#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dxk s GLY 3 N 0.00 -0.34 0.16 0.00 0.00 -1.26 -5.04 107.32 100.84 3dxk s GLY 3 Ca 0.00 0.51 -0.03 0.00 0.00 0.00 0.00 44.72 45.20 3dxk s GLY 3 CO 0.00 0.89 1.38 -0.09 0.00 0.00 0.00 173.10 175.29 3dxk h ARG 4 N 2.00 0.43 -5.68 2.90 2.43 -2.08 -3.45 114.38 110.94 3dxk h ARG 4 Ca -0.29 -0.38 -0.67 0.00 -0.81 0.00 0.00 59.98 57.83 3dxk h ARG 4 Cb 1.20 0.09 -0.08 0.00 -0.42 0.00 0.00 29.97 30.76 3dxk h ARG 4 CO 0.29 1.03 -0.50 -0.51 -1.51 0.00 0.00 179.97 178.77 3dxk s LEU 5 N -7.90 4.28 0.54 3.80 1.43 -1.26 -5.10 118.68 114.46 3dxk s LEU 5 Ca -0.06 0.42 -0.17 0.00 -1.03 0.00 0.00 54.13 53.29 3dxk s LEU 5 Cb 0.10 -2.04 -0.06 0.00 0.03 0.00 0.00 46.19 44.22 3dxk s LEU 5 CO 0.85 0.40 1.02 -2.16 0.23 0.00 0.00 176.35 176.70 3dxk s PRO 6 N -0.99 3.67 0.64 1.29 0.04 -1.26 -4.95 135.00 133.45 3dxk s PRO 6 Ca 0.15 1.16 -0.14 0.00 0.04 0.00 0.00 61.00 62.20 3dxk s PRO 6 Cb -0.12 -2.09 -0.01 0.00 0.04 0.00 0.00 34.50 32.32 3dxk s PRO 6 CO 0.04 -0.52 1.07 0.00 0.04 0.00 0.00 177.00 177.63 3dxk s ALA 7 N -2.39 2.65 -0.04 8.56 0.00 -1.26 -4.75 121.76 124.54 3dxk s ALA 7 Ca 0.63 0.32 -0.18 0.00 0.00 0.00 0.00 51.96 52.73 3dxk s ALA 7 Cb -0.14 -3.23 -0.05 0.00 0.00 0.00 0.00 23.12 19.70 3dxk s ALA 7 CO 0.30 -1.05 0.49 0.00 0.00 0.00 0.00 175.76 175.50 3dxk s VAL 9 N -0.24 2.23 -0.13 0.00 1.01 -0.15 -0.64 120.40 122.49 3dxk s VAL 9 Ca 0.27 -1.02 0.00 0.00 0.00 0.00 0.00 61.98 61.23 3dxk s VAL 9 Cb -0.17 -2.02 0.02 0.00 0.00 0.00 0.00 36.38 34.22 3dxk s VAL 9 CO 0.14 0.42 -0.12 -0.69 0.00 0.00 0.00 175.10 174.84 3dxk s VAL 10 N 1.28 1.36 -0.37 2.92 1.01 -0.47 -2.04 120.40 124.08 3dxk s VAL 10 Ca 0.03 -0.51 -0.00 0.00 0.00 0.00 0.00 61.98 61.49 3dxk s VAL 10 Cb -0.14 -1.30 0.10 0.00 0.00 0.00 0.00 36.38 35.04 3dxk s VAL 10 CO -0.10 0.42 0.12 -0.62 0.00 0.00 0.00 175.10 174.92 3dxk s ASP 11 N 1.45 5.03 -0.27 3.32 3.68 0.12 -3.08 116.67 126.91 3dxk s ASP 11 Ca 0.02 -1.98 -0.23 0.00 2.13 0.00 0.00 52.55 52.49 3dxk s ASP 11 Cb -0.13 -1.74 -0.01 0.00 -1.45 0.00 0.00 42.92 39.59 3dxk s ASP 11 CO -0.08 -0.45 0.77 0.00 0.13 0.00 0.00 175.17 175.54 3dxk s GLY 13 N 1.48 2.17 0.33 0.00 0.00 -0.28 -4.92 107.32 106.11 3dxk s GLY 13 Ca 0.32 -1.90 0.06 0.00 0.00 0.00 0.00 44.72 43.20 3dxk s GLY 13 CO 0.10 -1.73 1.82 -0.84 0.00 0.00 0.00 173.10 172.44 3dxk h THR 14 N 1.06 1.23 0.00 0.90 2.02 -1.93 -3.36 112.91 112.83 3dxk h THR 14 Ca -0.41 -1.06 -0.30 0.00 0.77 0.00 0.00 66.41 65.41 3dxk h THR 14 Cb 1.27 1.29 -0.05 0.00 -1.74 0.00 0.00 68.15 68.92 3dxk h THR 14 CO 0.59 0.33 -2.07 0.61 0.37 0.00 0.00 175.52 175.35 3dxk n GLY 15 N -0.61 -0.28 3.16 2.16 0.00 -1.26 -4.76 105.19 103.60 3dxk n GLY 15 Ca -0.00 -0.11 -0.16 0.00 0.00 0.00 0.00 46.02 45.75 3dxk n GLY 15 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3dxk s TYR 16 N -2.36 1.07 -0.17 1.61 1.51 -1.26 -1.25 117.35 116.51 3dxk s TYR 16 Ca -0.26 -0.54 -0.01 0.00 -1.01 0.00 0.00 57.07 55.26 3dxk s TYR 16 Cb 0.08 -0.60 -0.00 0.00 -0.11 0.00 0.00 41.96 41.33 3dxk s TYR 16 CO 0.39 0.02 -0.13 0.99 -1.11 0.00 0.00 175.55 175.70 3dxk s THR 17 N -1.73 2.78 -0.23 -0.71 2.01 0.21 -1.13 115.64 116.83 3dxk s THR 17 Ca -0.00 -0.72 -0.11 0.00 0.31 0.00 0.00 61.69 61.17 3dxk s THR 17 Cb -0.07 -2.19 -0.05 0.00 0.01 0.00 0.00 72.50 70.19 3dxk s THR 17 CO 0.01 0.50 0.17 -0.54 -0.69 0.00 0.00 174.62 174.07 3dxk s LYS 18 N 0.97 4.09 0.02 4.92 3.01 0.11 -1.50 119.74 131.36 3dxk s LYS 18 Ca -0.02 -0.24 0.01 0.00 -1.01 0.00 0.00 55.97 54.71 3dxk s LYS 18 Cb -0.15 -3.52 -0.02 0.00 -1.01 0.00 0.00 37.83 33.13 3dxk s LYS 18 CO -0.02 0.09 -0.04 -0.48 0.51 0.00 0.00 175.35 175.41 3dxk s LEU 19 N 0.97 2.17 0.00 3.17 2.34 -0.60 0.12 118.68 126.86 3dxk s LEU 19 Ca 0.08 -0.37 0.00 0.00 0.06 0.00 0.00 54.13 53.90 3dxk s LEU 19 Cb -0.13 -0.05 0.00 0.00 -0.56 0.00 0.00 46.19 45.45 3dxk s LEU 19 CO 0.04 -0.17 0.00 0.61 -1.06 0.00 0.00 176.35 175.77 3dxk n GLY 20 N 1.99 -1.17 3.86 -3.48 0.00 -0.87 -1.24 105.19 104.29 3dxk n GLY 20 Ca -0.20 -0.88 -0.34 0.00 0.00 0.00 0.00 46.02 44.60 3dxk n GLY 20 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3dxk s TYR 21 N -3.00 3.47 0.58 1.61 1.51 -1.26 -0.97 117.35 119.29 3dxk s TYR 21 Ca 0.00 0.33 -0.20 0.00 -1.01 0.00 0.00 57.07 56.19 3dxk s TYR 21 Cb 0.00 -1.82 -0.04 0.00 -0.11 0.00 0.00 41.96 39.99 3dxk s TYR 21 CO 0.00 0.63 1.18 0.00 -1.11 0.00 0.00 175.55 176.25 3dxk n ALA 22 N 1.15 0.89 0.00 3.71 0.00 0.10 -3.04 120.51 123.33 3dxk n ALA 22 Ca -0.13 0.06 0.00 0.00 0.00 0.00 0.00 53.44 53.38 3dxk n ALA 22 Cb 0.53 -2.24 0.00 0.00 0.00 0.00 0.00 19.45 17.74 3dxk n ALA 22 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dxk n GLY 23 N 1.01 3.42 3.93 0.00 0.00 -1.08 -4.70 105.19 107.77 3dxk n GLY 23 Ca 0.13 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.90 3dxk n GLY 23 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3dxk s ASN 24 N -1.01 5.41 -0.20 1.61 0.01 -1.17 -5.02 114.94 114.57 3dxk s ASN 24 Ca 0.00 0.48 -0.12 0.00 -0.71 0.00 0.00 52.86 52.51 3dxk s ASN 24 Cb 0.00 -1.42 -0.20 0.00 0.41 0.00 0.00 41.25 40.04 3dxk s ASN 24 CO 0.00 -1.13 0.09 0.41 -1.51 0.00 0.00 177.10 174.96 3dxk n THR 25 N -2.54 1.61 -4.12 1.60 -1.04 -1.26 -4.77 114.28 103.76 3dxk n THR 25 Ca 0.05 -0.37 -0.22 0.00 -2.04 0.00 0.00 64.05 61.48 3dxk n THR 25 Cb 0.59 -1.83 -0.04 0.00 -1.82 0.00 0.00 70.33 67.22 3dxk n THR 25 CO 0.00 0.00 0.00 -1.61 -0.64 0.00 0.00 175.07 172.82 3dxk s GLU 26 N -2.47 2.92 0.66 -2.82 0.41 -1.26 -4.73 118.70 111.40 3dxk s GLU 26 Ca -0.30 -1.05 -0.14 0.00 -0.41 0.00 0.00 54.97 53.08 3dxk s GLU 26 Cb 0.08 -2.56 -0.00 0.00 -1.78 0.00 0.00 34.13 29.86 3dxk s GLU 26 CO 0.63 0.40 1.07 -2.14 -0.49 0.00 0.00 175.26 174.74 3dxk s PRO 27 N -3.80 2.97 0.12 0.39 0.02 -1.26 -4.94 135.00 128.50 3dxk s PRO 27 Ca 0.33 1.17 0.06 0.00 0.02 0.00 0.00 61.00 62.58 3dxk s PRO 27 Cb -0.08 -1.99 -0.21 0.00 0.02 0.00 0.00 34.50 32.25 3dxk s PRO 27 CO 0.25 -1.09 1.27 1.96 -0.33 0.00 0.00 177.00 179.07 3dxk h GLN 28 N -0.16 0.02 -3.86 5.54 7.50 -1.54 -3.46 115.11 119.15 3dxk h GLN 28 Ca -0.46 -0.03 -0.20 0.00 0.50 0.00 0.00 58.65 58.46 3dxk h GLN 28 Cb 1.22 0.01 -0.24 0.00 0.05 0.00 0.00 27.48 28.52 3dxk h GLN 28 CO 0.56 1.01 -0.71 -0.06 -1.50 0.00 0.00 178.83 178.13 3dxk s PHE 29 N -2.72 0.13 -0.28 2.96 0.40 -0.39 -5.03 117.98 113.05 3dxk s PHE 29 Ca 0.01 -0.27 -0.02 0.00 -0.60 0.00 0.00 56.93 56.05 3dxk s PHE 29 Cb 0.10 -0.10 0.09 0.00 0.51 0.00 0.00 43.02 43.62 3dxk s PHE 29 CO 0.82 -0.10 0.09 0.42 0.70 0.00 0.00 175.22 177.16 3dxk s ILE 30 N -0.75 0.64 0.15 0.64 1.01 -1.26 -1.55 121.20 120.08 3dxk s ILE 30 Ca -0.08 -1.12 0.09 0.00 0.00 0.00 0.00 60.65 59.53 3dxk s ILE 30 Cb -0.05 -1.42 -0.04 0.00 0.01 0.00 0.00 42.46 40.95 3dxk s ILE 30 CO -0.01 -0.60 -0.21 0.27 0.00 0.00 0.00 174.94 174.40 3dxk s ILE 31 N 1.75 1.91 0.14 2.92 -4.36 -0.57 -4.93 121.20 118.07 3dxk s ILE 31 Ca 0.07 -1.82 -0.33 0.00 -0.26 0.00 0.00 60.65 58.32 3dxk s ILE 31 Cb -0.17 -1.82 -0.12 0.00 1.25 0.00 0.00 42.46 41.60 3dxk s ILE 31 CO -0.24 -0.18 1.73 -2.65 0.24 0.00 0.00 174.94 173.84 3dxk n PRO 32 N 0.56 2.52 -0.56 0.37 -0.02 -1.26 0.64 135.00 137.24 3dxk n PRO 32 Ca -0.15 0.91 -0.11 0.00 -2.02 0.00 0.00 63.50 62.13 3dxk n PRO 32 Cb 0.56 -2.75 -0.06 0.00 -0.02 0.00 0.00 33.50 31.22 3dxk n PRO 32 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 3dxk n SER 33 N 4.58 3.28 -4.11 2.55 7.64 -0.38 -3.10 113.62 124.07 3dxk n SER 33 Ca 0.18 -2.10 -0.13 0.00 1.01 0.00 0.00 58.87 57.83 3dxk n SER 33 Cb 0.33 -0.83 -0.11 0.00 -1.01 0.00 0.00 64.21 62.59 3dxk n SER 33 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3dxk s ILE 35 N -1.94 0.60 -0.18 0.00 2.07 -0.62 -1.43 121.20 119.69 3dxk s ILE 35 Ca -0.03 -0.26 -0.07 0.00 -1.41 0.00 0.00 60.65 58.89 3dxk s ILE 35 Cb -0.06 -0.55 -0.04 0.00 0.13 0.00 0.00 42.46 41.94 3dxk s ILE 35 CO -0.00 0.20 0.04 0.00 -1.91 0.00 0.00 174.94 173.27 3dxk s ALA 36 N 0.27 3.33 0.28 1.50 0.00 0.38 -0.43 121.76 127.09 3dxk s ALA 36 Ca -0.03 -0.76 0.01 0.00 0.00 0.00 0.00 51.96 51.18 3dxk s ALA 36 Cb -0.08 -1.85 -0.01 0.00 0.00 0.00 0.00 23.12 21.19 3dxk s ALA 36 CO 0.00 0.19 0.05 0.44 0.00 0.00 0.00 175.76 176.44 3dxk n ILE 37 N 3.52 0.00 -4.09 0.00 -5.35 -0.46 -2.08 119.36 110.89 3dxk n ILE 37 Ca -0.17 -1.47 -0.35 0.00 -0.27 0.00 0.00 62.75 60.50 3dxk n ILE 37 Cb 0.52 0.43 -0.11 0.00 -1.74 0.00 0.00 39.64 38.74 3dxk n ILE 37 CO 0.00 0.00 0.00 -0.54 -1.76 