.39 0.00 0.00 177.20 177.05 2wbg h MET 280 N 0.00 0.56 -0.24 -1.24 2.86 -1.26 -1.95 114.93 113.66 2wbg h MET 280 Ca 0.00 -0.14 0.03 0.00 -2.06 0.00 0.00 59.70 57.53 2wbg h MET 280 Cb 0.55 -0.07 -0.03 0.00 0.06 0.00 0.00 31.60 32.11 2wbg h MET 280 CO 0.00 0.63 0.04 1.03 1.06 0.00 0.00 176.91 179.67 2wbg h SER 281 N 0.53 0.00 -0.26 1.22 0.87 -1.77 -2.23 113.55 111.91 2wbg h SER 281 Ca 0.11 0.04 -0.05 0.00 -1.23 0.00 0.00 61.79 60.65 2wbg h SER 281 Cb 0.42 0.05 -0.02 0.00 -0.44 0.00 0.00 62.40 62.42 2wbg h SER 281 CO 0.02 0.03 0.01 -0.33 -0.53 0.00 0.00 176.83 176.03 2wbg h GLU 282 N 0.13 0.57 0.00 2.24 5.08 -1.78 -2.65 114.58 118.17 2wbg h GLU 282 Ca 0.11 -0.12 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2wbg h GLU 282 Cb 0.11 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.28 2wbg h GLU 282 CO -0.15 0.59 0.00 0.82 -1.00 0.00 0.00 179.01 179.27 2wbg h ILE 283 N 0.54 0.00 -0.12 3.13 2.04 -0.76 -2.78 117.51 119.56 2wbg h ILE 283 Ca 0.12 -0.21 0.00 0.00 1.00 0.00 0.00 64.86 65.76 2wbg h ILE 283 Cb 0.34 1.18 0.00 0.00 -0.74 0.00 0.00 36.82 37.60 2wbg h ILE 283 CO 0.01 0.00 0.00 0.00 0.00 0.00 0.00 178.15 178.16 2wbg n GLN 284 N -3.02 1.38 -1.70 2.37 6.02 -1.00 -4.49 117.38 116.95 2wbg n GLN 284 Ca -0.01 -0.59 -0.66 0.00 -0.01 0.00 0.00 57.00 55.73 2wbg n GLN 284 Cb 0.17 -1.26 -0.10 0.00 1.02 0.00 0.00 30.24 30.07 2wbg n GLN 284 CO 0.00 0.00 0.00 -1.91 -1.01 0.00 0.00 177.06 174.14 2wbg n GLU 285 N -0.13 0.01 -1.88 -1.09 4.07 -1.05 -4.77 120.64 115.80 2wbg n GLU 285 Ca 0.11 0.00 -0.42 0.00 -0.06 0.00 0.00 57.16 56.80 2wbg n GLU 285 Cb 0.18 -1.50 -0.02 0.00 -0.06 0.00 0.00 31.44 30.03 2wbg n GLU 285 CO 0.00 0.00 0.00 0.21 -0.06 0.00 0.00 177.13 177.28 2wbg s LYS 286 N 2.38 4.19 0.21 5.31 2.20 -1.26 -5.02 119.74 127.75 2wbg s LYS 286 Ca 1.02 2.45 0.08 0.00 -0.36 0.00 0.00 55.97 59.16 2wbg s LYS 286 Cb -1.45 -3.08 -0.04 0.00 -1.51 0.00 0.00 37.83 31.75 2wbg s LYS 286 CO 0.77 -0.57 0.04 0.96 -0.36 0.00 0.00 175.35 176.19 2wbg s ILE 287 N 0.35 3.84 -0.12 5.43 -4.36 -1.26 -5.00 121.20 120.08 2wbg s ILE 287 Ca 0.65 -1.51 0.17 0.00 -0.26 0.00 0.00 60.65 59.69 2wbg s ILE 287 Cb -0.45 -2.99 -0.14 0.00 1.25 0.00 0.00 42.46 40.12 2wbg s ILE 287 CO 0.41 -0.22 0.80 0.47 0.24 0.00 0.00 174.94 176.64 2wbg n ASP 288 N -0.52 0.84 -3.43 4.36 8.00 -0.12 -4.93 116.55 120.74 2wbg n ASP 288 Ca -0.08 0.37 -0.13 0.00 0.71 0.00 0.00 54.79 55.66 2wbg n ASP 288 Cb 0.57 0.18 -0.03 0.00 -0.02 0.00 0.00 41.12 41.82 2wbg n ASP 288 CO 0.00 0.00 0.00 0.72 -0.39 0.00 0.00 177.20 177.53 2wbg s PHE 289 N -2.90 -0.55 -0.11 1.24 -0.12 -1.22 -3.87 117.98 110.44 2wbg s PHE 289 Ca -0.03 0.43 -0.01 0.00 -0.05 0.00 0.00 56.93 57.27 2wbg s PHE 289 Cb 0.09 0.54 -0.03 0.00 -0.63 0.00 0.00 43.02 42.99 2wbg s PHE 289 CO 0.81 -0.81 -0.06 0.08 -0.05 0.00 0.00 175.22 175.19 2wbg s VAL 290 N -3.41 3.69 -0.17 -2.49 1.01 -0.68 -3.66 120.40 114.69 2wbg s VAL 290 Ca -0.00 -0.45 -0.07 0.00 0.00 0.00 0.00 61.98 61.45 2wbg s VAL 290 Cb -0.01 -2.56 -0.04 0.00 0.00 0.00 0.00 36.38 33.77 2wbg s VAL 290 CO -0.10 0.55 0.06 -0.83 0.00 0.00 0.00 175.10 174.78 2wbg s GLY 291 N -0.18 1.92 -0.16 4.51 0.00 0.46 -1.08 107.32 112.79 2wbg s GLY 291 Ca 0.02 -0.74 -0.02 0.00 0.00 0.00 0.00 44.72 43.98 2wbg s GLY 291 CO 0.03 -0.01 -0.08 1.08 0.00 0.00 0.00 173.10 174.11 2wbg s LEU 292 N 0.20 2.89 0.05 0.66 1.43 0.02 -1.05 118.68 122.89 2wbg s LEU 292 Ca 0.04 -0.30 -0.08 0.00 -1.03 0.00 0.00 54.13 52.76 2wbg s LEU 292 Cb -0.12 -1.69 -0.05 0.00 0.03 0.00 0.00 46.19 44.36 2wbg s LEU 292 CO 0.00 0.11 0.35 0.20 0.23 0.00 0.00 176.35 177.24 2wbg s ASN 293 N 0.68 6.58 -0.19 2.29 0.01 0.46 -1.48 114.94 123.29 2wbg s ASN 293 Ca -0.04 0.69 -0.12 0.00 -0.71 0.00 0.00 52.86 52.68 2wbg s ASN 293 Cb -0.15 -2.14 0.06 0.00 0.41 0.00 0.00 41.25 39.43 2wbg s ASN 293 CO 0.02 0.20 0.46 -0.47 -1.51 0.00 0.00 177.10 175.81 2wbg s TYR 294 N -1.37 -0.65 0.00 2.20 5.04 -0.74 -2.39 117.35 119.44 2wbg s TYR 294 Ca 0.31 1.40 0.00 0.00 -2.44 0.00 0.00 57.07 56.34 2wbg s TYR 294 Cb -0.14 0.30 0.00 0.00 0.35 0.00 0.00 41.96 42.47 2wbg s TYR 294 CO 0.18 -0.35 0.00 0.66 -1.34 0.00 0.00 175.55 174.70 2wbg n TYR 295 N 3.94 0.00 -3.72 4.97 4.02 -1.26 -4.30 117.16 120.82 2wbg n TYR 295 Ca -0.21 0.00 -0.11 0.00 -0.01 0.00 0.00 57.90 57.57 2wbg n TYR 295 Cb 0.56 0.00 -0.06 0.00 -0.02 0.00 0.00 39.34 39.82 2wbg n TYR 295 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 176.86 174.31 2wbg s SER 296 N -2.28 -0.15 0.20 7.72 1.04 -1.26 -4.74 113.70 114.23 2wbg s SER 296 Ca 0.00 -0.26 0.08 0.00 0.48 0.00 0.00 55.95 56.25 2wbg s SER 296 Cb 0.00 0.40 -0.04 0.00 0.10 0.00 0.00 66.02 66.48 2wbg s SER 296 CO 0.00 -0.71 -0.02 -0.83 0.98 0.00 0.00 173.24 172.66 2wbg s GLY 297 N -2.39 1.70 -0.07 7.32 0.00 -1.16 -2.06 107.32 110.66 2wbg s GLY 297 Ca -0.01 -1.46 -0.04 0.00 0.00 0.00 0.00 44.72 43.20 2wbg s GLY 297 CO -0.07 -1.49 0.16 0.30 0.00 0.00 0.00 173.10 172.00 2wbg s HIS 298 N -1.88 -0.19 -0.08 1.90 3.76 -0.09 -4.44 115.29 114.27 2wbg s HIS 298 Ca 0.28 0.50 -0.21 0.00 -0.15 0.00 0.00 55.06 55.48 2wbg s HIS 298 Cb -0.08 -0.02 -0.04 0.00 1.11 0.00 0.00 32.58 33.54 2wbg s HIS 298 CO 0.18 -0.15 0.60 -1.17 -0.85 0.00 0.00 174.74 173.35 2wbg s LEU 299 N 0.84 4.31 -0.01 0.89 2.96 -1.26 -1.33 118.68 125.08 2wbg s LEU 299 Ca -0.06 1.03 0.06 0.00 -0.22 0.00 0.00 54.13 54.94 2wbg s LEU 299 Cb -0.08 -2.91 -0.02 0.00 0.50 0.00 0.00 46.19 43.69 2wbg s LEU 299 CO -0.04 -0.05 -0.20 -0.69 -1.32 0.00 0.00 176.35 174.05 2wbg s VAL 300 N 0.63 1.57 0.10 1.68 1.01 -0.15 0.13 120.40 125.38 2wbg s VAL 300 Ca 0.32 -0.88 0.03 0.00 0.00 0.00 0.00 61.98 61.45 2wbg s VAL 300 Cb -0.17 -1.31 -0.04 