0.00 0.00 176.55 174.25 3dxk s LYS 38 N -3.03 3.81 -0.21 6.28 -0.14 -1.26 -0.72 119.74 124.48 3dxk s LYS 38 Ca 0.07 -0.43 -0.07 0.00 -1.36 0.00 0.00 55.97 54.19 3dxk s LYS 38 Cb 0.00 -3.13 0.09 0.00 -1.68 0.00 0.00 37.83 33.12 3dxk s LYS 38 CO 0.05 0.17 0.43 -1.83 -0.76 0.00 0.00 175.35 173.42 3dxk s GLU 39 N 0.60 0.34 0.00 1.68 -1.05 -1.26 -5.01 118.70 114.00 3dxk s GLU 39 Ca 0.01 1.04 0.00 0.00 -0.15 0.00 0.00 54.97 55.87 3dxk s GLU 39 Cb -0.13 0.34 0.00 0.00 -0.44 0.00 0.00 34.13 33.89 3dxk s GLU 39 CO 0.02 -0.26 0.00 0.43 0.95 0.00 0.00 175.26 176.39 3dxk n SER 40 N 5.39 0.00 -1.42 0.83 7.64 -1.26 -4.98 113.62 119.82 3dxk n SER 40 Ca -0.08 -0.31 0.00 0.00 1.01 0.00 0.00 58.87 59.49 3dxk n SER 40 Cb 0.49 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.69 3dxk n SER 40 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 3dxk n VAL 51 N 0.00 -0.42 -2.44 0.44 0.31 -1.26 -5.32 118.33 109.64 3dxk n VAL 51 Ca 0.00 0.00 -0.40 0.00 -0.01 0.00 0.00 64.34 63.93 3dxk n VAL 51 Cb 0.13 -1.14 -0.04 0.00 -0.91 0.00 0.00 33.84 31.88 3dxk n VAL 51 CO 0.00 0.00 0.00 -0.04 -1.32 0.00 0.00 176.83 175.47 3dxk s MET 52 N 0.00 4.60 0.03 5.55 1.00 -1.26 -5.04 119.30 124.18 3dxk s MET 52 Ca 0.00 1.83 -0.04 0.00 0.00 0.00 0.00 55.69 57.48 3dxk s MET 52 Cb 0.00 -3.19 -0.01 0.00 0.00 0.00 0.00 34.83 31.62 3dxk s MET 52 CO 0.00 0.14 0.06 -1.59 0.00 0.00 0.00 175.02 173.63 3dxk s LYS 53 N -1.25 0.52 6.56 2.03 -2.85 -1.26 -5.02 119.74 118.48 3dxk s LYS 53 Ca 0.46 -0.72 0.00 0.00 -1.00 0.00 0.00 55.97 54.71 3dxk s LYS 53 Cb -0.32 0.20 0.00 0.00 -2.06 0.00 0.00 37.83 35.65 3dxk s LYS 53 CO 0.41 -0.12 0.00 0.41 0.10 0.00 0.00 175.35 176.15 3dxk n GLY 54 N 0.97 2.01 0.94 0.59 0.00 -1.26 -2.67 105.19 105.77 3dxk n GLY 54 Ca -0.20 0.01 0.05 0.00 0.00 0.00 0.00 46.02 45.89 3dxk n GLY 54 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3dxk n VAL 55 N 0.00 1.38 0.22 1.61 0.31 -1.26 -4.79 118.33 115.80 3dxk n VAL 55 Ca 0.00 -2.40 0.06 0.00 -0.01 0.00 0.00 64.34 61.99 3dxk n VAL 55 Cb 0.00 0.23 0.50 0.00 -0.91 0.00 0.00 33.84 33.66 3dxk n VAL 55 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 3dxk h ASP 56 N 1.00 0.00 0.22 4.52 3.32 -1.90 -2.42 116.42 121.15 3dxk h ASP 56 Ca -0.09 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 56.94 3dxk h ASP 56 Cb 1.34 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.89 3dxk h ASP 56 CO 0.04 0.23 -0.09 -2.24 -1.72 0.00 0.00 179.24 175.45 3dxk h ASP 57 N 0.00 0.00 0.32 6.45 2.03 -1.86 -1.68 116.42 121.67 3dxk h ASP 57 Ca -0.00 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.30 3dxk h ASP 57 Cb 0.43 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.93 3dxk h ASP 57 CO 0.03 0.09 -0.14 0.18 -1.03 0.00 0.00 179.24 178.37 3dxk n LEU 58 N -3.85 0.64 -4.34 0.15 4.77 -0.91 -4.63 117.00 108.83 3dxk n LEU 58 Ca -0.02 -0.08 -0.43 0.00 -0.03 0.00 0.00 56.01 55.45 3dxk n LEU 58 Cb 0.19 -0.16 0.00 0.00 -2.33 0.00 0.00 43.42 41.12 3dxk n LEU 58 CO 0.31 0.12 1.89 -0.67 -1.33 0.00 0.00 177.39 177.71 3dxk n ASP 59 N -0.84 4.89 -3.84 -1.43 4.64 -0.63 -4.92 116.55 114.42 3dxk n ASP 59 Ca 0.14 -2.95 -0.09 0.00 -1.38 0.00 0.00 54.79 50.52 3dxk n ASP 59 Cb 0.30 -1.65 -0.03 0.00 -1.04 0.00 0.00 41.12 38.69 3dxk n ASP 59 CO 0.00 0.00 0.00 0.72 -0.82 0.00 0.00 177.20 177.10 3dxk s PHE 60 N 2.77 0.17 0.06 -0.67 -0.12 -1.26 -4.31 117.98 114.61 3dxk s PHE 60 Ca 0.48 -0.58 0.00 0.00 -0.05 0.00 0.00 56.93 56.78 3dxk s PHE 60 Cb 0.04 0.41 -0.04 0.00 -0.63 0.00 0.00 43.02 42.81 3dxk s PHE 60 CO 0.02 -1.13 -0.05 -0.06 -0.05 0.00 0.00 175.22 173.96 3dxk s PHE 61 N -3.83 0.60 0.18 3.49 0.08 -0.89 -4.97 117.98 112.65 3dxk s PHE 61 Ca 0.18 -0.87 0.04 0.00 0.12 0.00 0.00 56.93 56.39 3dxk s PHE 61 Cb -0.03 -0.39 -0.05 0.00 -0.57 0.00 0.00 43.02 41.98 3dxk s PHE 61 CO 0.09 -0.25 -0.04 0.96 -0.10 0.00 0.00 175.22 175.88 3dxk s ILE 62 N -3.14 1.01 0.00 0.64 -4.36 -1.26 -0.47 121.20 113.62 3dxk s ILE 62 Ca 0.03 -2.03 0.00 0.00 -0.26 0.00 0.00 60.65 58.38 3dxk s ILE 62 Cb 0.02 -2.08 0.00 0.00 1.25 0.00 0.00 42.46 41.65 3dxk s ILE 62 CO -0.06 -0.54 0.00 0.61 0.24 0.00 0.00 174.94 175.19 3dxk n GLY 63 N -0.29 0.58 0.22 6.27 0.00 -0.52 -3.57 105.19 107.89 3dxk n GLY 63 Ca -0.08 -0.77 -0.02 0.00 0.00 0.00 0.00 46.02 45.15 3dxk n GLY 63 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3dxk h ASP 64 N 8.04 -0.52 0.00 1.61 3.32 -1.91 0.17 116.42 127.14 3dxk h ASP 64 Ca 0.00 0.17 0.00 0.00 0.02 0.00 0.00 57.03 57.22 3dxk h ASP 64 Cb 0.00 0.35 0.00 0.00 0.22 0.00 0.00 39.33 39.90 3dxk h ASP 64 CO 0.00 -0.18 0.39 -0.33 -1.72 0.00 0.00 179.24 177.39 3dxk h GLU 65 N -0.00 0.00 0.00 3.56 5.08 -1.96 -0.70 114.58 120.56 3dxk h GLU 65 Ca 0.27 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.63 3dxk h GLU 65 Cb 0.41 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.66 3dxk h GLU 65 CO -0.57 0.00 -0.99 0.00 -1.00 0.00 0.00 179.01 176.45 3dxk n ALA 66 N -1.78 4.36 0.10 3.43 0.00 0.60 -4.28 120.51 122.94 3dxk n ALA 66 Ca -0.02 -0.54 -0.05 0.00 0.00 0.00 0.00 53.44 52.84 3dxk n ALA 66 Cb 0.42 -0.84 0.11 0.00 0.00 0.00 0.00 19.45 19.14 3dxk n ALA 66 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 3dxk h ILE 67 N 0.00 1.43 -0.01 0.00 2.04 -1.07 -3.37 117.51 116.53 3dxk h ILE 67 Ca 0.00 -2.18 0.00 0.00 1.00 0.00 0.00 64.86 63.68 3dxk h ILE 67 Cb 0.55 2.15 0.00 0.00 -0.74 0.00 0.00 36.82 38.78 3dxk h ILE 67 CO 0.00 0.63 0.00 -1.84 0.00 0.00 0.00 178.15 176.94 3dxk n GLU 68 N -3.80 -0.37 -1.42 2.37 -0.00 -1.26 -4.96 120.64 111.20 3dxk n GLU 68 Ca -0.02 -0.69 -0.52 0.00 -0.00 0.00 0.00 57.16 55.92 3dxk n GLU 68 Cb 0.66 -1.02 -0.08 0.00 -0.00 0.00 0.00 31.44 31.00 3dxk n GLU 68 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 3dxk n LYS 69 N 0.02 0.91 0.00 3.44 4.76 -1.26 -4.87 118.16 121.16 3dxk n LYS 69 Ca 0.01 0.25 0.00 0.00 -2.87 0.00 0.00 58.31 55.70 3dxk n LYS 69 Cb 0.06 -2.30 0.00 0.00 -1.84 0.00 0.00 35.03 30.95 3dxk n LYS 69 CO 0.00 0.00 0.00 -2.30 -1.37 0.00 0.00 177.40 173.73 3dxk n PRO 70 N 8.03 0.00 -0.02 1.97 -0.02 -1.26 -1.16 135.00 142.54 3dxk n PRO 70 Ca 0.43 0.77 0.00 0.00 -2.02 0.00 0.00 63.50 62.68 3dxk n PRO 70 Cb 0.19 -1.20 0.01 0.00 -0.02 0.00 0.00 33.50 32.48 3dxk n PRO 70 CO 0.00 0.00 0.00 -2.37 1.98 0.00 0.00 175.50 175.11 3dxk n THR 71 N -2.46 0.07 -5.01 3.45 5.66 -1.26 -4.84 114.28 109.88 3dxk n THR 71 Ca 0.00 -0.04 -0.31 0.00 -3.05 0.00 0.00 64.05 60.65 3dxk n THR 71 Cb 0.00 -0.31 -0.15 0.00 -1.55 0.00 0.00 70.33 68.32 3dxk n THR 71 CO 0.00 0.00 0.00 -0.31 -3.05 0.00 0.00 175.07 171.71 3dxk s TYR 72 N -1.38 2.37 -0.20 1.09 1.51 -0.31 -4.72 117.35 115.71 3dxk s TYR 72 Ca 0.02 -0.39 -0.13 0.00 -1.01 0.00 0.00 57.07 55.56 3dxk s TYR 72 Cb 0.01 -1.45 -0.05 0.00 -0.11 0.00 0.00 41.96 40.37 3dxk s TYR 72 CO 0.01 0.09 0.25 0.00 -1.11 0.00 0.00 175.55 174.79 3dxk s ALA 73 N -0.75 3.60 -0.21 3.71 0.00 0.10 -4.72 121.76 123.50 3dxk s ALA 73 Ca 0.11 -0.65 -0.24 0.00 0.00 0.00 0.00 51.96 51.19 3dxk s ALA 73 Cb -0.10 -2.40 -0.01 0.00 0.00 0.00 0.00 23.12 20.61 3dxk s ALA 73 CO 0.01 -0.09 0.77 0.99 0.00 0.00 0.00 175.76 177.44 3dxk s THR 74 N 0.86 4.91 0.21 0.00 2.01 -1.26 -1.35 115.64 121.01 3dxk s THR 74 Ca 0.13 1.47 0.09 0.00 0.31 0.00 0.00 61.69 63.69 3dxk s THR 74 Cb -0.13 -4.07 -0.04 0.00 0.01 0.00 0.00 72.50 68.26 3dxk s THR 74 CO 0.04 0.01 -0.05 -0.54 -0.69 0.00 0.00 174.62 173.39 3dxk s LYS 75 N 2.35 2.18 -0.36 4.92 -0.14 0.43 -4.96 119.74 124.16 3dxk s LYS 75 Ca 0.34 -1.31 0.02 0.00 -1.36 0.00 0.00 55.97 53.66 3dxk s LYS 75 Cb -0.16 -2.18 0.11 0.00 -1.68 0.00 0.00 37.83 33.92 3dxk s LYS 75 CO 0.10 0.41 0.12 -1.58 -0.76 0.00 0.00 175.35 173.64 3dxk s TRP 76 N -1.94 2.58 0.51 3.18 0.52 -1.26 -1.59 118.94 120.94 3dxk s TRP 76 Ca 0.28 -2.40 0.21 0.00 0.02 0.00 0.00 56.10 54.21 3dxk s TRP 76 Cb -0.08 -2.25 1.30 0.00 -1.15 0.00 0.00 33.47 31.29 3dxk s TRP 76 CO 0.17 -0.88 2.03 -1.35 0.02 0.00 0.00 176.95 176.94 3dxk h PRO 77 N 7.58 0.07 -4.97 4.98 0.11 -1.92 -3.41 132.00 134.44 3dxk h PRO 77 Ca -0.08 -0.00 -0.66 0.00 0.11 0.00 0.00 66.00 65.36 3dxk h PRO 77 Cb 0.99 -0.02 -0.30 0.00 0.11 0.00 0.00 31.00 31.79 3dxk h PRO 77 CO 0.51 0.04 -0.74 0.42 -0.21 0.00 0.00 178.00 178.02 3dxk s ILE 78 N -5.09 3.07 -0.03 4.15 1.01 -1.26 -0.74 121.20 122.31 3dxk s ILE 78 Ca -0.05 -0.70 0.06 0.00 0.00 0.00 0.00 60.65 59.96 3dxk s ILE 78 Cb 0.19 -2.44 -0.02 0.00 0.01 0.00 0.00 42.46 40.20 3dxk s ILE 78 CO 0.72 0.37 -0.21 -0.13 0.00 0.00 0.00 174.94 175.69 3dxk s ARG 79 N 1.41 2.24 -1.27 2.79 1.81 -0.93 -4.62 118.95 120.38 3dxk s ARG 79 Ca 0.04 -0.85 -0.09 0.00 -1.72 0.00 0.00 55.73 53.11 3dxk s ARG 79 Cb -0.15 -2.17 0.07 0.00 -0.45 0.00 0.00 34.95 32.25 3dxk s ARG 79 CO -0.05 0.58 0.47 0.72 -0.68 0.00 0.00 175.30 176.35 3dxk n HIS 80 N 2.32 -1.77 -0.90 -0.53 8.25 -1.26 -0.91 115.22 120.42 3dxk n HIS 80 Ca -0.16 0.46 0.00 0.00 -0.26 0.00 0.00 57.72 57.75 3dxk n HIS 80 Cb 0.52 -2.88 0.00 0.00 1.12 0.00 0.00 29.99 28.74 3dxk n HIS 80 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3dxk n GLY 81 N -1.15 0.74 3.25 -1.41 0.00 -1.26 -5.01 105.19 100.34 3dxk n GLY 81 Ca -0.01 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.70 3dxk n GLY 81 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3dxk s ILE 82 N -3.16 1.92 0.03 -0.61 1.10 -0.09 -4.52 121.20 115.87 3dxk s ILE 82 Ca 0.00 -1.00 -0.30 0.00 -0.51 0.00 0.00 60.65 58.84 3dxk s ILE 82 Cb 0.00 -1.62 -0.08 0.00 0.15 0.00 0.00 42.46 40.90 3dxk s ILE 82 CO 0.00 0.54 1.85 -0.69 -2.11 0.00 0.00 174.94 174.52 3dxk s VAL 83 N -0.21 3.08 -1.55 4.00 1.01 -1.26 -2.20 120.40 123.28 3dxk s VAL 83 Ca -0.01 0.23 0.14 0.00 0.00 0.00 0.00 61.98 62.33 3dxk s VAL 83 Cb -0.13 -3.15 0.07 0.00 0.00 0.00 0.00 36.38 33.18 3dxk s VAL 83 CO 0.03 -0.02 0.87 -0.62 0.00 0.00 0.00 175.10 175.36 3dxk n GLU 84 N 6.99 1.25 -3.31 2.72 -0.58 0.08 -4.83 120.64 122.96 3dxk n GLU 84 Ca 0.19 -1.11 -0.11 0.00 -0.42 0.00 0.00 57.16 55.70 3dxk n GLU 84 Cb 0.41 -1.24 -0.06 0.00 -0.57 0.00 0.00 31.44 29.99 3dxk n GLU 84 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 3dxk s ASP 85 N -1.32 0.33 0.44 1.62 -1.08 -1.21 -5.02 116.67 110.44 3dxk s ASP 85 Ca 0.14 -1.17 0.18 0.00 -0.52 0.00 0.00 52.55 51.19 3dxk s ASP 85 Cb 0.11 1.02 1.04 0.00 -1.46 0.00 0.00 42.92 43.63 3dxk s ASP 85 CO 0.23 -0.25 1.95 -0.50 0.52 0.00 0.00 175.17 177.11 3dxk h TRP 86 N 7.23 0.00 -0.04 -5.34 4.06 -1.91 -0.17 115.95 119.79 3dxk h TRP 86 Ca 0.03 0.00 -0.00 0.00 2.06 0.00 0.00 58.89 60.97 3dxk h TRP 86 Cb 1.10 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 29.26 3dxk h TRP 86 CO 0.27 0.23 0.02 -0.44 -3.56 0.00 0.00 178.44 174.96 3dxk h ASP 87 N 0.00 0.05 -0.12 -3.49 3.45 -1.99 -0.01 116.42 114.31 3dxk h ASP 87 Ca -0.00 -0.15 -0.11 0.00 0.43 0.00 0.00 57.03 57.19 3dxk h ASP 87 Cb 0.47 -0.01 -0.01 0.00 -0.56 0.00 0.00 39.33 39.21 3dxk h ASP 87 CO 0.03 0.19 -0.29 -0.07 -1.57 0.00 0.00 179.24 177.53 3dxk h LEU 88 N -0.09 0.60 -0.47 1.55 4.07 -1.89 -2.78 115.31 116.30 3dxk h LEU 88 Ca 0.01 -0.23 -0.06 0.00 0.08 0.00 0.00 57.88 57.69 3dxk h LEU 88 Cb 0.15 -0.17 -0.02 0.00 1.08 0.00 0.00 40.66 41.71 3dxk h LEU 88 CO -0.00 0.86 0.05 -0.03 -1.08 0.00 0.00 178.44 178.24 3dxk h MET 89 N 0.51 0.79 -0.55 1.13 4.05 -0.82 -1.55 114.93 118.48 3dxk h MET 89 Ca 0.06 -0.23 0.00 0.00 -0.28 0.00 0.00 59.70 59.26 3dxk h MET 89 Cb 0.76 -0.08 -0.03 0.00 -0.80 0.00 0.00 31.60 31.44 3dxk h MET 89 CO 0.06 0.82 0.35 1.49 0.23 0.00 0.00 176.91 179.86 3dxk h GLU 90 N 0.66 0.74 -0.05 0.39 4.81 -0.89 -2.05 114.58 118.18 3dxk h GLU 90 Ca 0.14 -0.05 -0.22 0.00 -0.13 0.00 0.00 59.36 59.10 3dxk h GLU 90 Cb 0.43 -0.16 0.02 0.00 0.63 0.00 0.00 28.75 29.67 3dxk h GLU 90 CO 0.01 0.50 -0.83 0.00 -0.73 0.00 0.00 179.01 177.97 3dxk h ARG 91 N 0.76 0.66 -0.85 1.92 3.08 -1.30 -2.98 114.38 115.66 3dxk h ARG 91 Ca 0.20 -0.63 0.14 0.00 0.07 0.00 0.00 59.98 59.76 3dxk h ARG 91 Cb -0.06 0.16 -0.09 0.00 0.08 0.00 0.00 29.97 30.06 3dxk h ARG 91 CO -0.04 1.24 0.45 0.35 -1.07 0.00 0.00 179.97 180.89 3dxk h PHE 92 N 0.31 0.79 -0.32 3.04 3.57 -0.80 0.89 116.94 124.43 3dxk h PHE 92 Ca -0.09 0.03 -0.08 0.00 3.53 0.00 0.00 57.97 61.37 3dxk h PHE 92 Cb 1.48 -0.22 -0.02 0.00 2.79 0.00 0.00 35.95 39.99 3dxk h PHE 92 CO 0.11 0.21 -0.14 0.52 -2.23 0.00 0.00 178.31 176.78 3dxk h MET 93 N 0.65 0.55 -0.68 1.11 2.86 -1.36 -2.58 114.93 115.48 3dxk h MET 93 Ca 0.46 -0.17 0.13 0.00 -2.06 0.00 0.00 59.70 58.05 3dxk h MET 93 Cb 0.62 -0.05 -0.09 0.00 0.06 0.00 0.00 31.60 32.14 3dxk h MET 93 CO -0.35 0.68 0.23 0.93 1.06 0.00 0.00 176.91 179.46 3dxk h GLU 94 N 0.50 0.36 0.01 1.72 5.08 -0.66 0.32 114.58 121.91 3dxk h GLU 94 Ca 0.09 -0.02 -0.21 0.00 -1.00 0.00 0.00 59.36 58.21 3dxk h GLU 94 Cb 0.54 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.68 3dxk h GLU 94 CO 0.03 0.24 -1.01 1.96 -1.00 0.00 0.00 179.01 179.23 3dxk h GLN 95 N 0.37 0.02 -0.49 2.33 4.20 -1.40 -0.14 115.11 120.00 3dxk h GLN 95 Ca 0.37 -0.04 0.01 0.00 0.06 0.00 0.00 58.65 59.05 3dxk h GLN 95 Cb 0.54 0.01 -0.03 0.00 0.30 0.00 0.00 27.48 28.31 3dxk h GLN 95 CO -0.40 1.01 0.31 0.28 -0.67 0.00 0.00 178.83 179.37 3dxk h VAL 96 N 0.01 1.10 0.06 -0.54 2.07 -0.89 0.27 116.25 118.33 3dxk h VAL 96 Ca -0.02 -0.22 -0.00 0.00 0.82 0.00 0.00 66.70 67.28 3dxk h VAL 96 Cb 1.77 0.41 0.00 0.00 -1.52 0.00 0.00 31.29 31.95 3dxk h VAL 96 CO 0.13 0.12 -0.03 0.40 0.02 0.00 0.00 177.57 178.21 3dxk h ILE 97 N 0.64 1.20 0.00 4.57 2.04 -0.99 0.26 117.51 125.24 3dxk h ILE 97 Ca 0.18 -1.55 -0.00 0.00 1.00 0.00 0.00 64.86 64.49 3dxk h ILE 97 Cb -0.05 2.13 -0.00 0.00 -0.74 0.00 0.00 36.82 38.16 3dxk h ILE 97 CO -0.05 0.35 -0.92 -0.26 0.00 0.00 0.00 178.15 177.27 3dxk h PHE 98 N -0.85 0.00 0.00 1.37 0.04 -1.03 0.40 116.94 116.87 3dxk h PHE 98 Ca -0.01 0.00 -0.33 0.00 2.80 0.00 0.00 57.97 60.44 3dxk h PHE 98 Cb 0.64 0.00 -0.06 0.00 2.20 0.00 0.00 35.95 38.73 3dxk h PHE 98 CO 0.15 0.01 -2.19 1.17 -0.60 0.00 0.00 178.31 176.86 3dxk n LYS 99 N -2.72 0.50 -0.04 1.51 4.81 0.82 -4.46 118.16 118.57 3dxk n LYS 99 Ca 0.00 0.14 -0.04 0.00 -0.87 0.00 0.00 58.31 57.55 3dxk n LYS 99 Cb 0.56 -1.37 -0.01 0.00 0.02 0.00 0.00 35.03 34.22 3dxk n LYS 99 CO 0.00 0.00 0.00 0.66 1.17 0.00 0.00 177.40 179.23 3dxk n TYR 100 N -3.37 0.33 -0.17 5.64 4.01 -0.47 -4.51 117.16 118.62 3dxk n TYR 100 Ca -0.38 0.14 0.01 0.00 -0.16 0.00 0.00 57.90 57.51 3dxk n TYR 100 Cb 0.86 -0.45 0.26 0.00 -0.31 0.00 0.00 39.34 39.71 3dxk n TYR 100 CO 0.00 0.00 0.00 -0.07 -0.46 0.00 0.00 176.86 176.33 3dxk h LEU 101 N -0.57 0.79 -1.55 7.72 3.38 -1.08 -3.46 115.31 120.54 3dxk h LEU 101 Ca 0.00 -0.04 -0.37 0.00 0.09 0.00 0.00 57.88 57.56 3dxk h LEU 101 Cb 0.40 -0.20 0.12 0.00 0.09 0.00 0.00 40.66 41.07 3dxk h LEU 101 CO 0.00 0.60 -0.77 0.54 0.09 0.00 0.00 178.44 178.90 3dxk n ARG 102 N -4.41 -6.26 -4.56 1.13 1.74 0.03 -4.99 116.66 99.34 3dxk n ARG 102 Ca 0.07 0.77 -0.34 0.00 -0.77 0.00 0.00 57.85 57.58 3dxk n ARG 102 Cb 0.06 -5.66 -0.12 0.00 -1.02 0.00 0.00 32.46 25.72 3dxk n ARG 102 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3dxk s ALA 103 N -3.44 2.92 -0.56 7.54 0.00 -0.59 -5.01 121.76 122.61 3dxk s ALA 103 Ca 0.11 -0.86 -0.27 0.00 0.00 0.00 0.00 51.96 50.94 3dxk s ALA 103 Cb -0.05 -1.37 0.00 0.00 0.00 0.00 0.00 23.12 21.70 3dxk s ALA 103 CO 0.76 0.35 1.59 -2.00 0.00 0.00 0.00 175.76 176.45 3dxk s GLU 104 N -0.06 3.09 0.58 0.00 2.56 -1.26 -4.65 118.70 118.96 3dxk s GLU 104 Ca 0.00 0.56 0.33 0.00 0.00 0.00 0.00 54.97 55.87 3dxk s GLU 104 Cb -0.13 -4.22 1.37 0.00 2.00 0.00 0.00 34.13 33.15 3dxk s GLU 104 CO 0.03 -2.19 1.65 -1.00 -0.56 0.00 0.00 175.26 173.19 3dxk h PRO 105 N 12.39 0.00 0.00 4.30 0.13 -1.93 0.14 132.00 147.04 3dxk h PRO 105 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 3dxk h PRO 105 Cb 1.12 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.25 3dxk h PRO 105 CO 1.18 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 179.34 3dxk n GLU 106 N -3.72 0.15 0.00 0.86 1.02 -1.26 -3.49 120.64 114.20 3dxk n GLU 106 Ca 0.22 0.21 0.10 0.00 -0.02 0.00 0.00 57.16 57.68 3dxk n GLU 106 Cb 1.26 -1.70 -0.08 0.00 -0.02 0.00 0.00 31.44 30.90 3dxk n GLU 106 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 3dxk n ASP 107 N -1.96 1.00 -4.23 1.62 8.00 0.50 -4.34 116.55 117.15 3dxk n ASP 107 Ca 0.05 -0.95 -0.27 0.00 0.71 0.00 0.00 54.79 54.33 3dxk n ASP 107 Cb 0.33 0.91 -0.15 0.00 -0.02 0.00 0.00 41.12 42.18 3dxk n ASP 107 CO 0.00 0.00 0.00 -1.00 -0.39 0.00 0.00 177.20 175.81 3dxk s HIS 108 N -2.98 1.85 0.48 1.24 3.76 -1.23 -4.91 115.29 113.51 3dxk s HIS 108 Ca 0.09 -0.36 -0.19 0.00 -0.15 0.00 0.00 55.06 54.45 3dxk s HIS 108 Cb 0.16 -1.18 -0.09 0.00 1.11 0.00 0.00 32.58 32.59 3dxk s HIS 108 CO 0.84 -0.01 1.00 0.71 -0.85 0.00 0.00 174.74 176.43 3dxk s TYR 109 N -0.55 3.19 -0.02 1.40 1.51 -1.26 -4.29 117.35 117.34 3dxk s TYR 109 Ca 0.08 1.56 0.07 0.00 -1.01 0.00 0.00 57.07 57.77 3dxk s TYR 109 Cb -0.08 -2.93 -0.02 0.00 -0.11 0.00 0.00 41.96 38.82 3dxk s TYR 109 CO -0.00 -0.51 -0.22 -0.06 -1.11 0.00 0.00 175.55 173.64 3dxk s PHE 110 N -2.23 2.45 -0.22 2.71 0.08 -0.05 -1.41 117.98 119.31 3dxk s PHE 110 Ca 0.63 -0.35 0.01 0.00 0.12 0.00 0.00 56.93 57.35 3dxk s PHE 110 Cb -0.12 -1.52 0.03 0.00 -0.57 0.00 0.00 43.02 40.84 3dxk s PHE 110 CO 0.21 0.06 -0.15 -1.17 -0.10 0.00 0.00 175.22 174.08 3dxk s LEU 111 N -0.78 2.73 0.25 -0.37 0.20 0.19 -1.12 118.68 119.78 3dxk s LEU 111 Ca 0.11 -0.92 0.09 0.00 0.69 0.00 0.00 54.13 54.11 3dxk s LEU 111 Cb -0.10 -1.54 -0.04 0.00 -0.43 0.00 0.00 46.19 44.08 3dxk s LEU 111 CO 0.00 -0.08 0.01 -0.76 -0.29 0.00 0.00 176.35 175.23 3dxk s LEU 112 N 1.24 3.25 0.48 -0.68 1.43 -0.31 -1.37 118.68 122.73 3dxk s LEU 112 Ca -0.00 -0.58 0.06 0.00 -1.03 0.00 0.00 54.13 52.57 3dxk s LEU 112 Cb -0.16 -1.79 -0.01 0.00 0.03 0.00 0.00 46.19 44.27 3dxk s LEU 112 CO -0.09 0.01 0.27 0.42 0.23 0.00 0.00 176.35 177.19 3dxk s THR 113 N -2.22 1.89 -0.07 5.49 -4.23 -1.18 -1.17 115.64 114.16 3dxk s THR 113 Ca 0.31 -1.62 -0.31 0.00 -1.18 0.00 0.00 61.69 58.89 3dxk s THR 113 Cb -0.07 -2.51 0.07 0.00 1.34 0.00 0.00 72.50 71.33 3dxk s THR 113 CO 0.20 0.00 0.70 -1.83 -0.54 0.00 0.00 174.62 173.15 3dxk s GLU 114 N -4.08 1.02 0.78 3.99 -1.05 -0.54 -4.79 118.70 114.02 3dxk s GLU 114 Ca 0.34 0.30 -0.11 0.00 -0.15 0.00 0.00 54.97 55.34 3dxk s GLU 114 Cb 0.00 0.48 0.06 0.00 -0.44 0.00 0.00 34.13 34.23 3dxk s GLU 114 CO 0.20 -0.31 1.09 -1.25 0.95 0.00 0.00 175.26 175.94 3dxk s PRO 115 N -1.09 2.24 0.69 -4.83 0.04 -1.26 -1.83 135.00 128.95 3dxk s PRO 115 Ca -0.10 0.69 -0.12 0.00 0.04 0.00 0.00 61.00 61.51 3dxk s PRO 115 Cb -0.00 -1.93 0.01 0.00 0.04 0.00 0.00 34.50 32.61 3dxk s PRO 115 CO 0.09 -1.52 1.07 -2.14 0.04 0.00 0.00 177.00 174.54 3dxk s PRO 116 N -5.14 2.86 -0.16 0.56 0.02 -1.26 -3.18 135.00 128.70 3dxk s PRO 116 Ca 0.60 1.09 0.00 0.00 0.02 0.00 0.00 61.00 62.71 3dxk s PRO 116 Cb -0.14 -1.98 0.00 0.00 0.02 0.00 0.00 34.50 32.40 3dxk s PRO 116 CO 0.54 -1.17 0.00 1.28 -0.33 0.00 0.00 177.00 177.33 3dxk n LEU 117 N -2.92 -0.03 -4.81 -5.54 4.32 -1.26 -5.02 117.00 101.74 3dxk n LEU 117 Ca 0.08 0.04 -0.33 0.00 -0.02 0.00 0.00 56.01 55.78 3dxk n LEU 117 Cb 0.53 -0.82 -0.03 0.00 -1.62 0.00 0.00 43.42 41.48 3dxk n LEU 117 CO 0.53 -0.15 0.70 0.21 -1.22 0.00 0.00 177.39 177.46 3dxk s ASN 118 N -2.46 6.30 0.48 -1.43 2.47 -1.19 -5.03 114.94 114.07 3dxk s ASN 118 Ca 0.00 1.81 -0.04 0.00 0.42 0.00 0.00 52.86 55.05 3dxk s ASN 118 Cb 0.00 -2.54 -0.03 0.00 -1.45 0.00 0.00 41.25 37.23 3dxk s ASN 118 CO 0.00 -0.81 0.77 0.42 -3.72 0.00 0.00 177.10 173.76 3dxk s THR 119 N -2.23 4.76 0.31 -5.21 -4.23 -1.26 -4.97 115.64 102.80 3dxk s THR 119 Ca 0.64 0.08 0.03 0.00 -1.18 0.00 0.00 61.69 61.26 3dxk s THR 119 Cb -0.14 -3.81 0.13 0.00 1.34 0.00 0.00 72.50 70.02 3dxk s THR 119 CO 0.25 -0.76 1.82 -0.65 -0.54 0.00 0.00 174.62 174.75 3dxk h PRO 120 N 0.24 0.55 -0.61 3.99 0.11 -1.96 -2.75 132.00 131.57 3dxk h PRO 120 Ca -0.47 -0.14 0.07 0.00 0.11 0.00 0.00 66.00 65.56 3dxk h PRO 120 Cb 1.21 -0.07 -0.06 0.00 0.11 0.00 0.00 31.00 32.20 3dxk h PRO 120 CO 0.61 0.62 0.30 0.93 -0.21 0.00 0.00 178.00 180.25 3dxk h GLU 121 N 0.51 0.53 -0.59 1.05 3.07 -1.99 -1.71 114.58 115.47 3dxk h GLU 121 Ca 0.10 -0.03 -0.06 0.00 -0.50 0.00 0.00 59.36 58.87 3dxk h GLU 121 Cb 0.44 -0.12 -0.03 0.00 -0.84 0.00 0.00 28.75 28.20 3dxk h GLU 121 CO 0.02 0.35 0.11 -0.91 -1.40 0.00 0.00 179.01 177.19 3dxk h ASN 122 N 0.55 0.88 -0.84 1.42 -0.26 -1.89 -1.67 115.58 113.78 3dxk h ASN 122 Ca 0.28 -0.18 -0.04 0.00 -0.56 0.00 0.00 56.30 55.80 3dxk h ASN 122 Cb 0.24 -0.23 -0.04 0.00 -1.06 0.00 0.00 38.32 37.23 3dxk h ASN 122 CO -0.21 0.88 0.39 0.03 -1.06 0.00 0.00 177.43 177.45 3dxk h ARG 123 N 0.89 1.23 -0.89 0.81 3.08 -1.20 -0.68 114.38 117.61 3dxk h ARG 123 Ca 0.19 -0.19 -0.01 0.00 0.07 0.00 0.00 59.98 60.03 3dxk h ARG 123 Cb 0.36 -0.21 -0.04 0.00 0.08 0.00 0.00 29.97 30.16 3dxk h ARG 123 CO 0.01 0.95 0.51 0.93 -1.07 0.00 0.00 179.97 181.30 3dxk h GLU 124 N 1.21 1.22 -0.70 0.04 5.08 -0.71 -0.55 114.58 120.17 3dxk h GLU 124 Ca 0.29 -0.12 -0.06 0.00 -1.00 0.00 0.00 59.36 58.46 3dxk h GLU 124 Cb 0.15 -0.25 -0.03 0.00 0.50 0.00 0.00 28.75 29.12 3dxk h GLU 124 CO -0.03 0.87 0.19 1.88 -1.00 0.00 0.00 179.01 180.91 3dxk h TYR 125 N 1.23 1.14 -0.21 4.33 0.99 -0.41 0.13 116.97 124.17 3dxk h TYR 125 Ca 0.32 -0.12 -0.03 0.00 2.00 0.00 0.00 58.73 60.90 3dxk h TYR 125 Cb -0.02 -0.33 -0.01 0.00 1.00 0.00 0.00 36.73 37.38 3dxk h TYR 125 CO 0.01 0.92 0.03 1.15 -0.00 0.00 0.00 178.16 180.27 3dxk h THR 126 N 1.04 1.23 -0.54 -2.88 2.02 -0.64 -2.51 112.91 110.63 3dxk h THR 126 Ca 0.22 -0.75 -0.04 0.00 0.77 0.00 0.00 66.41 66.61 3dxk h THR 126 Cb 0.34 1.31 -0.03 0.00 -1.74 0.00 0.00 68.15 68.03 3dxk h THR 126 CO -0.00 0.23 0.17 0.00 0.37 0.00 0.00 175.52 176.29 3dxk h ALA 127 N 0.84 1.28 -0.56 6.16 0.00 -0.88 -1.21 119.26 124.88 3dxk h ALA 127 Ca 0.06 -0.18 0.03 0.00 0.00 0.00 0.00 54.91 54.82 3dxk h ALA 127 Cb 0.32 -0.22 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 3dxk h ALA 127 CO 0.00 0.52 0.34 1.49 0.00 0.00 0.00 179.25 181.60 3dxk h GLU 128 N 0.79 0.65 -0.54 0.00 4.81 -0.72 0.95 114.58 120.53 3dxk h GLU 128 Ca 0.18 -0.04 -0.11 0.00 -0.13 0.00 0.00 59.36 59.26 3dxk h GLU 128 Cb 0.23 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.44 3dxk h GLU 128 CO -0.01 0.43 -0.11 0.82 -0.73 0.00 0.00 179.01 179.41 3dxk h ILE 129 N 0.67 1.27 0.00 2.32 2.04 -0.95 0.39 117.51 123.25 3dxk h ILE 129 Ca 0.23 -1.27 -0.14 0.00 1.00 0.00 0.00 64.86 64.68 3dxk h ILE 129 Cb 0.03 0.97 -0.02 0.00 -0.74 0.00 0.00 36.82 37.06 3dxk h ILE 129 CO -0.10 0.45 -0.66 0.24 0.00 0.00 0.00 178.15 178.08 3dxk h MET 130 N 0.91 0.00 0.01 2.37 2.86 -0.74 -2.76 114.93 117.57 3dxk h MET 130 Ca 0.14 0.00 -0.41 0.00 -2.06 0.00 0.00 59.70 57.37 3dxk h MET 130 Cb 0.68 0.00 -0.06 0.00 0.06 0.00 0.00 31.60 32.28 3dxk h MET 130 CO 0.05 0.66 -2.41 1.19 1.06 0.00 0.00 176.91 177.46 3dxk n PHE 131 N -3.35 0.15 0.12 -0.22 3.72 0.28 -1.20 117.46 116.96 3dxk n PHE 131 Ca 0.01 0.04 -0.02 0.00 -0.05 0.00 0.00 57.45 57.43 3dxk n PHE 131 Cb 0.77 -1.02 0.07 0.00 -0.94 0.00 0.00 39.48 38.35 3dxk n PHE 131 CO 0.00 0.00 0.00 0.93 -0.05 0.00 0.00 176.76 177.64 3dxk h GLU 132 N -0.37 0.00 0.00 -1.08 4.39 -1.07 -3.08 114.58 113.37 3dxk h GLU 132 Ca -0.60 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.10 3dxk h GLU 132 Cb 1.79 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.44 3dxk h GLU 132 CO -0.19 0.70 -0.11 0.43 -1.16 0.00 0.00 179.01 178.67 3dxk n SER 133 N -3.50 0.27 -0.32 1.42 7.64 -1.05 -4.69 113.62 113.39 3dxk n SER 133 Ca -0.00 0.14 0.14 0.00 1.01 0.00 0.00 58.87 60.16 3dxk n SER 133 Cb 0.74 -0.54 0.63 0.00 -1.01 0.00 0.00 64.21 64.03 3dxk n SER 133 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 3dxk n PHE 134 N -2.70 0.03 -4.03 1.43 3.72 -1.18 -4.97 117.46 109.76 3dxk n PHE 134 Ca -0.02 -0.01 -0.27 0.00 -0.05 0.00 0.00 57.45 57.10 3dxk n PHE 134 Cb 0.06 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.56 3dxk n PHE 134 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 3dxk n ASN 135 N -0.20 -0.19 -4.77 4.37 3.02 -1.02 -4.09 115.26 112.37 3dxk n ASN 135 Ca 0.20 -1.05 -0.38 0.00 -0.03 0.00 0.00 54.58 53.31 3dxk n ASN 135 Cb 0.26 -2.79 -0.01 0.00 -0.61 0.00 0.00 39.78 36.63 3dxk n ASN 135 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 3dxk s VAL 136 N -4.01 2.89 0.20 2.41 -7.23 -0.34 -4.30 120.40 110.01 3dxk s VAL 136 Ca 0.03 0.74 0.22 0.00 -1.81 0.00 0.00 61.98 61.16 3dxk s VAL 136 Cb -0.02 -3.41 0.20 0.00 0.56 0.00 0.00 36.38 33.71 3dxk s VAL 136 CO 0.91 0.06 1.83 1.55 -0.31 0.00 0.00 175.10 179.14 3dxk h PRO 137 N 2.46 0.00 -1.78 4.82 0.13 -1.75 -3.40 132.00 132.49 3dxk h PRO 137 Ca -0.49 0.00 0.01 0.00 -0.87 0.00 0.00 66.00 64.65 3dxk h PRO 137 Cb 1.25 0.00 -0.22 0.00 0.13 0.00 0.00 31.00 32.15 3dxk h PRO 137 CO 0.62 0.27 0.34 0.20 -0.23 0.00 0.00 178.00 179.20 3dxk s GLY 138 N -4.30 -0.38 -0.02 1.56 0.00 -1.26 -1.44 107.32 101.49 3dxk s GLY 138 Ca -0.00 2.01 -0.01 0.00 0.00 0.00 0.00 44.72 46.72 3dxk s GLY 138 CO 0.65 1.37 0.04 -2.27 0.00 0.00 0.00 173.10 172.88 3dxk s LEU 139 N -0.48 1.40 -0.07 0.66 2.96 -0.66 -0.87 118.68 121.62 3dxk s LEU 139 Ca -0.03 0.06 0.04 0.00 -0.22 0.00 0.00 54.13 53.99 3dxk s LEU 139 Cb -0.02 0.03 -0.00 0.00 0.50 0.00 0.00 46.19 46.69 3dxk s LEU 139 CO 0.02 -0.08 -0.20 -0.47 -1.32 0.00 0.00 176.35 174.30 