0.00 0.00 0.00 0.00 36.38 34.86 2wbg s VAL 300 CO 0.15 0.42 -0.09 -1.59 0.00 0.00 0.00 175.10 173.98 2wbg s LYS 301 N -0.53 0.86 0.24 2.72 -2.85 -0.67 -0.77 119.74 118.73 2wbg s LYS 301 Ca 0.08 -1.21 -0.30 0.00 -1.00 0.00 0.00 55.97 53.54 2wbg s LYS 301 Cb -0.08 -0.47 -0.10 0.00 -2.06 0.00 0.00 37.83 35.12 2wbg s LYS 301 CO -0.01 0.06 1.48 0.12 0.10 0.00 0.00 175.35 177.10 2wbg s PHE 302 N -2.71 3.00 -0.15 1.78 5.36 -1.26 -1.93 117.98 122.08 2wbg s PHE 302 Ca 0.07 0.93 -0.04 0.00 -0.96 0.00 0.00 56.93 56.94 2wbg s PHE 302 Cb -0.01 -3.86 0.05 0.00 -0.34 0.00 0.00 43.02 38.86 2wbg s PHE 302 CO -0.01 -2.88 0.06 0.34 -1.46 0.00 0.00 175.22 171.27 2wbg s ASP 303 N 0.52 2.25 0.47 6.13 -1.08 -0.19 -4.83 116.67 119.94 2wbg s ASP 303 Ca 0.62 -0.52 0.31 0.00 -0.52 0.00 0.00 52.55 52.44 2wbg s ASP 303 Cb -0.43 -0.33 1.39 0.00 -1.46 0.00 0.00 42.92 42.09 2wbg s ASP 303 CO 0.41 -0.31 1.93 1.55 0.52 0.00 0.00 175.17 179.28 2wbg h PRO 304 N 8.37 0.00 -0.00 4.34 0.13 -1.95 -2.95 132.00 139.93 2wbg h PRO 304 Ca -0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.98 2wbg h PRO 304 Cb 1.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 2wbg h PRO 304 CO 0.28 0.00 -0.70 -0.25 -0.23 0.00 0.00 178.00 177.09 2wbg n ASP 305 N -2.78 1.00 -4.94 1.44 8.00 -1.26 -4.89 116.55 113.13 2wbg n ASP 305 Ca 0.00 -0.84 -0.27 0.00 0.71 0.00 0.00 54.79 54.39 2wbg n ASP 305 Cb 0.23 0.62 -0.03 0.00 -0.02 0.00 0.00 41.12 41.92 2wbg n ASP 305 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2wbg s ALA 306 N -2.88 3.90 0.25 2.24 0.00 -1.12 -5.00 121.76 119.16 2wbg s ALA 306 Ca 0.12 -0.93 -0.31 0.00 0.00 0.00 0.00 51.96 50.84 2wbg s ALA 306 Cb 0.17 -1.89 -0.13 0.00 0.00 0.00 0.00 23.12 21.28 2wbg s ALA 306 CO 0.74 0.50 1.47 -2.30 0.00 0.00 0.00 175.76 176.18 2wbg n PRO 307 N -0.57 2.24 -0.93 0.00 -0.02 -1.26 -0.36 135.00 134.10 2wbg n PRO 307 Ca -0.06 0.80 0.00 0.00 -2.02 0.00 0.00 63.50 62.22 2wbg n PRO 307 Cb 0.54 -2.50 0.00 0.00 -0.02 0.00 0.00 33.50 31.52 2wbg n PRO 307 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2wbg n ALA 308 N 2.09 0.00 -2.58 3.55 0.00 -1.26 -3.64 120.51 118.66 2wbg n ALA 308 Ca 0.11 0.00 -0.20 0.00 0.00 0.00 0.00 53.44 53.35 2wbg n ALA 308 Cb 0.33 -1.18 0.01 0.00 0.00 0.00 0.00 19.45 18.60 2wbg n ALA 308 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2wbg n LYS 309 N -0.06 -2.65 -4.28 0.00 5.02 0.51 -4.98 118.16 111.73 2wbg n LYS 309 Ca 0.00 0.92 -0.18 0.00 -2.02 0.00 0.00 58.31 57.03 2wbg n LYS 309 Cb 0.35 -5.56 -0.15 0.00 -0.02 0.00 0.00 35.03 29.65 2wbg n LYS 309 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2wbg s VAL 310 N -3.04 0.60 0.08 -0.18 0.11 -1.24 -1.02 120.40 115.71 2wbg s VAL 310 Ca 0.10 -0.30 0.01 0.00 -2.93 0.00 0.00 61.98 58.86 2wbg s VAL 310 Cb -0.04 -0.52 -0.04 0.00 -1.53 0.00 0.00 36.38 34.24 2wbg s VAL 310 CO 0.12 0.18 -0.05 -0.94 -3.33 0.00 0.00 175.10 171.08 2wbg s SER 311 N -0.02 0.89 0.26 3.54 1.04 -0.81 -4.71 113.70 113.89 2wbg s SER 311 Ca 0.01 -0.96 -0.22 0.00 0.48 0.00 0.00 55.95 55.26 2wbg s SER 311 Cb -0.05 0.12 -0.09 0.00 0.10 0.00 0.00 66.02 66.11 2wbg s SER 311 CO -0.00 -0.48 0.81 -0.36 0.98 0.00 0.00 173.24 174.18 2wbg s PHE 312 N -3.49 3.67 -0.17 5.02 0.40 -1.26 -1.67 117.98 120.48 2wbg s PHE 312 Ca 0.08 1.54 -0.01 0.00 -0.60 0.00 0.00 56.93 57.94 2wbg s PHE 312 Cb 0.05 -2.73 -0.00 0.00 0.51 0.00 0.00 43.02 40.84 2wbg s PHE 312 CO -0.06 0.29 -0.13 0.08 0.70 0.00 0.00 175.22 176.10 2wbg s VAL 313 N -1.55 2.81 0.15 -0.44 1.01 0.12 -4.92 120.40 117.57 2wbg s VAL 313 Ca 0.46 -0.71 -0.31 0.00 0.00 0.00 0.00 61.98 61.42 2wbg s VAL 313 Cb -0.17 -2.21 -0.08 0.00 0.00 0.00 0.00 36.38 33.91 2wbg s VAL 313 CO 0.22 0.50 1.38 -0.70 0.00 0.00 0.00 175.10 176.50 2wbg s GLU 314 N 0.98 4.33 0.10 2.72 2.12 -1.26 -4.17 118.70 123.51 2wbg s GLU 314 Ca -0.02 2.09 0.04 0.00 0.36 0.00 0.00 54.97 57.44 2wbg s GLU 314 Cb -0.15 -3.22 -0.04 0.00 0.26 0.00 0.00 34.13 30.98 2wbg s GLU 314 CO -0.02 -0.39 0.07 1.03 -0.54 0.00 0.00 175.26 175.40 2wbg s ARG 315 N 0.70 2.80 -1.31 4.30 0.52 -1.26 -5.04 118.95 119.66 2wbg s ARG 315 Ca 0.62 -0.76 -0.18 0.00 -0.52 0.00 0.00 55.73 54.90 2wbg s ARG 315 Cb -0.37 -2.66 0.07 0.00 0.52 0.00 0.00 34.95 32.50 2wbg s ARG 315 CO 0.33 0.55 1.76 -3.47 0.02 0.00 0.00 175.30 174.49 2wbg n ASP 316 N 0.35 4.89 -4.24 0.23 2.03 -1.26 -4.92 116.55 113.63 2wbg n ASP 316 Ca -0.09 -2.92 -0.15 0.00 0.52 0.00 0.00 54.79 52.16 2wbg n ASP 316 Cb 0.52 -1.74 -0.10 0.00 -0.72 0.00 0.00 41.12 39.08 2wbg n ASP 316 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 2wbg s LEU 317 N 4.09 2.50 0.24 -2.67 1.02 -1.26 -5.11 118.68 117.49 2wbg s LEU 317 Ca 0.54 -0.96 -0.31 0.00 0.02 0.00 0.00 54.13 53.41 2wbg s LEU 317 Cb 0.04 -0.37 -0.13 0.00 0.02 0.00 0.00 46.19 45.75 2wbg s LEU 317 CO 0.07 -0.30 1.49 -2.65 0.02 0.00 0.00 176.35 174.99 2wbg n PRO 318 N -0.02 2.25 -4.40 1.29 -0.02 -1.26 -4.88 135.00 127.96 2wbg n PRO 318 Ca -0.12 0.80 -0.24 0.00 -2.02 0.00 0.00 63.50 61.93 2wbg n PRO 318 Cb 0.60 -2.51 -0.11 0.00 -0.02 0.00 0.00 33.50 31.45 2wbg n PRO 318 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 2wbg s LYS 319 N -0.19 1.47 0.75 -0.52 1.02 -1.26 -0.66 119.74 120.34 2wbg s LYS 319 Ca 0.69 -1.56 -0.08 0.00 0.02 0.00 0.00 55.97 55.04 2wbg s LYS 319 Cb -0.61 -1.60 0.16 0.00 -0.52 0.00 0.00 37.83 35.27 2wbg s LYS 319 CO 0.47 0.32 1.02 0.25 -0.92 0.00 0.00 175.35 176.49 2wbg n THR 320 N -0.02 0.00 0.28 2.17 -2.24 -0.47 -4.89 114.28 109.12 2wbg n THR 320 Ca -0.10 -1.10 0.18 0.00 -2.27 0.00 0.00 64.05 60.76 2wbg n THR 320 Cb 0.58 -1.28 0.91 0.00 -2.10 0.00 0.00 70.33 68.44 2wbg n THR 320 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2wbg