3dxk s TYR 140 N 0.63 2.08 -0.33 5.38 5.04 -0.27 -2.87 117.35 127.02 3dxk s TYR 140 Ca -0.05 -0.73 -0.04 0.00 -2.44 0.00 0.00 57.07 53.82 3dxk s TYR 140 Cb -0.07 -1.41 0.05 0.00 0.35 0.00 0.00 41.96 40.88 3dxk s TYR 140 CO -0.02 -0.28 0.06 0.42 -1.34 0.00 0.00 175.55 174.39 3dxk s ILE 141 N 0.21 3.31 0.15 3.14 1.01 -1.26 -1.16 121.20 126.61 3dxk s ILE 141 Ca -0.11 -1.36 -0.01 0.00 0.00 0.00 0.00 60.65 59.17 3dxk s ILE 141 Cb -0.15 -2.93 -0.04 0.00 0.01 0.00 0.00 42.46 39.35 3dxk s ILE 141 CO 0.05 -0.19 0.34 0.00 0.00 0.00 0.00 174.94 175.14 3dxk s ALA 142 N 1.30 3.87 -0.19 9.38 0.00 -0.32 -4.70 121.76 131.10 3dxk s ALA 142 Ca -0.03 -0.78 -0.20 0.00 0.00 0.00 0.00 51.96 50.95 3dxk s ALA 142 Cb -0.20 -1.98 -0.03 0.00 0.00 0.00 0.00 23.12 20.91 3dxk s ALA 142 CO 0.00 0.58 0.58 0.54 0.00 0.00 0.00 175.76 177.46 3dxk s VAL 143 N -1.74 5.06 0.19 0.00 0.11 -1.26 -1.47 120.40 121.29 3dxk s VAL 143 Ca 0.38 1.10 -0.25 0.00 -2.93 0.00 0.00 61.98 60.28 3dxk s VAL 143 Cb -0.12 -3.90 0.06 0.00 -1.53 0.00 0.00 36.38 30.89 3dxk s VAL 143 CO 0.28 0.15 1.55 1.56 -3.33 0.00 0.00 175.10 175.31 3dxk h GLN 144 N 7.40 -0.04 -0.82 1.54 4.20 -1.70 -1.88 115.11 123.81 3dxk h GLN 144 Ca -0.33 0.00 0.15 0.00 0.06 0.00 0.00 58.65 58.54 3dxk h GLN 144 Cb 1.15 0.01 -0.15 0.00 0.30 0.00 0.00 27.48 28.79 3dxk h GLN 144 CO 0.76 -0.03 -0.26 0.00 -0.67 0.00 0.00 178.83 178.63 3dxk h ALA 145 N 0.84 0.38 -0.41 3.87 0.00 -1.93 0.34 119.26 122.34 3dxk h ALA 145 Ca 0.23 0.29 -0.05 0.00 0.00 0.00 0.00 54.91 55.38 3dxk h ALA 145 Cb 0.51 0.73 -0.02 0.00 0.00 0.00 0.00 17.79 19.01 3dxk h ALA 145 CO -0.91 -0.49 0.04 0.28 0.00 0.00 0.00 179.25 178.17 3dxk h VAL 146 N -0.03 1.21 -0.43 0.00 2.07 -1.71 -2.25 116.25 115.11 3dxk h VAL 146 Ca 0.36 -0.80 -0.12 0.00 0.82 0.00 0.00 66.70 66.96 3dxk h VAL 146 Cb 0.60 0.85 -0.01 0.00 -1.52 0.00 0.00 31.29 31.20 3dxk h VAL 146 CO -0.85 0.28 -0.23 -0.07 0.02 0.00 0.00 177.57 176.72 3dxk h LEU 147 N 0.61 0.90 -0.42 2.57 3.38 -0.77 -2.17 115.31 119.42 3dxk h LEU 147 Ca 0.13 -0.34 0.02 0.00 0.09 0.00 0.00 57.88 57.79 3dxk h LEU 147 Cb 0.32 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.79 3dxk h LEU 147 CO 0.01 1.09 0.23 0.00 0.09 0.00 0.00 178.44 179.86 3dxk h ALA 148 N 0.98 0.53 0.05 1.53 0.00 -0.81 0.61 119.26 122.15 3dxk h ALA 148 Ca 0.10 0.00 0.02 0.00 0.00 0.00 0.00 54.91 55.03 3dxk h ALA 148 Cb 0.77 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.43 3dxk h ALA 148 CO 0.06 -0.10 -0.22 -0.07 0.00 0.00 0.00 179.25 178.92 3dxk h LEU 149 N 0.47 -0.63 -1.62 0.00 3.38 -1.19 -1.26 115.31 114.45 3dxk h LEU 149 Ca 0.17 0.08 0.13 0.00 0.09 0.00 0.00 57.88 58.35 3dxk h LEU 149 Cb 0.04 0.25 -0.04 0.00 0.09 0.00 0.00 40.66 41.00 3dxk h LEU 149 CO -0.09 -0.29 0.45 0.00 0.09 0.00 0.00 178.44 178.60 3dxk h ALA 150 N 0.46 2.09 -0.28 1.53 0.00 -0.79 -1.34 119.26 120.92 3dxk h ALA 150 Ca 0.05 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 3dxk h ALA 150 Cb 0.43 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 3dxk h ALA 150 CO -0.16 -0.26 0.07 0.00 0.00 0.00 0.00 179.25 178.90 3dxk h ALA 151 N 1.67 1.60 0.00 0.00 0.00 0.32 -2.39 119.26 120.46 3dxk h ALA 151 Ca 0.32 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 55.10 3dxk h ALA 151 Cb 0.72 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.38 3dxk h ALA 151 CO -0.09 0.31 -0.07 0.66 0.00 0.00 0.00 179.25 180.05 3dxk h SER 152 N 0.40 0.00 0.00 0.00 4.64 -1.00 -3.02 113.55 114.57 3dxk h SER 152 Ca 0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 3dxk h SER 152 Cb 0.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.25 3dxk h SER 152 CO -0.00 0.07 0.33 -0.50 -0.87 0.00 0.00 176.83 175.86 3dxk h TRP 153 N 0.00 0.00 0.00 4.77 6.55 -1.49 -1.36 115.95 124.42 3dxk h TRP 153 Ca -0.00 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.84 3dxk h TRP 153 Cb 0.58 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.88 3dxk h TRP 153 CO 0.00 0.00 0.00 -2.37 -1.05 0.00 0.00 178.44 175.02 3dxk n THR 154 N -2.24 0.00 -2.47 1.49 5.66 -1.14 -3.07 114.28 112.51 3dxk n THR 154 Ca -0.01 0.00 -0.03 0.00 -3.05 0.00 0.00 64.05 60.96 3dxk n THR 154 Cb 0.36 -0.25 0.07 0.00 -1.55 0.00 0.00 70.33 68.96 3dxk n THR 154 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 175.07 170.48 3dxk n SER 155 N -0.03 -1.20 0.00 1.09 3.41 -0.51 -4.91 113.62 111.48 3dxk n SER 155 Ca 0.00 -2.00 0.00 0.00 -0.26 0.00 0.00 58.87 56.61 3dxk n SER 155 Cb 0.08 0.52 0.00 0.00 -0.26 0.00 0.00 64.21 64.55 3dxk n SER 155 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3dxk n ARG 156 N -1.03 0.00 -1.67 4.33 1.74 -1.17 -5.10 116.66 113.75 3dxk n ARG 156 Ca -0.18 0.00 -0.55 0.00 -0.77 0.00 0.00 57.85 56.35 3dxk n ARG 156 Cb 0.79 0.00 -0.07 0.00 -1.02 0.00 0.00 32.46 32.16 3dxk n ARG 156 CO 0.00 0.00 0.00 -0.85 -1.52 0.00 0.00 177.63 175.26 3dxk n GLU 160 N 0.00 1.27 -3.52 5.56 -0.00 -1.26 -5.04 120.64 117.65 3dxk n GLU 160 Ca 0.00 0.46 -0.38 0.00 -0.00 0.00 0.00 57.16 57.25 3dxk n GLU 160 Cb 0.00 -2.15 -0.06 0.00 -0.00 0.00 0.00 31.44 29.23 3dxk n GLU 160 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.13 178.16 3dxk s ARG 161 N 2.64 4.00 0.05 3.44 0.52 -1.26 -5.08 118.95 123.25 3dxk s ARG 161 Ca 0.93 0.30 -0.02 0.00 -0.52 0.00 0.00 55.73 56.42 3dxk s ARG 161 Cb -0.99 -3.29 -0.03 0.00 0.52 0.00 0.00 34.95 31.15 3dxk s ARG 161 CO 0.58 0.53 -0.00 -0.08 0.02 0.00 0.00 175.30 176.35 3dxk s THR 162 N -0.51 0.20 -0.42 0.02 -1.32 -1.26 -5.04 115.64 107.32 3dxk s THR 162 Ca 0.22 -1.68 0.05 0.00 -1.21 0.00 0.00 61.69 59.06 3dxk s THR 162 Cb -0.15 -1.42 0.55 0.00 -1.51 0.00 0.00 72.50 69.97 3dxk s THR 162 CO 0.10 -0.93 1.72 0.18 -2.21 0.00 0.00 174.62 173.48 3dxk n LEU 163 N 0.19 5.84 -4.23 9.08 4.77 -1.26 -4.83 117.00 126.56 3dxk n LEU 163 Ca -0.15 -3.90 -0.31 0.00 -0.03 0.00 0.00 56.01 51.61 3dxk n LEU 163 Cb 0.61 -0.75 -0.17 0.00 -2.33 0.00 0.00 43.42 40.78 3dxk n LEU 163 CO 0.27 1.30 -0.56 -0.89 -1.33 0.00 0.00 177.39 176.19 3dxk s THR 164 N -3.68 2.00 -3.58 -5.08 2.01 -1.26 -0.91 115.64 105.14 3dxk s THR 164 Ca 0.54 -1.01 0.00 0.00 0.31 0.00 0.00 61.69 61.53 3dxk s THR 164 Cb 0.45 -1.72 0.00 0.00 0.01 0.00 0.00 72.50 71.25 3dxk s THR 164 CO 0.04 0.55 0.00 0.61 -0.69 0.00 0.00 174.62 175.13 3dxk n GLY 165 N 3.29 -2.19 3.31 4.40 0.00 0.28 -4.84 105.19 109.45 3dxk n GLY 165 Ca -0.18 -1.21 -0.33 0.00 0.00 0.00 0.00 46.02 44.29 3dxk n GLY 165 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3dxk s THR 166 N -2.21 2.83 -0.15 2.61 2.01 -0.92 0.17 115.64 119.98 3dxk s THR 166 Ca 0.00 -0.73 -0.06 0.00 0.31 0.00 0.00 61.69 61.21 3dxk s THR 166 Cb 0.00 -2.19 -0.04 0.00 0.01 0.00 0.00 72.50 70.28 3dxk s THR 166 CO 0.00 0.52 0.06 -0.69 -0.69 0.00 0.00 174.62 173.82 3dxk s VAL 167 N 0.57 4.81 -0.40 3.82 1.01 0.87 -1.07 120.40 130.01 3dxk s VAL 167 Ca -0.09 -0.04 -0.03 0.00 0.00 0.00 0.00 61.98 61.82 3dxk s VAL 167 Cb -0.16 -3.12 0.10 0.00 0.00 0.00 0.00 36.38 33.20 3dxk s VAL 167 CO 0.03 0.52 0.19 -0.63 0.00 0.00 0.00 175.10 175.21 3dxk s ILE 168 N -0.12 3.34 -0.28 2.22 1.01 -0.36 -0.48 121.20 126.53 3dxk s ILE 168 Ca 0.07 -1.93 -0.09 0.00 0.00 0.00 0.00 60.65 58.70 3dxk s ILE 168 Cb -0.12 -3.23 -0.03 0.00 0.01 0.00 0.00 42.46 39.09 3dxk s ILE 168 CO 0.01 -0.61 0.13 -0.62 0.00 0.00 0.00 174.94 173.85 3dxk s ASP 169 N 1.80 5.55 -0.31 3.58 2.15 -0.63 -1.36 116.67 127.44 3dxk s ASP 169 Ca 0.06 -0.22 0.00 0.00 0.43 0.00 0.00 52.55 52.82 3dxk s ASP 169 Cb -0.22 -2.01 0.10 0.00 -0.30 0.00 0.00 42.92 40.48 3dxk s ASP 169 CO -0.03 -0.08 0.09 -0.55 -0.17 0.00 0.00 175.17 174.42 3dxk s SER 170 N 1.67 4.17 0.00 -0.34 0.15 -0.16 -0.06 113.70 119.13 3dxk s SER 170 Ca 0.06 -1.73 0.00 0.00 0.70 0.00 0.00 55.95 54.98 3dxk s SER 170 Cb -0.16 -1.02 0.00 0.00 -1.71 0.00 0.00 66.02 63.13 3dxk s SER 170 CO 0.07 -0.41 0.00 0.61 1.20 0.00 0.00 173.24 174.71 3dxk n GLY 171 N 4.73 1.27 0.00 9.45 0.00 -1.24 -2.22 105.19 117.18 3dxk n GLY 171 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.01 3dxk n GLY 171 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3dxk n ASP 172 N 0.00 0.00 -0.10 1.61 -0.08 -1.26 -4.05 116.55 112.67 3dxk n ASP 172 Ca 0.00 0.00 -0.19 0.00 -1.51 0.00 0.00 54.79 53.09 3dxk n ASP 172 Cb 0.00 0.00 -0.09 0.00 2.34 0.00 0.00 41.12 43.37 3dxk n ASP 172 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 3dxk n GLY 173 N 0.04 -0.81 3.30 0.27 0.00 -1.26 -3.07 105.19 103.67 3dxk n GLY 173 Ca 0.00 0.02 -0.10 0.00 0.00 0.00 0.00 46.02 45.94 3dxk n GLY 173 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3dxk s VAL 174 N -2.38 0.08 -0.09 1.61 1.01 -1.26 -4.65 120.40 114.72 3dxk s VAL 174 Ca -0.28 -0.73 -0.01 0.00 0.00 0.00 0.00 61.98 60.96 3dxk s VAL 174 Cb 0.06 -1.24 -0.03 0.00 0.00 0.00 0.00 36.38 35.17 3dxk s VAL 174 CO 0.50 -0.37 -0.02 -0.89 0.00 0.00 0.00 175.10 174.32 3dxk s THR 175 N -3.82 4.10 0.00 3.92 2.01 -1.09 -3.67 115.64 117.08 3dxk s THR 175 Ca 0.04 -0.32 0.07 0.00 0.31 0.00 0.00 61.69 61.79 3dxk s THR 175 Cb 0.02 -2.72 -0.03 0.00 0.01 0.00 0.00 72.50 69.79 3dxk s THR 175 CO -0.11 0.59 -0.23 -1.00 -0.69 0.00 0.00 174.62 173.18 3dxk s HIS 176 N -0.68 2.44 -0.39 4.92 3.76 0.92 -1.05 115.29 125.21 3dxk s HIS 176 Ca 0.11 -0.35 -0.05 0.00 -0.15 0.00 0.00 55.06 54.61 3dxk s HIS 176 Cb -0.12 -1.49 0.08 0.00 1.11 0.00 0.00 32.58 32.17 3dxk s HIS 176 CO 0.02 0.10 0.19 0.08 -0.85 0.00 0.00 174.74 174.27 3dxk s VAL 177 N -0.74 3.65 -0.31 -0.90 1.01 -0.77 -1.61 120.40 120.72 3dxk s VAL 177 Ca 0.12 -1.62 -0.04 0.00 0.00 0.00 0.00 61.98 60.43 3dxk s VAL 177 Cb -0.10 -3.29 0.04 0.00 0.00 0.00 0.00 36.38 33.03 3dxk s VAL 177 CO 0.01 -0.49 0.04 -0.63 0.00 0.00 0.00 175.10 174.03 3dxk s ILE 178 N 1.29 3.35 0.17 2.22 1.01 0.37 -2.99 121.20 126.63 3dxk s ILE 178 Ca 0.03 -1.22 -0.27 0.00 0.00 0.00 0.00 60.65 59.19 3dxk s ILE 178 Cb -0.22 -2.89 -0.08 0.00 0.01 0.00 0.00 42.46 39.28 3dxk s ILE 178 CO -0.01 -0.11 0.85 -2.16 0.00 0.00 0.00 174.94 173.52 3dxk s PRO 179 N 1.33 4.67 -0.03 2.79 0.04 -1.26 -0.09 135.00 142.45 3dxk s PRO 179 Ca -0.03 1.29 0.02 0.00 0.04 0.00 0.00 61.00 62.32 3dxk s PRO 179 Cb -0.19 -3.29 0.00 0.00 0.04 0.00 0.00 34.50 31.06 3dxk s PRO 179 CO 0.00 0.49 -0.09 0.08 0.04 0.00 0.00 177.00 177.52 3dxk s VAL 180 N -0.95 0.83 -0.20 -0.36 1.01 0.13 -1.83 120.40 119.04 3dxk s VAL 180 Ca 0.39 -0.38 -0.00 0.00 0.00 0.00 0.00 61.98 61.99 3dxk s VAL 180 Cb -0.24 -0.75 0.05 0.00 0.00 0.00 0.00 36.38 35.44 3dxk s VAL 180 CO 0.28 0.26 -0.05 0.00 0.00 0.00 0.00 175.10 175.59 3dxk s ALA 181 N 0.27 1.66 -1.27 5.51 0.00 -0.49 -0.55 121.76 126.88 3dxk s ALA 181 Ca -0.05 -1.03 -0.00 0.00 0.00 0.00 0.00 51.96 50.88 3dxk s ALA 181 Cb -0.10 -1.25 0.00 0.00 0.00 0.00 0.00 23.12 21.78 3dxk s ALA 181 CO 0.01 -0.96 0.82 0.39 0.00 0.00 0.00 175.76 176.02 3dxk n GLU 182 N 4.80 -5.61 -0.87 0.00 1.02 -1.09 -1.81 120.64 117.08 3dxk n GLU 182 Ca -0.12 0.71 0.00 0.00 -0.02 0.00 0.00 57.16 57.73 3dxk n GLU 182 Cb 0.46 -5.46 0.00 0.00 -0.02 0.00 0.00 31.44 26.42 3dxk n GLU 182 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3dxk n GLY 183 N -1.40 0.74 3.08 0.62 0.00 -0.09 -4.99 105.19 103.16 3dxk n GLY 183 Ca -0.29 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.41 3dxk n GLY 183 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3dxk s TYR 184 N -3.23 2.68 0.26 1.61 2.02 -0.75 -4.87 117.35 115.07 3dxk s TYR 184 Ca 0.00 -1.65 -0.30 0.00 -0.37 0.00 0.00 57.07 54.74 3dxk s TYR 184 Cb 0.00 -1.82 -0.11 0.00 -0.40 0.00 0.00 41.96 39.63 3dxk s TYR 184 CO 0.00 -0.78 1.60 0.08 -1.57 0.00 0.00 175.55 174.88 3dxk s VAL 185 N 1.32 2.16 -1.28 0.71 1.01 -1.26 -1.40 120.40 121.66 3dxk s VAL 185 Ca 0.02 0.13 -0.12 0.00 0.00 0.00 0.00 61.98 62.01 3dxk s VAL 185 Cb -0.14 -3.08 0.15 0.00 0.00 0.00 0.00 36.38 33.30 3dxk s VAL 185 CO -0.11 0.02 1.75 -0.38 0.00 0.00 0.00 175.10 176.38 3dxk n ILE 186 N 2.67 4.20 -0.32 2.22 5.41 -0.76 -4.85 119.36 127.92 3dxk n ILE 186 Ca 0.10 -4.35 0.18 0.00 1.00 0.00 0.00 62.75 59.67 3dxk n ILE 186 Cb 0.37 -2.42 0.36 0.00 -0.71 0.00 0.00 39.64 37.24 3dxk n ILE 186 CO 0.00 0.00 0.00 1.23 0.00 0.00 0.00 176.55 177.78 3dxk h GLY 187 N 9.08 1.53 1.70 7.39 0.00 -1.91 0.18 103.07 121.05 3dxk h GLY 187 Ca 0.39 -0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.72 3dxk h GLY 187 CO 1.51 -0.51 0.00 -1.14 0.00 0.00 0.00 176.54 176.40 3dxk n SER 188 N -5.31 0.00 -0.39 0.19 3.41 -1.26 -2.79 113.62 107.47 3dxk n SER 188 Ca 0.26 0.28 0.04 0.00 -0.26 0.00 0.00 58.87 59.18 3dxk n SER 188 Cb 0.84 -0.35 0.09 0.00 -0.26 0.00 0.00 64.21 64.52 3dxk n SER 188 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3dxk s ILE 190 N -0.93 3.13 -0.07 0.00 1.01 -1.12 -4.77 121.20 118.44 3dxk s ILE 190 Ca 0.14 0.54 -0.08 0.00 0.00 0.00 0.00 60.65 61.26 3dxk s ILE 190 Cb 0.07 -3.08 0.02 0.00 0.01 0.00 0.00 42.46 39.49 3dxk s ILE 190 CO 0.10 -0.30 0.21 -0.54 0.00 0.00 0.00 174.94 174.41 3dxk s LYS 191 N -3.98 0.27 0.15 2.79 3.01 -1.16 -5.03 119.74 115.78 3dxk s LYS 191 Ca 0.68 0.25 0.06 0.00 -1.01 0.00 0.00 55.97 55.96 3dxk s LYS 191 Cb -0.22 0.13 -0.04 0.00 -1.01 0.00 0.00 37.83 36.69 3dxk s LYS 191 CO 0.40 -0.04 0.01 -1.01 0.51 0.00 0.00 175.35 175.23 3dxk s HIS 192 N -0.00 2.92 -0.11 3.18 3.76 -1.26 -1.85 115.29 121.92 3dxk s HIS 192 Ca -0.01 -0.09 0.01 0.00 -0.15 0.00 0.00 55.06 54.82 3dxk s HIS 192 Cb -0.02 -1.44 0.02 0.00 1.11 0.00 0.00 32.58 32.25 3dxk s HIS 192 CO 0.00 0.50 -0.13 0.42 -0.85 0.00 0.00 174.74 174.69 3dxk s ILE 193 N -1.59 1.36 -0.31 0.60 1.01 -0.21 -5.01 121.20 117.05 3dxk s ILE 193 Ca 0.27 -0.54 0.00 0.00 0.00 0.00 0.00 60.65 60.38 3dxk s ILE 193 Cb -0.10 -1.28 0.00 0.00 0.01 0.00 0.00 42.46 41.09 3dxk s ILE 193 CO 0.19 0.42 0.22 -2.65 0.00 0.00 0.00 174.94 173.12 3dxk n PRO 194 N 4.47 0.27 -4.63 2.79 -0.02 -1.26 -2.67 135.00 133.94 3dxk n PRO 194 Ca -0.17 0.00 -0.24 0.00 -2.02 0.00 0.00 63.50 61.06 3dxk n PRO 194 Cb 0.51 -1.30 -0.16 0.00 -0.02 0.00 0.00 33.50 32.53 3dxk n PRO 194 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 3dxk s ILE 195 N 0.20 1.17 0.25 4.25 1.09 -1.26 -4.97 121.20 121.94 3dxk s ILE 195 Ca 0.00 -0.54 -0.18 0.00 -1.10 0.00 0.00 60.65 58.84 3dxk s ILE 195 Cb 0.00 -1.04 0.06 0.00 -1.06 0.00 0.00 42.46 40.42 3dxk s ILE 195 CO 0.00 0.36 0.88 0.00 -0.10 0.00 0.00 174.94 176.07 3dxk n ALA 196 N 3.51 -2.18 -0.33 9.38 0.00 -1.26 -3.39 120.51 126.24 3dxk n ALA 196 Ca -0.21 -1.05 0.23 0.00 0.00 0.00 0.00 53.44 52.41 3dxk n ALA 196 Cb 0.53 0.70 0.43 0.00 0.00 0.00 0.00 19.45 21.10 3dxk n ALA 196 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 3dxk h GLY 197 N 1.85 1.75 0.94 0.00 0.00 -1.71 -1.09 103.07 104.80 3dxk h GLY 197 Ca -0.28 -0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.05 3dxk h GLY 197 CO 0.36 -0.64 -0.02 -0.09 0.00 0.00 0.00 176.54 176.15 3dxk h ARG 198 N 0.02 -0.05 -0.92 4.80 2.43 -1.87 -1.89 114.38 116.91 3dxk h ARG 198 Ca 0.72 0.00 0.04 0.00 -0.81 0.00 0.00 59.98 59.93 3dxk h ARG 198 Cb 1.71 0.01 -0.05 0.00 -0.42 0.00 0.00 29.97 31.21 3dxk h ARG 198 CO -0.84 0.03 0.60 -0.44 -1.51 0.00 0.00 179.97 177.81 3dxk h ASP 199 N -0.12 0.98 -0.62 -3.80 3.32 -1.51 -0.58 116.42 114.10 3dxk h ASP 199 Ca -0.01 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.04 3dxk h ASP 199 Cb 0.10 -0.22 -0.03 0.00 0.22 0.00 0.00 39.33 39.40 3dxk h ASP 199 CO 0.01 0.67 0.40 0.40 -1.72 0.00 0.00 179.24 179.00 3dxk h ILE 200 N 1.14 1.17 0.24 0.35 2.04 -1.09 -1.44 117.51 119.92 3dxk h ILE 200 Ca 0.37 -0.34 -0.01 0.00 1.00 0.00 0.00 64.86 65.87 3dxk h ILE 200 Cb 0.03 0.28 0.00 0.00 -0.74 0.00 0.00 36.82 36.39 3dxk h ILE 200 CO -0.11 0.17 -0.11 0.74 0.00 0.00 0.00 178.15 178.83 3dxk h THR 201 N 0.85 0.80 -0.78 -0.27 2.02 -0.45 -1.86 112.91 113.22 3dxk h THR 201 Ca 0.23 -0.20 0.13 0.00 0.77 0.00 0.00 66.41 67.33 3dxk h THR 201 Cb -0.07 0.92 -0.09 0.00 -1.74 0.00 0.00 68.15 67.17 3dxk h THR 201 CO -0.05 0.04 0.38 1.88 0.37 0.00 0.00 175.52 178.14 3dxk h TYR 202 N -0.42 0.66 0.38 3.16 0.99 -0.97 -0.60 116.97 120.18 3dxk h TYR 202 Ca -0.03 0.03 -0.02 0.00 2.00 0.00 0.00 58.73 60.71 3dxk h TYR 202 Cb 0.32 -0.18 0.00 0.00 1.00 0.00 0.00 36.73 37.87 3dxk h TYR 202 CO -0.03 0.17 -0.18 0.35 -0.00 0.00 0.00 178.16 178.47 3dxk h PHE 203 N 0.58 -0.47 0.00 4.88 3.57 -1.08 -0.73 116.94 123.69 3dxk h PHE 203 Ca 0.41 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.90 3dxk h PHE 203 Cb 0.54 0.16 0.00 0.00 2.79 0.00 0.00 35.95 39.44 3dxk h PHE 203 CO -0.11 -0.27 0.19 0.82 -2.23 0.00 0.00 178.31 176.71 3dxk h ILE 204 N -0.55 0.00 0.05 1.41 2.04 -0.57 0.28 117.51 120.17 3dxk h ILE 204 Ca -0.05 0.00 -0.23 0.00 1.00 0.00 0.00 64.86 65.58 3dxk h ILE 204 Cb 0.41 0.73 0.02 0.00 -0.74 0.00 0.00 36.82 37.24 3dxk h ILE 204 CO 0.09 0.00 -0.93 -0.61 0.00 0.00 0.00 178.15 176.70 3dxk h GLN 205 N 0.00 0.53 -0.46 2.37 4.15 0.33 -2.85 115.11 119.18 3dxk h GLN 205 Ca 0.00 -0.64 -0.10 0.00 0.77 0.00 0.00 58.65 58.68 3dxk h GLN 205 Cb 0.39 0.20 -0.01 0.00 0.21 0.00 0.00 27.48 28.27 3dxk h GLN 205 CO 0.00 1.26 -0.08 1.96 -1.93 0.00 0.00 178.83 180.04 3dxk h GLN 206 N 0.09 0.87 -0.55 1.69 4.20 0.26 -1.61 115.11 120.06 3dxk h GLN 206 Ca -0.13 -0.32 0.04 0.00 0.06 0.00 0.00 58.65 58.30 3dxk h GLN 206 Cb 1.63 -0.06 -0.03 0.00 0.30 0.00 0.00 27.48 29.32 3dxk h GLN 206 CO 0.18 0.96 0.36 -0.07 -0.67 0.00 0.00 178.83 179.59 3dxk h LEU 207 N 0.71 0.51 0.01 1.46 3.38 -1.29 -2.21 115.31 117.89 3dxk h LEU 207 Ca 0.12 -0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.03 3dxk h LEU 207 Cb 0.62 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.26 3dxk h LEU 207 CO 0.04 0.35 -0.21 -0.07 0.09 0.00 0.00 178.44 178.64 3dxk h LEU 208 N 0.59 0.17 -0.97 1.67 3.38 -1.25 -3.30 115.31 115.59 3dxk h LEU 208 Ca 0.23 -0.83 0.19 0.00 0.09 0.00 0.00 57.88 57.55 3dxk h LEU 208 Cb 0.15 -0.05 -0.11 0.00 0.09 0.00 0.00 40.66 40.74 3dxk h LEU 208 CO -0.06 0.98 0.57 0.03 0.09 0.00 0.00 178.44 180.05 3dxk h ARG 209 N -0.63 0.69 0.00 1.13 3.08 -1.05 0.26 114.38 117.87 3dxk h ARG 209 Ca -0.03 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 59.98 3dxk h ARG 209 Cb 1.03 -0.16 0.00 0.00 0.08 0.00 0.00 29.97 30.92 3dxk h ARG 209 CO 0.04 0.45 0.00 -0.25 -1.07 0.00 0.00 179.97 179.15 3dxk n ASP 210 N -4.81 0.00 0.10 7.04 8.00 -0.85 -4.51 116.55 121.52 3dxk n ASP 210 Ca 0.23 -1.18 0.00 0.00 0.71 0.00 0.00 54.79 54.55 3dxk n ASP 210 Cb 0.57 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.67 3dxk n ASP 210 CO 0.00 0.00 0.00 -1.14 -0.39 0.00 0.00 177.20 175.67 3dxk n ARG 211 N -0.84 0.00 -2.57 -1.24 0.63 0.30 -5.10 116.66 107.84 3dxk n ARG 211 Ca 0.15 0.00 -0.33 0.00 -0.92 0.00 0.00 57.85 56.74 3dxk n ARG 211 Cb 0.07 0.00 -0.04 0.00 0.45 0.00 0.00 32.46 32.94 3dxk n ARG 211 CO 0.00 0.00 0.00 -1.21 -2.51 0.00 0.00 177.63 173.91 3dxk s GLU 212 N -2.00 3.90 0.22 -0.14 0.41 0.66 -5.07 118.70 116.68 3dxk s GLU 212 Ca 0.00 1.23 0.07 0.00 -0.41 0.00 0.00 54.97 55.86 3dxk s GLU 212 Cb 0.00 -2.12 -0.05 0.00 -1.78 0.00 0.00 34.13 30.18 3dxk s GLU 212 CO 0.00 -0.33 -0.11 0.14 -0.49 0.00 0.00 175.26 174.48 3dxk s VAL 213 N -2.15 1.60 -0.06 2.63 -7.23 -1.26 -4.65 120.40 109.28 3dxk s VAL 213 Ca 0.64 -2.16 0.00 0.00 -1.81 0.00 0.00 61.98 58.65 3dxk s VAL 213 Cb -0.13 -2.15 0.00 0.00 0.56 0.00 0.00 36.38 34.66 3dxk s VAL 213 CO 0.20 -0.52 0.00 0.61 -0.31 0.00 0.00 175.10 175.09 3dxk n GLY 214 N -0.42 0.45 3.55 2.32 0.00 -1.26 -4.87 105.19 104.96 3dxk n GLY 214 Ca -0.07 -0.80 -0.42 0.00 0.00 0.00 0.00 46.02 44.73 3dxk n GLY 214 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3dxk s ILE 215 N -2.01 4.99 -0.62 -0.61 1.01 -1.26 -4.88 121.20 117.82 3dxk s ILE 215 Ca 0.00 0.26 -0.38 0.00 0.00 0.00 0.00 60.65 60.53 3dxk s ILE 215 Cb 0.00 -4.01 -0.18 0.00 0.01 0.00 0.00 42.46 38.29 3dxk s ILE 215 CO 0.00 -0.29 2.33 -2.65 0.00 0.00 0.00 174.94 174.33 3dxk n PRO 216 N 5.81 0.24 -0.45 2.79 -0.02 -1.26 -4.79 135.00 137.31 3dxk n PRO 216 Ca -0.04 0.05 0.38 0.00 -2.02 0.00 0.00 63.50 61.86 3dxk n PRO 216 Cb 0.49 -1.76 0.69 0.00 -0.02 0.00 0.00 33.50 32.89 3dxk n PRO 216 CO 0.00 0.00 0.00 -1.35 1.98 0.00 0.00 175.50 176.13 3dxk h PRO 217 N 10.99 0.10 -0.11 0.52 0.11 -2.00 1.88 132.00 143.49 3dxk h PRO 217 Ca -0.12 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.98 3dxk h PRO 217 Cb 1.36 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.45 3dxk h PRO 217 CO 1.17 0.06 0.00 0.39 -0.21 0.00 0.00 178.00 179.41 3dxk n GLU 218 N -4.42 1.42 -1.10 1.05 -0.58 -1.26 -3.35 120.64 112.41 3dxk n GLU 218 Ca 0.34 -0.63 0.05 0.00 -0.42 0.00 0.00 57.16 56.50 3dxk n GLU 218 Cb 1.43 -1.33 0.10 0.00 -0.57 0.00 0.00 31.44 31.07 3dxk n GLU 218 CO 0.00 0.00 0.00 1.04 -0.48 0.00 0.00 177.13 177.69 3dxk n GLN 219 N -0.13 0.65 0.25 3.49 6.02 0.64 -4.88 117.38 123.42 3dxk n GLN 219 Ca 0.14 -2.51 -0.15 0.00 -0.01 0.00 0.00 57.00 54.47 3dxk n GLN 219 Cb 0.21 -0.68 -0.08 0.00 1.02 0.00 0.00 30.24 30.70 3dxk n GLN 219 CO 0.00 0.00 0.00 1.03 -1.01 0.00 0.00 177.06 177.08 3dxk h SER 220 N 0.96 -0.51 0.30 1.08 0.87 -1.49 -3.01 113.55 111.75 3dxk h SER 220 Ca -0.13 -0.04 -0.01 0.00 -1.23 0.00 0.00 61.79 60.38 3dxk h SER 220 Cb 1.52 0.13 0.00 0.00 -0.44 0.00 0.00 62.40 63.61 3dxk h SER 220 CO 0.06 -0.29 -0.14 -0.07 -0.53 0.00 0.00 176.83 175.86 3dxk h LEU 221 N -0.72 -0.34 -0.93 2.23 3.38 -1.89 -2.68 115.31 114.36 3dxk h LEU 221 Ca -0.06 -0.08 0.23 0.00 0.09 0.00 0.00 57.88 58.06 3dxk h LEU 221 Cb 0.52 0.09 -0.18 0.00 0.09 0.00 0.00 40.66 41.18 3dxk h LEU 221 CO 0.10 -0.12 -0.06 1.21 0.09 0.00 0.00 178.44 179.66 3dxk n GLU 222 N -5.20 -0.08 0.00 1.13 2.13 -1.23 -0.10 120.64 117.29 3dxk n GLU 222 Ca -0.10 1.42 -0.13 0.00 0.66 0.00 0.00 57.16 59.01 3dxk n GLU 222 Cb 0.22 -2.21 -0.10 0.00 0.27 0.00 0.00 31.44 29.62 3dxk n GLU 222 CO 0.00 0.00 0.00 1.15 -0.41 0.00 0.00 177.13 177.87 3dxk h THR 223 N 0.00 1.31 -0.10 6.31 2.02 -1.44 -2.09 112.91 118.92 3dxk h THR 223 Ca 0.53 -1.19 0.03 0.00 0.77 0.00 0.00 66.41 66.55 3dxk h THR 223 Cb 1.01 2.09 -0.03 0.00 -1.74 0.00 0.00 68.15 69.48 3dxk h THR 223 CO -0.91 0.30 -0.08 0.00 0.37 0.00 0.00 175.52 175.20 3dxk h ALA 224 N 0.34 0.00 -0.98 6.16 0.00 -0.78 0.63 119.26 124.62 3dxk h ALA 224 Ca -0.01 0.04 0.05 0.00 0.00 0.00 0.00 54.91 55.00 3dxk h ALA 224 Cb 0.53 0.17 -0.06 0.00 0.00 0.00 0.00 17.79 18.42 3dxk h ALA 224 CO 0.01 -0.54 0.64 -0.22 0.00 0.00 0.00 179.25 179.14 3dxk h LYS 225 N -0.09 1.16 0.04 0.00 3.64 -0.59 0.27 116.57 121.01 3dxk h LYS 225 Ca 0.06 -0.07 -0.00 0.00 -1.27 0.00 0.00 60.65 59.37 3dxk h LYS 225 Cb 0.18 -0.26 0.00 0.00 -0.41 0.00 0.00 32.23 31.74 3dxk h LYS 225 CO -0.15 0.77 -0.02 0.00 -2.27 0.00 0.00 179.45 177.77 3dxk h ALA 226 N 1.45 -0.06 -0.25 5.00 0.00 -0.58 -1.62 119.26 123.20 3dxk h ALA 226 Ca 0.41 -0.14 0.03 0.00 0.00 0.00 0.00 54.91 55.20 3dxk h ALA 226 Cb 0.09 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 3dxk h ALA 226 CO -0.14 -0.40 0.06 0.28 0.00 0.00 0.00 179.25 179.06 3dxk h VAL 227 N -0.33 0.91 0.09 0.00 2.07 0.89 -0.19 116.25 119.69 3dxk h VAL 227 Ca -0.01 -0.06 0.02 0.00 0.82 0.00 0.00 66.70 67.48 3dxk h VAL 227 Cb 0.30 0.73 -0.04 0.00 -1.52 0.00 0.00 31.29 30.76 3dxk h VAL 227 CO 0.01 0.03 -0.33 0.50 0.02 0.00 0.00 177.57 177.80 3dxk h LYS 228 N 0.17 -0.52 0.00 1.57 3.64 -0.44 0.18 116.57 121.17 3dxk h LYS 228 Ca 0.11 0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.53 3dxk h LYS 228 Cb 0.10 0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.03 3dxk h LYS 228 CO -0.13 -0.34 0.00 0.93 -2.27 0.00 0.00 179.45 177.63 3dxk h GLU 229 N -0.54 0.00 0.00 1.90 5.08 -1.06 -2.50 114.58 117.46 3dxk h GLU 229 Ca 0.04 0.00 -0.17 0.00 -1.00 0.00 0.00 59.36 58.23 3dxk h GLU 229 Cb 0.58 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.80 3dxk h GLU 229 CO -0.21 0.00 -1.82 0.54 -1.00 0.00 0.00 179.01 176.51 3dxk n ARG 230 N -2.70 1.44 0.00 2.33 1.74 -0.10 -4.83 116.66 114.54 3dxk n ARG 230 Ca 0.00 -0.04 0.00 0.00 -0.77 0.00 0.00 57.85 57.04 3dxk n ARG 230 Cb 0.22 -1.34 0.00 0.00 -1.02 0.00 0.00 32.46 30.33 3dxk n ARG 230 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 3dxk n TYR 231 N -2.34 0.00 -2.21 -1.55 4.01 0.60 -5.07 117.16 110.61 3dxk n TYR 231 Ca -0.16 -0.06 -0.30 0.00 -0.16 0.00 0.00 57.90 57.23 3dxk n TYR 231 Cb 0.76 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.79 3dxk n TYR 231 CO 0.00 0.00 0.00 -1.12 -0.46 0.00 0.00 176.86 175.28 3dxk s SER 232 N -0.11 6.28 -0.12 7.72 0.01 -0.94 -4.68 113.70 121.85 3dxk s SER 232 Ca 0.00 1.25 -0.33 0.00 1.31 0.00 0.00 55.95 58.18 3dxk s SER 232 Cb 0.00 -2.39 0.13 0.00 0.21 0.00 0.00 66.02 63.97 3dxk s SER 232 CO 0.00 -0.73 1.18 -0.72 0.41 0.00 0.00 173.24 173.38 3dxk s TYR 233 N -2.96 -0.14 -0.19 2.43 1.13 -0.27 -4.56 117.35 112.80 3dxk s TYR 233 Ca 0.52 0.06 -0.17 0.00 -1.41 0.00 0.00 57.07 56.07 3dxk s TYR 233 Cb -0.11 0.53 -0.04 0.00 -1.10 0.00 0.00 41.96 41.24 3dxk s TYR 233 CO 0.48 -0.28 0.45 0.08 -2.51 0.00 0.00 175.55 173.77 3dxk s VAL 234 N -2.54 5.17 0.13 -3.49 1.01 -0.72 -4.12 120.40 115.84 3dxk s VAL 234 Ca 0.10 0.82 0.02 0.00 0.00 0.00 0.00 61.98 62.92 3dxk s VAL 234 Cb 0.00 -3.78 -0.04 0.00 0.00 0.00 0.00 36.38 32.57 3dxk s VAL 234 CO -0.05 0.24 0.23 0.00 0.00 0.00 0.00 175.10 175.53 3dxk h PRO 236 N 2.46 0.38 -2.68 0.00 0.11 -1.98 -3.45 132.00 126.84 3dxk h PRO 236 Ca -0.47 -0.20 -0.12 0.00 0.11 0.00 0.00 66.00 65.31 3dxk h PRO 236 Cb 1.19 0.01 -0.27 0.00 0.11 0.00 0.00 31.00 32.04 3dxk