h ALA 321 N -1.23 1.00 0.00 6.98 0.00 -1.30 0.10 119.26 124.81 2wbg h ALA 321 Ca -0.33 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.58 2wbg h ALA 321 Cb 1.04 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.83 2wbg h ALA 321 CO 0.29 0.00 0.00 -1.33 0.00 0.00 0.00 179.25 178.21 2wbg n MET 322 N -2.77 0.01 -0.97 0.00 2.81 -1.26 -4.90 117.12 110.04 2wbg n MET 322 Ca -0.02 0.06 0.00 0.00 -1.81 0.00 0.00 57.70 55.94 2wbg n MET 322 Cb 0.10 -1.51 0.00 0.00 -0.71 0.00 0.00 33.22 31.10 2wbg n MET 322 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2wbg n GLY 323 N 1.15 0.51 3.74 3.03 0.00 0.35 -5.03 105.19 108.95 2wbg n GLY 323 Ca 0.06 -0.01 -0.40 0.00 0.00 0.00 0.00 46.02 45.67 2wbg n GLY 323 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2wbg s TRP 324 N -2.00 3.73 0.17 1.61 0.51 -1.26 -4.75 118.94 116.96 2wbg s TRP 324 Ca 0.00 1.49 -0.31 0.00 -2.12 0.00 0.00 56.10 55.16 2wbg s TRP 324 Cb 0.00 -2.84 -0.08 0.00 -0.81 0.00 0.00 33.47 29.74 2wbg s TRP 324 CO 0.00 0.26 1.35 -1.21 -0.51 0.00 0.00 176.95 176.84 2wbg s GLU 325 N 0.01 4.35 -0.49 4.98 2.02 -1.26 -1.37 118.70 126.93 2wbg s GLU 325 Ca 0.39 2.08 -0.23 0.00 0.02 0.00 0.00 54.97 57.24 2wbg s GLU 325 Cb -0.21 -3.21 0.04 0.00 0.10 0.00 0.00 34.13 30.85 2wbg s GLU 325 CO 0.23 -0.34 0.81 0.42 0.02 0.00 0.00 175.26 176.40 2wbg s ILE 326 N 0.52 4.60 -0.51 -1.63 1.01 0.17 -2.97 121.20 122.38 2wbg s ILE 326 Ca 0.60 0.21 0.04 0.00 0.00 0.00 0.00 60.65 61.50 2wbg s ILE 326 Cb -0.37 -4.39 0.17 0.00 0.01 0.00 0.00 42.46 37.88 2wbg s ILE 326 CO 0.35 -0.87 0.39 -0.69 0.00 0.00 0.00 174.94 174.13 2wbg s VAL 327 N 3.39 1.20 0.37 2.92 1.01 -1.26 -4.76 120.40 123.26 2wbg s VAL 327 Ca 0.27 -3.20 0.08 0.00 0.00 0.00 0.00 61.98 59.14 2wbg s VAL 327 Cb -0.13 -1.81 0.31 0.00 0.00 0.00 0.00 36.38 34.75 2wbg s VAL 327 CO 0.20 -1.16 1.91 -0.65 0.00 0.00 0.00 175.10 175.40 2wbg h PRO 328 N 5.56 0.67 0.00 2.72 0.11 -1.92 -0.19 132.00 138.95 2wbg h PRO 328 Ca 0.23 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.30 2wbg h PRO 328 Cb 0.86 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 31.82 2wbg h PRO 328 CO 0.49 0.44 0.00 1.05 -0.21 0.00 0.00 178.00 179.77 2wbg h GLU 329 N 0.69 0.00 -0.61 1.05 9.09 -1.94 -1.83 114.58 121.03 2wbg h GLU 329 Ca 0.38 0.00 0.04 0.00 0.05 0.00 0.00 59.36 59.83 2wbg h GLU 329 Cb 0.54 0.00 -0.03 0.00 -1.65 0.00 0.00 28.75 27.61 2wbg h GLU 329 CO -0.15 0.00 0.40 0.78 0.05 0.00 0.00 179.01 180.09 2wbg h GLY 330 N 1.12 0.80 1.83 1.06 0.00 -1.43 0.22 103.07 106.67 2wbg h GLY 330 Ca 0.00 -0.27 -0.13 0.00 0.00 0.00 0.00 47.33 46.93 2wbg h GLY 330 CO 0.00 0.23 -0.55 1.19 0.00 0.00 0.00 176.54 177.41 2wbg h ILE 331 N 0.69 1.37 0.25 2.60 2.10 -1.50 -0.86 117.51 122.16 2wbg h ILE 331 Ca 0.25 -1.86 -0.01 0.00 1.08 0.00 0.00 64.86 64.31 2wbg h ILE 331 Cb 0.13 1.94 0.00 0.00 -1.09 0.00 0.00 36.82 37.80 2wbg h ILE 331 CO -0.07 0.55 -0.12 0.22 -1.08 0.00 0.00 178.15 177.65 2wbg h TYR 332 N 0.14 -0.31 -0.32 2.19 5.03 -1.49 -2.68 116.97 119.54 2wbg h TYR 332 Ca -0.00 -0.01 0.07 0.00 2.58 0.00 0.00 58.73 61.37 2wbg h TYR 332 Cb 1.01 0.10 -0.07 0.00 1.55 0.00 0.00 36.73 39.32 2wbg h TYR 332 CO 0.01 -0.06 -0.14 2.35 -1.32 0.00 0.00 178.16 179.00 2wbg h TRP 333 N -0.51 -0.35 -0.75 -3.82 7.01 -0.75 -1.28 115.95 115.50 2wbg h TRP 333 Ca -0.03 0.03 -0.03 0.00 2.11 0.00 0.00 58.89 60.97 2wbg h TRP 333 Cb 0.38 0.20 -0.03 0.00 -2.10 0.00 0.00 29.16 27.61 2wbg h TRP 333 CO -0.01 -0.22 0.37 0.97 -2.79 0.00 0.00 178.44 176.76 2wbg h ILE 334 N -0.09 1.24 -0.17 2.65 6.09 -1.21 0.11 117.51 126.12 2wbg h ILE 334 Ca 0.16 -0.67 -0.00 0.00 -1.37 0.00 0.00 64.86 62.98 2wbg h ILE 334 Cb 0.34 0.29 -0.01 0.00 0.47 0.00 0.00 36.82 37.91 2wbg h ILE 334 CO -0.38 0.28 0.10 -0.07 -3.07 0.00 0.00 178.15 175.02 2wbg h LEU 335 N 1.06 0.21 -0.63 2.19 3.38 -1.11 -0.87 115.31 119.55 2wbg h LEU 335 Ca 0.26 -0.08 0.01 0.00 0.09 0.00 0.00 57.88 58.17 2wbg h LEU 335 Cb 0.11 -0.05 -0.03 0.00 0.09 0.00 0.00 40.66 40.77 2wbg h LEU 335 CO -0.03 0.23 0.41 0.11 0.09 0.00 0.00 178.44 179.25 2wbg h LYS 336 N 0.18 0.81 -0.43 1.13 1.79 -0.92 -2.92 116.57 116.22 2wbg h LYS 336 Ca 0.06 -0.05 -0.11 0.00 -2.18 0.00 0.00 60.65 58.37 2wbg h LYS 336 Cb 0.06 -0.18 -0.02 0.00 -1.58 0.00 0.00 32.23 30.51 2wbg h LYS 336 CO -0.01 0.53 -0.19 -0.22 -1.08 0.00 0.00 179.45 178.49 2wbg h LYS 337 N 0.83 0.83 -0.33 3.15 1.63 -0.57 -0.41 116.57 121.71 2wbg h LYS 337 Ca 0.24 -0.32 -0.10 0.00 -0.85 0.00 0.00 60.65 59.61 2wbg h LYS 337 Cb -0.07 -0.05 -0.01 0.00 -0.60 0.00 0.00 32.23 31.50 2wbg h LYS 337 CO -0.06 0.95 -0.22 -0.24 -3.45 0.00 0.00 179.45 176.42 2wbg h VAL 338 N 0.73 1.27 0.06 2.00 3.04 -1.10 0.21 116.25 122.46 2wbg h VAL 338 Ca 0.11 -1.28 -0.00 0.00 -1.01 0.00 0.00 66.70 64.51 2wbg h VAL 338 Cb 0.70 1.26 0.00 0.00 -2.01 0.00 0.00 31.29 31.24 2wbg h VAL 338 CO 0.05 0.42 -0.03 0.50 -1.01 0.00 0.00 177.57 177.50 2wbg h LYS 339 N 0.56 -0.08 -0.71 4.17 3.64 -1.30 -0.79 116.57 122.06 2wbg h LYS 339 Ca 0.08 0.01 0.09 0.00 -1.27 0.00 0.00 60.65 59.56 2wbg h LYS 339 Cb 0.68 0.02 -0.07 0.00 -0.41 0.00 0.00 32.23 32.45 2wbg h LYS 339 CO 0.05 0.15 0.35 1.49 -2.27 0.00 0.00 179.45 179.22 2wbg h GLU 340 N -0.30 0.58 0.15 1.90 4.81 -0.86 -0.94 114.58 119.92 2wbg h GLU 340 Ca -0.01 -0.03 -0.33 0.00 -0.13 0.00 0.00 59.36 58.86 2wbg h GLU 340 Cb 0.27 -0.13 0.00 0.00 0.63 0.00 0.00 28.75 29.52 2wbg h GLU 340 CO 0.01 0.38 -1.64 0.93 -0.73 0.00 0.00 179.01 177.97 2wbg h GLU 341 N 0.59 0.32 0.00 1.92 5.08 -0.93 -3.42 114.58 118.14 2wbg h GLU 341 Ca 0.35 -0.56 0.00 0.00 -1.00 0.00 0.00 59.36 58.16 2wbg h GLU 341 Cb 0.38 0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.83 2wbg h GLU 341 CO -0.27 1.21 -0.22 0.66 -1.00 0.00 0.00 179.01 179.39 2wbg n TYR 342 N -3.52 0.00 -4.02 4.33 4.01 -0.36 -5.06 117.16 112.53 2wbg n TYR 342 Ca -0.20 0.00 -0.34 0.00 -0.16 0.00 0.00 57.90 57.20 2wbg n TYR 342 Cb 1.06 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 40.08 2wbg n TYR 342 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 2wbg n ASN 343 N -0.60 -2.03 -4.75 7.72 5.15 -0.36 -4.91 115.26 115.49 2wbg n ASN 343 Ca 0.00 -1.16 -0.39 0.00 -0.60 0.00 0.00 54.58 52.43 2wbg n ASN 343 Cb 0.00 -2.38 0.04 0.00 -0.53 0.00 0.00 39.78 36.91 2wbg n ASN 343 CO 0.00 0.00 0.00 -0.81 1.40 0.00 0.00 177.26 177.85 2wbg n PRO 344 N -4.59 1.84 -0.18 1.20 -0.04 -1.26 -4.91 135.00 127.05 2wbg n PRO 344 Ca -0.22 0.67 -0.03 0.00 -0.04 0.00 0.00 63.50 63.88 2wbg n PRO 344 Cb 0.64 -2.59 0.17 0.00 -0.04 0.00 0.00 33.50 31.68 2wbg n PRO 344 CO 0.00 0.00 0.00 -1.00 -0.04 0.00 0.00 175.50 174.46 2wbg h PRO 345 N 1.65 0.95 -4.45 0.54 0.13 -1.91 -3.44 132.00 125.47 2wbg h PRO 345 Ca -0.51 -0.17 -0.31 0.00 -0.87 0.00 0.00 66.00 64.14 2wbg h PRO 345 Cb 1.30 -0.16 -0.26 0.00 0.13 0.00 0.00 31.00 32.01 2wbg h PRO 345 CO 0.58 0.79 -0.75 -1.21 -0.23 0.00 0.00 178.00 177.18 2wbg s GLU 346 N -5.39 0.49 0.04 0.86 2.02 -1.25 -4.78 118.70 110.68 2wbg s GLU 346 Ca -0.11 -0.42 0.06 0.00 0.02 0.00 0.00 54.97 54.53 2wbg s GLU 346 Cb 0.16 -0.39 -0.02 0.00 0.10 0.00 0.00 34.13 33.97 2wbg s GLU 346 CO 0.81 0.10 -0.17 0.08 0.02 0.00 0.00 175.26 176.09 2wbg s VAL 347 N -0.60 1.38 0.03 2.63 1.01 -0.42 -1.69 120.40 122.73 2wbg s VAL 347 Ca -0.02 -1.06 0.05 0.00 0.00 0.00 0.00 61.98 60.95 2wbg s VAL 347 Cb -0.05 -1.21 -0.02 0.00 0.00 0.00 0.00 36.38 35.09 2wbg s VAL 347 CO 0.00 0.13 -0.16 -0.31 0.00 0.00 0.00 175.10 174.76 2wbg s TYR 348 N -0.78 1.40 -0.53 5.22 1.51 -0.24 -0.31 117.35 123.62 2wbg s TYR 348 Ca 0.05 -0.33 -0.26 0.00 -1.01 0.00 0.00 57.07 55.51 2wbg s TYR 348 Cb -0.08 -0.84 0.03 0.00 -0.11 0.00 0.00 41.96 40.96 2wbg s TYR 348 CO 0.01 0.04 1.01 0.42 -1.11 0.00 0.00 175.55 175.92 2wbg s ILE 349 N -0.72 4.31 -0.88 2.71 -1.09 -0.72 -0.79 121.20 124.01 2wbg s ILE 349 Ca 0.04 0.62 0.24 0.00 -2.23 0.00 0.00 60.65 59.32 2wbg s ILE 349 Cb -0.08 -4.56 -0.00 0.00 -1.58 0.00 0.00 42.46 36.24 2wbg s ILE 349 CO 0.01 -1.09 1.34 0.35 -1.23 0.00 0.00 174.94 174.32 2wbg n THR 350 N 6.42 0.09 -3.66 2.92 -2.24 -0.55 -0.22 114.28 117.05 2wbg n THR 350 Ca 0.05 -0.09 -0.10 0.00 -2.27 0.00 0.00 64.05 61.65 2wbg n THR 350 Cb 0.48 0.18 -0.08 0.00 -2.10 0.00 0.00 70.33 68.82 2wbg n THR 350 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2wbg s GLU 351 N -3.06 0.67 -0.23 -0.78 2.02 -1.24 -4.67 118.70 111.42 2wbg s GLU 351 Ca 0.09 1.04 -0.17 0.00 0.02 0.00 0.00 54.97 55.95 2wbg s GLU 351 Cb 0.16 0.19 0.06 0.00 0.10 0.00 0.00 34.13 34.65 2wbg s GLU 351 CO 0.72 -0.13 0.58 1.21 0.02 0.00 0.00 175.26 177.66 2wbg s ASN 352 N 1.15 -0.69 -0.05 -0.19 3.04 -0.94 -1.78 114.94 115.48 2wbg s ASN 352 Ca -0.06 1.22 -0.23 0.00 0.04 0.00 0.00 52.86 53.83 2wbg s ASN 352 Cb -0.05 1.17 0.07 0.00 -1.54 0.00 0.00 41.25 40.90 2wbg s ASN 352 CO -0.12 -0.21 1.01 0.61 -3.04 0.00 0.00 177.10 175.36 2wbg n GLY 353 N 3.48 0.21 3.25 1.21 0.00 -1.26 -1.58 105.19 110.51 2wbg n GLY 353 Ca -0.17 -0.97 -0.13 0.00 0.00 0.00 0.00 46.02 44.74 2wbg n GLY 353 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2wbg s ALA 354 N -1.76 -0.85 -0.18 4.61 0.00 -1.26 -4.91 121.76 117.41 2wbg s ALA 354 Ca 0.24 0.53 -0.14 0.00 0.00 0.00 0.00 51.96 52.59 2wbg s ALA 354 Cb -0.00 -0.08 -0.05 0.00 0.00 0.00 0.00 23.12 22.99 2wbg s ALA 354 CO -0.02 -0.25 0.30 0.00 0.00 0.00 0.00 175.76 175.80 2wbg s ALA 355 N -0.98 3.59 0.13 0.00 0.00 -1.26 -4.35 121.76 118.89 2wbg s ALA 355 Ca -0.10 -0.52 0.02 0.00 0.00 0.00 0.00 51.96 51.36 2wbg s ALA 355 Cb -0.04 -2.44 -0.04 0.00 0.00 0.00 0.00 23.12 20.60 2wbg s ALA 355 CO 0.04 -0.03 -0.05 -0.06 0.00 0.00 0.00 175.76 175.66 2wbg s PHE 356 N 0.73 1.05 -1.23 0.00 0.08 -1.22 -0.76 117.98 116.62 2wbg s PHE 356 Ca 0.16 -0.92 -0.17 0.00 0.12 0.00 0.00 56.93 56.12 2wbg s PHE 356 Cb -0.13 -0.59 -0.02 0.00 -0.57 0.00 0.00 43.02 41.71 2wbg s PHE 356 CO 0.05 -0.13 2.09 -0.25 -0.10 0.00 0.00 175.22 176.88 2wbg n ASP 357 N -0.13 3.51 -4.75 1.36 8.00 -1.26 -4.49 116.55 118.79 2wbg n ASP 357 Ca -0.10 -2.79 -0.41 0.00 0.71 0.00 0.00 54.79 52.19 2wbg n ASP 357 Cb 0.61 -1.50 -0.02 0.00 -0.02 0.00 0.00 41.12 40.19 2wbg n ASP 357 CO 0.00 0.00 0.00 -1.81 -0.39 0.00 0.00 177.20 175.00 2wbg s ASP 358 N 3.95 6.59 -0.02 -2.24 1.01 -1.26 -5.02 116.67 119.68 2wbg s ASP 358 Ca 0.52 2.74 0.06 0.00 0.71 0.00 0.00 52.55 56.57 2wbg s ASP 358 Cb 0.13 -2.63 -0.01 0.00 1.01 0.00 0.00 42.92 41.42 2wbg s ASP 358 CO -0.00 -0.74 -0.19 0.68 0.21 0.00 0.00 175.17 175.13 2wbg s VAL 359 N -0.13 1.51 -0.40 -1.27 -7.23 -1.26 -5.10 120.40 106.52 2wbg s VAL 359 Ca 0.59 -0.81 -0.26 0.00 -1.81 0.00 0.00 61.98 59.69 2wbg s VAL 359 Cb -0.43 -1.25 0.02 0.00 0.56 0.00 0.00 36.38 35.27 2wbg s VAL 359 CO 0.46 0.43 0.94 -0.69 -0.31 0.00 0.00 175.10 175.92 2wbg s VAL 360 N -0.41 4.54 0.93 1.32 1.01 -1.26 -4.30 120.40 122.22 2wbg s VAL 360 Ca 0.06 1.08 -0.14 0.00 0.00 0.00 0.00 61.98 62.97 2wbg s VAL 360 Cb -0.08 -4.37 0.16 0.00 0.00 0.00 0.00 36.38 32.09 2wbg s VAL 360 CO -0.00 -0.64 1.23 -0.94 0.00 0.00 0.00 175.10 174.75 2wbg s SER 361 N 2.01 3.43 0.58 3.32 1.04 -0.46 -4.88 113.70 118.76 2wbg s SER 361 Ca 0.38 0.56 0.28 0.00 0.48 0.00 0.00 55.95 57.66 2wbg s SER 361 Cb -0.11 -0.84 1.71 0.00 0.10 0.00 0.00 66.02 66.87 2wbg s SER 361 CO 0.21 -2.56 2.18 1.05 0.98 0.00 0.00 173.24 175.10 2wbg h GLU 362 N -1.51 0.00 0.00 4.02 4.11 -1.97 0.76 114.58 119.99 2wbg h GLU 362 Ca -0.46 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.97 2wbg h GLU 362 Cb 1.28 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.53 2wbg h GLU 362 CO 0.50 0.00 0.00 -0.40 0.07 0.00 0.00 179.01 179.18 2wbg n ASP 363 N -3.88 0.00 -0.13 3.06 5.68 -1.26 -4.86 116.55 115.15 2wbg n ASP 363 Ca -0.01 -0.83 -0.02 0.00 -0.50 0.00 0.00 54.79 53.44 2wbg n ASP 363 Cb 0.20 0.00 -0.01 0.00 -1.14 0.00 0.00 41.12 40.17 2wbg n ASP 363 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2wbg n GLY 364 N 0.49 0.53 3.67 6.12 0.00 0.26 -5.03 105.19 111.23 2wbg n GLY 364 Ca 0.16 -0.39 -0.25 0.00 0.00 0.00 0.00 46.02 45.55 2wbg n GLY 364 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2wbg s ARG 365 N -1.24 2.16 -0.25 1.61 0.52 -1.25 -4.89 118.95 115.60 2wbg s ARG 365 Ca 0.00 -1.76 0.01 0.00 -0.52 0.00 0.00 55.73 53.47 2wbg s ARG 365 Cb 0.00 -1.97 0.07 0.00 0.52 0.00 0.00 34.95 33.57 2wbg s ARG 365 CO 0.00 0.06 -0.05 0.08 0.02 0.00 0.00 175.30 175.41 2wbg s VAL 366 N -2.53 1.71 -1.17 3.52 1.01 -1.26 -1.35 120.40 120.33 2wbg s VAL 366 Ca 0.37 -1.42 -0.11 0.00 0.00 0.00 0.00 61.98 60.82 2wbg s VAL 366 Cb 0.01 -1.98 0.23 0.00 0.00 0.00 0.00 36.38 34.64 2wbg s VAL 366 CO 0.21 -0.15 1.32 1.41 0.00 0.00 0.00 175.10 177.89 2wbg n HIS 367 N 4.59 4.90 -2.65 5.22 -0.00 -1.26 -0.78 115.22 125.23 2wbg n HIS 367 Ca -0.11 -3.55 -0.41 0.00 -0.00 0.00 0.00 57.72 53.65 2wbg n HIS 367 Cb 0.43 -1.92 0.02 0.00 -0.00 0.00 0.00 29.99 28.52 2wbg n HIS 367 CO 0.00 0.00 0.00 -0.40 -0.00 0.00 0.00 176.34 175.94 2wbg n ASP 368 N 4.02 7.34 -0.10 0.41 5.75 -1.26 -4.74 116.55 127.97 2wbg n ASP 368 Ca 0.31 -3.68 0.20 0.00 -0.01 0.00 0.00 54.79 51.60 2wbg n ASP 368 Cb 0.40 -1.17 0.61 0.00 -1.03 0.00 0.00 41.12 39.93 2wbg n ASP 368 CO 0.00 0.00 0.00 -0.61 -0.11 0.00 0.00 177.20 176.48 2wbg h GLN 369 N 4.25 0.18 -0.91 0.11 5.75 -1.98 -1.12 115.11 121.38 2wbg h GLN 369 Ca 0.53 -0.01 -0.00 0.00 -0.15 0.00 0.00 58.65 59.01 2wbg h GLN 369 Cb 0.33 -0.04 -0.04 0.00 1.07 0.00 0.00 27.48 28.80 2wbg h GLN 369 CO 1.19 0.12 0.56 -2.95 -2.65 0.00 0.00 178.83 175.09 2wbg h ASN 370 N 0.18 1.09 0.47 -0.69 7.08 -2.00 0.74 115.58 122.46 2wbg h ASN 370 Ca 0.34 -0.06 -0.24 0.00 -3.08 0.00 0.00 56.30 53.25 2wbg h ASN 370 Cb 1.07 -0.28 0.00 0.00 -2.08 0.00 0.00 38.32 37.03 2wbg h ASN 370 CO -0.06 0.83 -1.06 -0.09 -2.08 0.00 0.00 177.43 174.97 2wbg h ARG 371 N 1.26 0.34 -0.23 4.14 2.43 -1.65 -2.05 114.38 118.62 2wbg h ARG 371 Ca 0.33 -0.44 0.02 0.00 -0.81 0.00 0.00 59.98 59.08 2wbg h ARG 371 Cb -0.06 0.14 -0.02 0.00 -0.42 0.00 0.00 29.97 29.61 2wbg h ARG 371 CO -0.06 1.14 0.11 0.82 -1.51 0.00 0.00 179.97 180.46 2wbg h ILE 372 N 0.16 0.98 -0.78 1.20 2.04 -0.81 -0.44 117.51 119.85 2wbg h ILE 372 Ca -0.10 -0.08 0.01 0.00 1.00 0.00 0.00 64.86 65.70 2wbg h ILE 372 Cb 1.73 0.73 -0.04 0.00 -0.74 0.00 0.00 36.82 38.50 2wbg h ILE 372 CO 0.18 0.04 0.51 0.44 0.00 0.00 0.00 178.15 179.32 2wbg h ASP 373 N 0.23 0.88 0.10 1.72 3.32 -0.80 0.75 116.42 122.62 2wbg h ASP 373 Ca 0.10 -0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.12 2wbg h ASP 373 Cb 0.04 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 39.38 2wbg h ASP 373 CO -0.08 0.63 -0.05 0.22 -1.72 0.00 0.00 179.24 178.24 2wbg h TYR 374 N 1.03 -0.13 -0.12 4.55 5.03 -1.12 -1.79 116.97 124.43 2wbg h TYR 374 Ca 0.29 -0.00 -0.01 0.00 2.58 0.00 0.00 58.73 61.59 2wbg h TYR 374 Cb -0.08 0.04 -0.01 0.00 1.55 0.00 0.00 36.73 38.23 2wbg h TYR 374 CO -0.02 -0.05 0.05 -0.07 -1.32 0.00 0.00 178.16 176.74 2wbg h LEU 375 N -0.17 0.16 -0.52 2.82 3.38 -0.67 -2.77 115.31 117.54 2wbg h LEU 375 Ca -0.01 -0.16 0.05 0.00 0.09 0.00 0.00 57.88 57.84 2wbg h LEU 375 Cb 0.14 -0.04 -0.05 0.00 0.09 0.00 0.00 40.66 40.80 2wbg h LEU 375 CO 0.02 0.28 0.27 0.50 0.09 0.00 0.00 178.44 179.60 2wbg h LYS 376 N 0.03 0.50 -0.90 1.13 3.64 -0.86 0.12 116.57 120.23 2wbg h LYS 376 Ca 0.04 -0.03 0.03 0.00 -1.27 0.00 0.00 60.65 59.41 2wbg h LYS 376 Cb 0.17 -0.11 -0.05 0.00 -0.41 0.00 0.00 32.23 31.82 2wbg h LYS 376 CO -0.00 0.33 0.59 0.00 -2.27 0.00 0.00 179.45 178.10 2wbg h ALA 377 N 1.28 1.18 -0.06 5.00 0.00 -1.24 -0.08 119.26 125.34 2wbg h ALA 377 Ca 0.23 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.99 2wbg h ALA 377 Cb 0.14 -0.33 0.01 0.00 0.00 0.00 0.00 17.79 17.60 2wbg h ALA 377 CO -0.16 0.48 -0.37 0.45 0.00 0.00 0.00 179.25 179.65 2wbg h HIS 378 N 1.17 0.48 -0.88 0.00 3.86 -1.14 -2.66 115.15 115.97 2wbg h HIS 378 Ca 0.35 -0.22 0.11 0.00 -1.16 0.00 0.00 60.37 59.45 2wbg h HIS 378 Cb -0.04 -0.07 -0.08 0.00 1.06 0.00 0.00 27.41 28.28 2wbg h HIS 378 CO -0.01 0.98 0.51 0.82 0.86 0.00 0.00 177.93 181.08 2wbg h ILE 379 N -0.16 0.88 -1.01 2.45 2.04 -0.70 0.31 117.51 121.33 2wbg h ILE 379 Ca -0.03 -0.28 0.03 0.00 1.00 0.00 0.00 64.86 65.58 2wbg h ILE 379 Cb 1.04 -0.01 -0.06 0.00 -0.74 0.00 0.00 36.82 37.06 2wbg h ILE 379 CO 0.08 0.15 0.66 1.23 0.00 0.00 0.00 178.15 180.27 2wbg h GLY 380 N 0.81 1.46 1.53 5.37 0.00 -0.95 -1.30 103.07 110.00 2wbg h GLY 380 Ca 0.44 -0.51 -0.19 0.00 0.00 0.00 0.00 47.33 47.07 2wbg h GLY 380 CO -0.27 0.45 -0.72 1.46 0.00 0.00 0.00 176.54 177.46 2wbg h GLN 381 N 1.30 0.46 -0.69 4.80 1.08 -0.86 -2.27 115.11 118.93 2wbg h GLN 381 Ca 0.39 -0.37 -0.02 0.00 -1.45 0.00 0.00 58.65 57.20 2wbg h GLN 381 Cb -0.04 0.07 -0.03 0.00 -0.05 0.00 0.00 27.48 27.43 2wbg h GLN 381 CO -0.12 1.00 0.33 0.00 -0.95 0.00 0.00 178.83 179.10 2wbg h ALA 382 N 0.90 1.29 -0.20 3.87 0.00 -0.67 -2.06 119.26 122.39 2wbg h ALA 382 Ca -0.03 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 2wbg h ALA 382 Cb 1.30 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.80 2wbg h ALA 382 CO 0.13 0.55 0.10 2.35 0.00 0.00 0.00 179.25 182.39 2wbg h TRP 383 N 0.98 0.28 -0.76 0.00 7.01 -1.05 -1.98 115.95 120.42 2wbg h TRP 383 Ca 0.24 -0.01 0.10 0.00 2.11 0.00 0.00 58.89 61.33 2wbg h TRP 383 Cb 0.10 -0.09 -0.08 0.00 -2.10 0.00 0.00 29.16 26.99 2wbg h TRP 383 CO 0.01 0.27 0.40 -0.22 -2.79 0.00 0.00 178.44 176.11 2wbg h LYS 384 N 0.21 0.63 -0.64 2.65 3.64 -1.08 -0.94 116.57 121.03 2wbg h LYS 384 Ca 0.07 -0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 59.37 2wbg h LYS 384 Cb 0.09 -0.14 -0.03 0.00 -0.41 0.00 0.00 32.23 31.74 2wbg h LYS 384 CO -0.01 0.42 0.24 0.00 -2.27 0.00 0.00 179.45 177.83 2wbg h ALA 385 N 1.46 1.21 -0.83 5.00 0.00 -1.02 -0.63 119.26 124.45 2wbg h ALA 385 Ca 0.38 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 55.10 2wbg h ALA 385 Cb 0.42 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 17.91 2wbg h ALA 385 CO -0.28 0.57 0.47 0.82 0.00 0.00 0.00 179.25 180.82 2wbg h ILE 386 N 0.93 1.24 0.00 0.00 2.04 -0.56 -1.85 117.51 119.31 2wbg h ILE 386 Ca 0.22 -0.58 -0.02 0.00 1.00 0.00 0.00 64.86 65.47 2wbg h ILE 386 Cb 0.21 0.10 -0.00 0.00 -0.74 0.00 0.00 36.82 36.38 2wbg h ILE 386 CO -0.02 0.26 -0.11 1.56 0.00 0.00 0.00 178.15 179.85 2wbg h GLN 387 N 1.16 0.00 -0.60 2.37 1.08 0.16 -2.10 115.11 117.18 2wbg h GLN 387 Ca 0.30 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.50 2wbg h GLN 387 Cb 0.01 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.44 2wbg h GLN 387 CO -0.05 0.11 0.00 0.39 -0.95 0.00 0.00 178.83 178.33 2wbg n GLU 388 N -3.27 4.12 0.00 1.46 1.02 -0.73 -4.97 120.64 118.27 2wbg n GLU 388 Ca 0.00 -2.98 0.00 0.00 -0.02 0.00 0.00 57.16 54.16 2wbg n GLU 388 Cb 0.35 -2.02 0.00 0.00 -0.02 0.00 0.00 31.44 29.75 2wbg n GLU 388 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2wbg n GLY 389 N 0.84 0.44 3.71 0.62 0.00 -0.79 -5.05 105.19 104.96 2wbg n GLY 389 Ca 0.26 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.86 2wbg n GLY 389 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2wbg s VAL 390 N -2.00 2.85 -1.52 1.61 1.01 -0.76 -4.88 120.40 116.72 2wbg s VAL 390 Ca 0.00 0.55 -0.10 0.00 0.00 0.00 0.00 61.98 62.43 2wbg s VAL 390 Cb 0.00 -3.35 -0.08 0.00 0.00 0.00 0.00 36.38 32.95 2wbg s VAL 390 CO 0.00 0.03 2.82 -0.81 0.00 0.00 0.00 175.10 177.14 2wbg n PRO 391 N 4.39 3.44 -2.44 2.72 -0.04 -1.26 -4.43 135.00 137.37 2wbg n PRO 391 Ca 0.14 -2.10 -0.43 0.00 -0.04 0.00 0.00 63.50 61.07 2wbg n PRO 391 Cb 0.40 -2.76 -0.02 0.00 -0.04 0.00 0.00 33.50 31.07 2wbg n PRO 391 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 2wbg s LEU 392 N 0.22 3.91 0.03 1.53 2.96 -1.26 -1.31 118.68 124.77 2wbg s LEU 392 Ca 0.65 1.23 0.23 0.00 -0.22 0.00 0.00 54.13 56.01 2wbg s LEU 392 Cb 0.17 -3.54 -0.01 0.00 0.50 0.00 0.00 46.19 43.31 2wbg s LEU 392 CO -0.06 -1.03 0.98 0.29 -1.32 0.00 0.00 176.35 175.21 2wbg n LYS 393 N 7.21 0.24 -3.88 1.98 4.76 0.58 -4.94 118.16 124.11 2wbg n LYS 393 Ca 0.14 -0.02 0.02 0.00 -2.87 0.00 0.00 58.31 55.59 2wbg n LYS 393 Cb 0.46 -1.56 0.01 0.00 -1.84 0.00 0.00 35.03 32.10 2wbg n LYS 393 CO 0.00 0.00 0.00 0.20 -1.37 0.00 0.00 177.40 176.23 2wbg s GLY 394 N -3.56 -0.21 -0.21 0.72 0.00 -1.26 -1.69 107.32 101.11 2wbg s GLY 394 Ca 0.04 0.23 -0.10 0.00 0.00 0.00 0.00 44.72 44.89 2wbg s GLY 394 CO 0.82 4.08 0.49 -0.47 0.00 0.00 0.00 173.10 178.02 2wbg s TYR 395 N -2.11 -0.79 -0.14 1.90 6.14 -0.26 -1.76 117.35 120.33 2wbg s TYR 395 Ca 0.25 1.59 0.02 0.00 0.64 0.00 0.00 57.07 59.57 2wbg s TYR 395 Cb 0.01 0.39 0.00 0.00 0.42 0.00 0.00 41.96 42.79 2wbg s TYR 395 CO -0.02 -0.43 -0.19 -0.06 0.64 0.00 0.00 175.55 175.49 2wbg s PHE 396 N 1.77 2.70 -0.06 4.97 0.40 0.70 -1.18 117.98 127.28 2wbg s PHE 396 Ca -0.08 -1.15 -0.30 0.00 -0.60 0.00 0.00 56.93 54.80 2wbg s PHE 396 Cb -0.08 -1.83 -0.03 0.00 0.51 0.00 0.00 43.02 41.59 2wbg s PHE 396 CO -0.15 -0.51 1.17 0.08 0.70 0.00 0.00 175.22 176.51 2wbg s VAL 397 N 0.71 4.33 -0.40 -0.44 1.01 -0.40 -2.22 120.40 123.00 2wbg s VAL 397 Ca -0.09 1.65 -0.21 0.00 0.00 0.00 0.00 61.98 63.33 2wbg s VAL 397 Cb -0.16 -4.06 0.01 0.00 0.00 0.00 0.00 36.38 32.18 2wbg s VAL 397 CO 0.01 0.01 0.65 0.86 0.00 0.00 0.00 175.10 176.62 2wbg s TRP 398 N 2.11 3.10 0.16 5.22 -0.11 -0.61 -0.57 118.94 128.25 2wbg s TRP 398 Ca 0.55 0.17 -0.00 0.00 1.22 0.00 0.00 56.10 58.04 2wbg s TRP 398 Cb -0.24 -3.26 -0.04 0.00 -1.50 0.00 0.00 33.47 28.43 2wbg s TRP 398 CO 0.22 -0.75 0.06 0.45 -4.62 0.00 0.00 176.95 172.31 2wbg s SER 399 N 1.90 0.59 0.14 5.86 0.15 -0.75 -4.01 113.70 117.57 2wbg s SER 399 Ca 0.24 -1.24 -0.19 0.00 0.70 0.00 0.00 55.95 55.46 2wbg s SER 399 Cb -0.14 0.25 0.01 0.00 -1.71 0.00 0.00 66.02 64.43 2wbg s SER 399 CO 0.17 -0.70 1.69 0.25 1.20 0.00 0.00 173.24 175.85 2wbg h LEU 400 N 2.75 -0.26 -8.69 3.45 5.85 -1.65 -0.70 115.31 116.06 2wbg h LEU 400 Ca -0.36 0.08 -0.69 0.00 0.84 0.00 0.00 57.88 57.75 2wbg h LEU 400 Cb 1.21 0.17 -0.27 0.00 0.37 0.00 0.00 40.66 42.13 2wbg h LEU 400 CO 0.59 -0.09 -0.88 -0.76 -0.34 0.00 0.00 178.44 176.96 2wbg s LEU 401 N -10.47 2.14 0.47 2.25 1.43 -1.26 -0.81 118.68 112.42 2wbg s LEU 401 Ca -0.14 -0.55 -0.23 0.00 -1.03 0.00 0.00 54.13 52.18 2wbg s LEU 401 Cb 0.11 -1.27 -0.09 0.00 0.03 0.00 0.00 46.19 44.97 2wbg s LEU 401 CO 0.69 0.27 1.00 0.47 0.23 0.00 0.00 176.35 179.01 2wbg n ASP 402 N 1.96 1.18 -1.63 2.29 8.00 -0.72 -3.92 116.55 123.71 2wbg n ASP 402 Ca -0.17 0.98 -0.03 0.00 0.71 0.00 0.00 54.79 56.28 2wbg n ASP 402 Cb 0.52 -1.37 0.01 0.00 -0.02 0.00 0.00 41.12 40.26 2wbg n ASP 402 CO 0.00 0.00 0.00 -0.46 -0.39 0.00 0.00 177.20 176.35 2wbg n ASN 403 N 0.20 -0.80 -4.58 -2.24 2.04 -1.26 -4.77 115.26 103.86 2wbg n ASN 403 Ca 0.10 -1.55 -0.42 0.00 -0.44 0.00 0.00 54.58 52.28 2wbg n ASN 403 Cb 0.41 1.33 -0.03 0.00 -2.53 0.00 0.00 39.78 38.97 2wbg n ASN 403 CO 0.00 0.00 0.00 0.12 -0.44 0.00 0.00 177.26 176.94 2wbg s PHE 404 N -6.50 2.36 -1.12 -2.53 5.36 -0.73 -4.56 117.98 110.26 2wbg s PHE 404 Ca 0.06 0.45 -0.06 0.00 -0.96 0.00 0.00 56.93 56.42 2wbg s PHE 404 Cb -0.02 -4.42 0.04 0.00 -0.34 0.00 0.00 43.02 38.28 2wbg s PHE 404 CO 0.04 -1.89 2.66 -1.91 -1.46 0.00 0.00 175.22 172.66 2wbg n GLU 405 N 8.61 3.82 0.00 10.12 4.07 -0.12 -4.65 120.64 142.50 2wbg n GLU 405 Ca 0.11 -2.83 0.00 0.00 -0.06 0.00 0.00 57.16 54.39 2wbg n GLU 405 Cb 0.49 -2.52 0.00 0.00 -0.06 0.00 0.00 31.44 29.35 2wbg n GLU 405 CO 0.00 0.00 0.00 0.91 -0.06 0.00 0.00 177.13 177.98 2wbg n TRP 406 N 1.97 0.00 0.34 4.31 7.02 -1.26 -1.37 117.44 128.45 2wbg n TRP 406 Ca 0.62 0.00 0.11 0.00 -1.02 0.00 0.00 57.50 57.21 2wbg n TRP 406 Cb 0.35 0.00 0.50 0.00 -2.42 0.00 0.00 31.31 29.74 2wbg n TRP 406 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2wbg n ALA 407 N 10.18 1.51 1.09 6.99 0.00 -1.26 -0.98 120.51 138.05 2wbg n ALA 407 Ca 0.00 0.11 0.13 0.00 0.00 0.00 0.00 53.44 53.68 2wbg n ALA 407 Cb 0.00 -1.36 0.49 0.00 0.00 0.00 0.00 19.45 18.57 2wbg n ALA 407 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 2wbg n GLU 408 N -2.22 0.15 0.00 0.00 -0.58 -0.47 -0.70 120.64 116.82 2wbg n GLU 408 Ca 0.01 -0.05 0.00 0.00 -0.42 0.00 0.00 57.16 56.70 2wbg n GLU 408 Cb 0.18 -1.50 0.00 0.00 -0.57 0.00 0.00 31.44 29.55 2wbg n GLU 408 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2wbg n GLY 409 N 1.45 0.97 0.08 0.62 0.00 -0.15 -3.08 105.19 105.09 2wbg n GLY 409 Ca 0.08 -0.64 0.16 0.00 0.00 0.00 0.00 46.02 45.62 2wbg n GLY 409 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2wbg n TYR 410 N 0.00 0.00 0.34 1.61 4.01 -1.26 -0.95 117.16 120.91 2wbg n TYR 410 Ca 0.00 0.00 0.11 0.00 -0.16 0.00 0.00 57.90 57.85 2wbg n TYR 410 Cb 0.00 -0.01 0.50 0.00 -0.31 0.00 0.00 39.34 39.51 2wbg n TYR 410 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 2wbg n SER 411 N -0.82 0.61 -4.13 7.72 3.41 -1.18 -4.55 113.62 114.69 2wbg n SER 411 Ca 0.23 0.68 -0.33 0.00 -0.26 0.00 0.00 58.87 59.18 2wbg n SER 411 Cb 0.16 -0.80 -0.16 0.00 -0.26 0.00 0.00 64.21 63.15 2wbg n SER 411 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 2wbg s LYS 412 N -3.35 3.00 -0.31 4.33 -0.14 -1.26 -5.05 119.74 116.97 2wbg s LYS 412 Ca 0.03 -0.82 -0.09 0.00 -1.36 0.00 0.00 55.97 53.73 2wbg s LYS 412 Cb 0.08 -2.59 0.00 0.00 -1.68 0.00 0.00 37.83 33.65 2wbg s LYS 412 CO 0.34 -0.21 0.14 1.03 -0.76 0.00 0.00 175.35 175.88 2wbg s ARG 413 N 1.30 3.19 0.00 1.68 0.52 -1.26 -4.59 118.95 119.79 2wbg s ARG 413 Ca 0.05 -0.81 0.19 0.00 -0.52 0.00 0.00 55.73 54.64 2wbg s ARG 413 Cb -0.13 -3.52 0.17 0.00 0.52 0.00 0.00 34.95 31.99 2wbg s ARG 413 CO -0.13 -0.46 1.12 1.19 0.02 0.00 0.00 175.30 177.04 2wbg n PHE 414 N 4.95 0.04 -1.49 -0.53 3.01 -1.26 -3.44 117.46 118.74 2wbg n PHE 414 Ca -0.14 -0.02 -0.32 0.00 1.01 0.00 0.00 57.45 57.98 2wbg n PHE 414 Cb 0.48 -0.00 0.07 0.00 -0.01 0.00 0.00 39.48 40.02 2wbg n PHE 414 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 2wbg s GLY 415 N -1.57 1.89 0.00 1.37 0.00 -1.25 -1.81 107.32 105.95 2wbg s GLY 415 Ca 0.23 0.38 0.27 0.00 0.00 0.00 0.00 44.72 45.60 2wbg s GLY 415 CO 0.24 0.73 1.63 0.29 0.00 0.00 0.00 173.10 175.99 2wbg n ILE 416 N -3.02 0.00 -4.66 0.90 -5.35 -0.27 -4.77 119.36 102.19 2wbg n ILE 416 Ca 0.10 -0.17 -0.28 0.00 -0.27 0.00 0.00 62.75 62.13 2wbg n ILE 416 Cb 0.53 0.42 -0.17 0.00 -1.74 0.00 0.00 39.64 38.68 2wbg n ILE 416 CO 0.00 0.00 0.00 -0.69 -1.76 0.00 0.00 176.55 174.10 2wbg s VAL 417 N -2.33 1.51 0.22 7.28 1.01 0.01 -1.32 120.40 126.77 2wbg s VAL 417 Ca 0.29 -0.67 -0.25 0.00 0.00 0.00 0.00 61.98 61.34 2wbg s VAL 417 Cb 0.20 -1.36 -0.09 0.00 0.00 0.00 0.00 36.38 35.14 2wbg s VAL 417 CO 0.46 0.44 0.83 -0.47 0.00 0.00 0.00 175.10 176.36 2wbg s TYR 418 N 0.75 3.84 -0.19 5.22 6.14 0.18 -1.76 117.35 131.53 2wbg s TYR 418 Ca -0.12 1.68 0.01 0.00 0.64 0.00 0.00 57.07 59.28 2wbg s TYR 418 Cb -0.16 -2.82 0.02 0.00 0.42 0.00 0.00 41.96 39.43 2wbg s TYR 418 CO 0.02 0.42 -0.19 0.08 0.64 0.00 0.00 175.55 176.52 2wbg s VAL 419 N -1.30 2.15 -0.55 3.14 1.01 -1.26 -0.26 120.40 123.32 2wbg s VAL 419 Ca 0.41 -0.94 -0.24 0.00 0.00 0.00 0.00 61.98 61.21 2wbg s VAL 419 Cb -0.22 -1.92 0.04 0.00 0.00 0.00 0.00 36.38 34.29 2wbg s VAL 419 CO 0.26 0.51 0.94 -0.62 0.00 0.00 0.00 175.10 176.19 2wbg s ASP 420 N 1.30 6.34 0.33 3.32 -1.08 -0.42 -4.90 116.67 121.55 2wbg s ASP 420 Ca 0.05 -0.36 0.26 0.00 -0.52 0.00 0.00 52.55 51.97 2wbg s ASP 420 Cb -0.13 -2.43 1.08 0.00 -1.46 0.00 0.00 42.92 39.97 2wbg s ASP 420 CO -0.12 -1.22 1.78 1.88 0.52 0.00 0.00 175.17 178.01 2wbg h TYR 421 N 9.31 0.00 0.00 -5.34 0.05 -1.95 0.63 116.97 119.68 2wbg h TYR 421 Ca -0.26 0.00 -0.02 0.00 0.05 0.00 0.00 58.73 58.50 2wbg h TYR 421 Cb 1.07 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.81 2wbg h TYR 421 CO 0.91 0.00 -0.08 0.66 -1.05 0.00 0.00 178.16 178.60 2wbg h SER 422 N 0.00 0.00 0.00 3.88 4.64 -1.98 -3.36 113.55 116.74 2wbg h SER 422 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2wbg h SER 422 Cb 0.41 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.50 2wbg h SER 422 CO 0.00 0.08 -0.00 0.35 -0.87 0.00 0.00 176.83 176.39 2wbg n THR 423 N -3.15 0.00 -1.09 2.95 -2.24 -0.91 -5.00 114.28 104.85 2wbg n THR 423 Ca 0.02 -0.32 -0.03 0.00 -2.27 0.00 0.00 64.05 61.45 2wbg n THR 423 Cb 0.47 0.99 -0.01 0.00 -2.10 0.00 0.00 70.33 69.69 2wbg n THR 423 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2wbg n GLN 424 N -0.65 -1.35 -2.08 -0.78 1.13 0.22 -5.00 117.38 108.87 2wbg n GLN 424 Ca 0.00 0.49 -0.41 0.00 -1.94 0.00 0.00 57.00 55.14 2wbg n GLN 424 Cb 0.00 -4.57 -0.02 0.00 0.11 0.00 0.00 30.24 25.76 2wbg n GLN 424 CO 0.00 0.00 0.00 0.21 -1.44 0.00 0.00 177.06 175.83 2wbg s LYS 425 N -1.79 4.31 -0.10 -1.09 2.20 -1.20 -4.76 119.74 117.31 2wbg s LYS 425 Ca 0.00 2.22 -0.16 0.00 -0.36 0.00 0.00 55.97 57.67 2wbg s LYS 425 Cb 0.00 -3.12 -0.05 0.00 -1.51 0.00 0.00 37.83 33.15 2wbg s LYS 425 CO 0.00 -0.33 0.40 1.03 -0.36 0.00 0.00 175.35 176.09 2wbg s ARG 426 N -0.57 4.20 -0.19 4.03 3.00 -1.26 -1.31 118.95 126.86 2wbg s ARG 426 Ca 0.57 0.33 0.01 0.00 0.00 0.00 0.00 55.73 56.64 2wbg s ARG 426 Cb -0.40 -3.38 0.03 0.00 0.00 0.00 0.00 34.95 31.21 2wbg s ARG 426 CO 0.44 0.32 -0.13 0.42 0.00 0.00 0.00 175.30 176.34 2wbg s ILE 427 N 0.15 1.73 0.04 1.52 1.01 0.64 -4.95 121.20 121.34 2wbg s ILE 427 Ca 0.23 -0.94 -0.30 0.00 0.00 0.00 0.00 60.65 59.63 2wbg s ILE 427 Cb -0.15 -1.72 -0.07 0.00 0.01 0.00 0.00 42.46 40.54 2wbg s ILE 427 CO 0.09 0.29 1.54 -0.69 0.00 0.00 0.00 174.94 176.18 2wbg s VAL 428 N 1.38 3.33 0.74 2.92 1.01 -1.26 0.48 120.40 129.00 2wbg s VAL 428 Ca 0.01 0.75 -0.11 0.00 0.00 0.00 0.00 61.98 62.62 2wbg s VAL 428 Cb -0.15 -3.48 0.04 0.00 0.00 0.00 0.00 36.38 32.79 2wbg s VAL 428 CO -0.09 -0.00 1.12 -0.54 0.00 0.00 0.00 175.10 175.58 2wbg s LYS 429 N 2.56 2.53 0.41 2.72 1.02 -0.44 -4.57 119.74 123.97 2wbg s LYS 429 Ca 0.70 0.32 0.11 0.00 0.02 0.00 0.00 55.97 57.11 2wbg s LYS 429 Cb -0.36 -2.00 0.93 0.00 -0.52 0.00 0.00 37.83 35.88 2wbg s LYS 429 CO 0.30 -1.23 1.99 -0.44 -0.92 0.00 0.00 175.35 175.04 2wbg h ASP 430 N -0.79 0.45 0.16 2.83 5.19 -1.26 0.12 116.42 123.12 2wbg h ASP 430 Ca -0.45 0.00 -0.03 0.00 -0.62 0.00 0.00 57.03 55.93 2wbg h ASP 430 Cb 1.28 -0.09 -0.00 0.00 0.18 0.00 0.00 39.33 40.69 2wbg h ASP 430 CO 0.64 0.29 -0.13 0.77 -3.12 0.00 0.00 179.24 177.70 2wbg h SER 431 N 0.51 0.00 -0.13 6.45 4.64 -1.82 -0.19 113.55 123.00 2wbg h SER 431 Ca 0.26 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.54 2wbg h SER 431 Cb 0.36 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.45 2wbg h SER 431 CO -0.08 0.13 -0.06 1.23 -0.87 0.00 0.00 176.83 177.18 2wbg h GLY 432 N 0.45 0.30 0.96 -0.77 0.00 -1.05 0.12 103.07 103.09 2wbg h GLY 432 Ca -0.00 -0.27 -0.04 0.00 0.00 0.00 0.00 47.33 47.02 2wbg h GLY 432 CO 0.02 0.24 0.12 -0.97 0.00 0.00 0.00 176.54 175.95 2wbg h TYR 433 N -0.06 0.76 -0.24 5.60 0.05 -1.29 0.19 116.97 121.99 2wbg h TYR 433 Ca 0.03 -0.09 0.05 0.00 0.05 0.00 0.00 58.73 58.77 2wbg h TYR 433 Cb 0.52 -0.22 -0.04 0.00 1.01 0.00 0.00 36.73 38.00 2wbg h TYR 433 CO 0.06 0.69 -0.03 2.35 -1.05 0.00 0.00 178.16 180.19 2wbg h TRP 434 N 0.61 -0.07 -0.43 4.88 7.01 -1.00 -2.51 115.95 124.44 2wbg h TRP 434 Ca 0.15 0.02 -0.09 0.00 2.11 0.00 0.00 58.89 61.07 2wbg h TRP 434 Cb 0.31 0.07 -0.02 0.00 -2.10 0.00 0.00 29.16 27.42 2wbg h TRP 434 CO 0.02 -0.07 -0.11 -0.92 -2.79 0.00 0.00 178.44 174.57 2wbg h TYR 435 N 0.04 0.86 -0.69 2.65 3.20 -0.53 -1.19 116.97 121.30 2wbg h TYR 435 Ca 0.12 -0.16 0.14 0.00 3.14 0.00 0.00 58.73 61.97 2wbg h TYR 435 Cb 0.16 -0.22 -0.10 0.00 1.54 0.00 0.00 36.73 38.11 2wbg h TYR 435 CO -0.22 0.85 0.16 1.03 -1.64 0.00 0.00 178.16 178.34 2wbg h SER 436 N 0.71 0.00 -0.33 -2.11 0.87 -0.81 -0.30 113.55 111.57 2wbg h SER 436 Ca 0.12 0.14 -0.00 0.00 -1.23 0.00 0.00 61.79 60.81 2wbg h SER 436 Cb 0.59 0.18 -0.02 0.00 -0.44 0.00 0.00 62.40 62.72 2wbg h SER 436 CO 0.04 -0.02 0.20 0.78 -0.53 0.00 0.00 176.83 177.30 2wbg h ASN 437 N 0.27 0.40 -0.43 6.23 2.35 -0.81 -0.54 115.58 123.05 2wbg h ASN 437 Ca 0.38 -0.05 0.06 0.00 -0.55 0.00 0.00 56.30 56.14 2wbg h ASN 437 Cb 0.62 -0.10 -0.05 0.00 0.05 0.00 0.00 38.32 38.84 2wbg h ASN 437 CO -0.48 0.34 0.12 0.58 -1.65 0.00 0.00 177.43 176.34 2wbg h VAL 438 N 0.43 0.81 -0.65 2.81 2.07 -0.42 0.98 116.25 122.28 2wbg h VAL 438 Ca 0.12 -0.09 -0.01 0.00 0.82 0.00 0.00 66.70 67.54 2wbg h VAL 438 Cb 0.01 0.53 -0.03 0.00 -1.52 0.00 0.00 31.29 30.28 2wbg h VAL 438 CO -0.02 0.05 0.38 0.58 0.02 0.00 0.00 177.57 178.58 2wbg h VAL 439 N 0.26 1.19 -0.27 2.57 2.07 -0.85 0.11 116.25 121.33 2wbg h VAL 439 Ca 0.21 -0.43 0.00 0.00 0.82 0.00 0.00 66.70 67.30 2wbg h VAL 439 Cb 0.23 0.31 -0.01 0.00 -1.52 0.00 0.00 31.29 30.30 2wbg h VAL 439 CO -0.24 0.20 0.18 0.11 0.02 0.00 0.00 177.57 177.84 2wbg h LYS 440 N 0.88 0.36 -0.03 1.57 1.57 -0.10 -2.58 116.57 118.24 2wbg h LYS 440 Ca 0.23 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.99 2wbg h LYS 440 Cb -0.01 -0.08 0.00 0.00 0.08 0.00 0.00 32.23 32.21 2wbg h LYS 440 CO -0.04 0.24 0.00 0.09 -0.57 0.00 0.00 179.45 179.17 2wbg n ASN 441 N -4.90 0.44 -4.21 0.86 3.02 0.24 -4.90 115.26 105.82 2wbg n ASN 441 Ca -0.02 -1.32 -0.36 0.00 -0.03 0.00 0.00 54.58 52.85 2wbg n ASN 441 Cb 0.03 -0.01 -0.02 0.00 -0.61 0.00 0.00 39.78 39.16 2wbg n ASN 441 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 2wbg n ASN 442 N -0.57 -3.41 0.00 6.41 5.15 -0.11 -4.80 115.26 117.93 2wbg n ASN 442 Ca 0.19 -1.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.17 2wbg n ASN 442 Cb 0.16 -2.83 0.00 0.00 -0.53 0.00 0.00 39.78 36.58 2wbg n ASN 442 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2wbg n GLY 443 N -1.41 -0.44 3.92 8.20 0.00 -0.43 -0.75 105.19 114.28 2wbg n GLY 443 Ca 0.07 -1.30 -0.30 0.00 0.00 0.00 0.00 46.02 44.50 2wbg n GLY 443 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2wbg s LEU 444 N 0.00 4.32 0.00 0.99 1.43 -0.57 -4.40 118.68 120.45 2wbg s LEU 444 Ca 0.00 0.33 0.00 0.00 -1.03 0.00 0.00 54.13 53.43 2wbg s LEU 444 Cb 0.00 -3.05 0.00 0.00 0.03 0.00 0.00 46.19 43.17 2wbg s LEU 444 CO 0.00 0.10 0.29 -0.62 0.23 0.00 0.00 176.35 176.35