h PRO 236 CO 0.69 0.76 -0.32 0.34 -0.21 0.00 0.00 178.00 179.26 3dxk s ASP 237 N -6.88 -0.47 0.08 -2.05 2.15 -1.26 -5.09 116.67 103.16 3dxk s ASP 237 Ca -0.06 0.86 -0.32 0.00 0.43 0.00 0.00 52.55 53.46 3dxk s ASP 237 Cb 0.13 0.76 -0.16 0.00 -0.30 0.00 0.00 42.92 43.34 3dxk s ASP 237 CO 0.80 -0.19 1.61 -0.07 -0.17 0.00 0.00 175.17 177.15 3dxk h LEU 238 N 7.19 -0.91 0.39 -1.34 3.38 -1.99 -1.68 115.31 120.35 3dxk h LEU 238 Ca -0.36 0.06 -0.02 0.00 0.09 0.00 0.00 57.88 57.65 3dxk h LEU 238 Cb 1.18 0.28 0.00 0.00 0.09 0.00 0.00 40.66 42.21 3dxk h LEU 238 CO 0.29 -0.54 -0.19 -0.37 0.09 0.00 0.00 178.44 177.72 3dxk h VAL 239 N -0.85 0.61 -0.68 1.22 -1.51 -1.99 -0.01 116.25 113.05 3dxk h VAL 239 Ca -0.06 0.00 0.18 0.00 -1.23 0.00 0.00 66.70 65.59 3dxk h VAL 239 Cb 0.70 0.61 -0.03 0.00 -2.13 0.00 0.00 31.29 30.44 3dxk h VAL 239 CO 0.04 0.00 0.48 0.11 -1.23 0.00 0.00 177.57 176.97 3dxk h LYS 240 N -0.53 0.12 0.02 5.19 1.57 -1.99 0.23 116.57 121.18 3dxk h LYS 240 Ca -0.05 -0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.72 3dxk h LYS 240 Cb 0.41 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.69 3dxk h LYS 240 CO 0.09 0.08 -0.01 1.49 -0.57 0.00 0.00 179.45 180.53 3dxk h GLU 241 N 0.13 -0.03 -0.96 3.15 4.57 -0.68 -2.17 114.58 118.59 3dxk h GLU 241 Ca 0.33 0.00 0.18 0.00 -1.18 0.00 0.00 59.36 58.70 3dxk h GLU 241 Cb 1.12 0.01 -0.09 0.00 -0.16 0.00 0.00 28.75 29.64 3dxk h GLU 241 CO -0.04 0.64 0.61 0.74 -1.18 0.00 0.00 179.01 179.78 3dxk h PHE 242 N -0.76 0.86 0.33 0.92 0.04 0.12 -0.63 116.94 117.82 3dxk h PHE 242 Ca -0.00 0.03 -0.02 0.00 2.80 0.00 0.00 57.97 60.78 3dxk h PHE 242 Cb 0.69 -0.26 0.00 0.00 2.20 0.00 0.00 35.95 38.58 3dxk h PHE 242 CO 0.17 0.23 -0.16 -0.97 -0.60 0.00 0.00 178.31 176.98 3dxk h ASN 243 N 0.65 -0.38 -0.73 2.17 -0.00 -0.53 -2.19 115.58 114.58 3dxk h ASN 243 Ca 0.52 -0.05 0.15 0.00 -0.00 0.00 0.00 56.30 56.92 3dxk h ASN 243 Cb 0.94 0.10 -0.11 0.00 -0.00 0.00 0.00 38.32 39.25 3dxk h ASN 243 CO -0.27 -0.19 0.19 0.11 -0.00 0.00 0.00 177.43 177.27 3dxk h LYS 244 N -0.54 0.28 0.00 6.67 1.57 -0.47 -0.09 116.57 123.98 3dxk h LYS 244 Ca -0.05 -0.02 -0.04 0.00 -1.87 0.00 0.00 60.65 58.68 3dxk h LYS 244 Cb 0.40 -0.06 -0.01 0.00 0.08 0.00 0.00 32.23 32.64 3dxk h LYS 244 CO 0.07 0.19 -0.20 1.88 -0.57 0.00 0.00 179.45 180.82 3dxk h TYR 245 N 0.29 0.00 -0.00 -1.35 0.99 -1.05 -1.68 116.97 114.17 3dxk h TYR 245 Ca 0.41 0.00 0.00 0.00 2.00 0.00 0.00 58.73 61.14 3dxk h TYR 245 Cb 0.68 0.00 0.00 0.00 1.00 0.00 0.00 36.73 38.41 3dxk h TYR 245 CO -0.25 0.20 -0.59 -0.25 -0.00 0.00 0.00 178.16 177.28 3dxk n ASP 246 N -3.90 0.65 -0.12 3.88 10.43 -0.15 -3.27 116.55 124.06 3dxk n ASP 246 Ca -0.02 -0.45 -0.23 0.00 2.57 0.00 0.00 54.79 56.66 3dxk n ASP 246 Cb 0.29 0.40 -0.08 0.00 1.84 0.00 0.00 41.12 43.57 3dxk n ASP 246 CO 0.00 0.00 0.00 0.41 -1.07 0.00 0.00 177.20 176.54 3dxk n THR 247 N -1.44 1.47 -1.92 -3.53 -1.04 -0.57 -4.65 114.28 102.60 3dxk n THR 247 Ca 0.06 -0.22 -0.32 0.00 -2.04 0.00 0.00 64.05 61.53 3dxk n THR 247 Cb 0.34 -1.99 0.04 0.00 -1.82 0.00 0.00 70.33 66.89 3dxk n THR 247 CO 0.00 0.00 0.00 -0.67 -0.64 0.00 0.00 175.07 173.76 3dxk n ASP 248 N -4.26 6.26 -0.51 8.00 4.64 -0.65 -4.87 116.55 125.15 3dxk n ASP 248 Ca -0.41 -3.78 0.42 0.00 -1.38 0.00 0.00 54.79 49.64 3dxk n ASP 248 Cb 0.77 -0.72 0.70 0.00 -1.04 0.00 0.00 41.12 40.83 3dxk n ASP 248 CO 0.00 0.00 0.00 1.23 -0.82 0.00 0.00 177.20 177.61 3dxk h GLY 249 N 2.43 1.18 2.00 0.27 0.00 -1.71 0.28 103.07 107.51 3dxk h GLY 249 Ca 0.47 -0.08 -0.04 0.00 0.00 0.00 0.00 47.33 47.67 3dxk h GLY 249 CO 1.17 -0.41 -0.19 0.23 0.00 0.00 0.00 176.54 177.34 3dxk h SER 250 N 0.01 0.00 -0.46 0.19 0.87 -1.89 -1.17 113.55 111.10 3dxk h SER 250 Ca 0.89 0.00 -0.25 0.00 -1.23 0.00 0.00 61.79 61.20 3dxk h SER 250 Cb 2.96 0.00 -0.15 0.00 -0.44 0.00 0.00 62.40 64.77 3dxk h SER 250 CO -0.40 0.19 0.01 0.29 -0.53 0.00 0.00 176.83 176.40 3dxk n LYS 251 N -3.79 1.94 0.00 2.24 5.02 0.09 -4.55 118.16 119.12 3dxk n LYS 251 Ca -0.02 -3.20 0.00 0.00 -2.02 0.00 0.00 58.31 53.07 3dxk n LYS 251 Cb 0.30 -1.89 0.00 0.00 -0.02 0.00 0.00 35.03 33.42 3dxk n LYS 251 CO 0.00 0.00 0.00 0.91 -0.52 0.00 0.00 177.40 177.79 3dxk n TRP 252 N -1.12 0.00 -2.54 2.13 7.02 -1.15 -5.06 117.44 116.72 3dxk n TRP 252 Ca 0.38 0.00 -0.43 0.00 -1.02 0.00 0.00 57.50 56.43 3dxk n TRP 252 Cb 1.12 0.00 -0.02 0.00 -2.42 0.00 0.00 31.31 29.99 3dxk n TRP 252 CO 0.00 0.00 0.00 0.42 -2.02 0.00 0.00 177.69 176.09 3dxk s ILE 253 N -1.00 4.42 0.36 -0.99 -1.09 -0.45 -4.87 121.20 117.58 3dxk s ILE 253 Ca 0.00 1.68 0.07 0.00 -2.23 0.00 0.00 60.65 60.17 3dxk s ILE 253 Cb 0.00 -4.23 -0.01 0.00 -1.58 0.00 0.00 42.46 36.64 3dxk s ILE 253 CO 0.00 -0.31 0.44 -0.54 -1.23 0.00 0.00 174.94 173.30 3dxk s LYS 254 N 3.60 2.89 0.06 2.79 -0.14 -0.40 -4.89 119.74 123.65 3dxk s LYS 254 Ca 0.50 -1.19 0.08 0.00 -1.36 0.00 0.00 55.97 53.99 3dxk s LYS 254 Cb -0.16 -2.68 -0.03 0.00 -1.68 0.00 0.00 37.83 33.28 3dxk s LYS 254 CO 0.14 -0.04 -0.19 -0.65 -0.76 0.00 0.00 175.35 173.85 3dxk s GLN 255 N -4.17 1.95 -0.02 1.68 -1.52 -1.26 0.56 119.66 116.88 3dxk s GLN 255 Ca 0.47 -1.05 0.03 0.00 -1.95 0.00 0.00 55.36 52.86 3dxk s GLN 255 Cb -0.08 -2.14 -0.00 0.00 -0.22 0.00 0.00 33.01 30.57 3dxk s GLN 255 CO 0.30 0.52 -0.10 -0.47 -0.25 0.00 0.00 175.29 175.30 3dxk s TYR 256 N -0.96 0.96 -0.07 0.91 5.04 -0.57 -4.92 117.35 117.74 3dxk s TYR 256 Ca 0.15 -0.22 0.01 0.00 -2.44 0.00 0.00 57.07 54.56 3dxk s TYR 256 Cb -0.10 -0.66 0.02 0.00 0.35 0.00 0.00 41.96 41.56 3dxk s TYR 256 CO 0.06 -0.07 -0.06 0.95 -1.34 0.00 0.00 175.55 175.08 3dxk s THR 257 N 0.04 0.77 0.33 4.34 -4.23 -1.26 -1.21 115.64 114.41 3dxk s THR 257 Ca -0.01 -0.20 0.05 0.00 -1.18 0.00 0.00 61.69 60.35 3dxk s THR 257 Cb -0.07 -0.79 -0.06 0.00 1.34 0.00 0.00 72.50 72.92 3dxk s THR 257 CO 0.00 0.30 0.01 -0.83 -0.54 0.00 0.00 174.62 173.56 3dxk s GLY 258 N 1.25 2.08 -0.22 3.99 0.00 -0.48 -4.96 107.32 108.98 3dxk s GLY 258 Ca -0.05 -2.06 -0.07 0.00 0.00 0.00 0.00 44.72 42.54 3dxk s GLY 258 CO -0.02 -1.88 0.06 -0.42 0.00 0.00 0.00 173.10 170.84 3dxk s ILE 259 N -3.09 4.46 -0.13 0.90 1.09 -1.26 -0.70 121.20 122.47 3dxk s ILE 259 Ca 0.34 -0.13 -0.29 0.00 -1.10 0.00 0.00 60.65 59.46 3dxk s ILE 259 Cb 0.07 -3.05 -0.05 0.00 -1.06 0.00 0.00 42.46 38.37 3dxk s ILE 259 CO 0.15 0.39 1.81 0.21 -0.10 0.00 0.00 174.94 177.40 3dxk s ASN 260 N 1.06 6.28 0.64 3.58 3.84 -1.11 -4.84 114.94 124.38 3dxk s ASN 260 Ca 0.04 2.01 0.32 0.00 0.21 0.00 0.00 52.86 55.43 3dxk s ASN 260 Cb -0.14 -2.53 1.72 0.00 -0.55 0.00 0.00 41.25 39.75 3dxk s ASN 260 CO 0.03 -1.28 2.02 0.00 -2.79 0.00 0.00 177.10 175.08 3dxk h ALA 261 N 11.27 1.54 -3.56 1.71 0.00 -1.97 -0.46 119.26 127.78 3dxk h ALA 261 Ca -0.39 -0.00 -0.67 0.00 0.00 0.00 0.00 54.91 53.84 3dxk h ALA 261 Cb 1.19 0.01 -0.37 0.00 0.00 0.00 0.00 17.79 18.62 3dxk h ALA 261 CO 0.97 -0.34 -0.69 0.42 0.00 0.00 0.00 179.25 179.61 3dxk s ILE 262 N -4.32 2.63 0.00 0.00 1.01 -1.26 -4.49 121.20 114.77 3dxk s ILE 262 Ca -0.04 -1.95 0.00 0.00 0.00 0.00 0.00 60.65 58.66 3dxk s ILE 262 Cb 0.12 -2.74 0.00 0.00 0.01 0.00 0.00 42.46 39.85 3dxk s ILE 262 CO 0.40 -0.41 0.00 -1.54 0.00 0.00 0.00 174.94 173.39 3dxk n SER 263 N 4.44 0.00 -2.72 3.58 3.41 -1.25 -4.68 113.62 116.40 3dxk n SER 263 Ca -0.04 0.00 -0.07 0.00 -0.26 0.00 0.00 58.87 58.49 3dxk n SER 263 Cb 0.42 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.36 3dxk n SER 263 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3dxk n LYS 264 N -1.29 -2.69 -3.42 4.33 5.02 -0.18 -4.97 118.16 114.96 3dxk n LYS 264 Ca 0.00 0.15 -0.20 0.00 -2.02 0.00 0.00 58.31 56.24 3dxk n LYS 264 Cb 0.00 -4.69 -0.02 0.00 -0.02 0.00 0.00 35.03 30.31 3dxk n LYS 264 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 3dxk s LYS 265 N -5.26 2.64 -0.24 1.97 -0.14 -1.25 -4.75 119.74 112.71 3dxk s LYS 265 Ca 0.10 -1.43 -0.28 0.00 -1.36 0.00 0.00 55.97 53.00 3dxk s LYS 265 Cb -0.05 -2.50 0.15 0.00 -1.68 0.00 0.00 37.83 33.75 3dxk s LYS 265 CO 0.12 -0.19 1.16 -0.59 -0.76 0.00 0.00 175.35 175.09 3dxk s PHE 267 N -2.42 -0.27 0.05 3.18 -0.12 0.12 -2.76 117.98 115.76 3dxk s PHE 267 Ca 0.49 0.54 0.08 0.00 -0.05 0.00 0.00 56.93 57.99 3dxk s PHE 267 Cb -0.05 0.45 -0.03 0.00 -0.63 0.00 0.00 43.02 42.76 3dxk s PHE 267 CO 0.29 -0.19 -0.23 -1.54 -0.05 0.00 0.00 175.22 173.50 3dxk s SER 268 N -0.60 2.75 -0.01 1.98 1.04 -1.26 -1.38 113.70 116.21 3dxk s SER 268 Ca 0.03 -0.56 -0.05 0.00 0.48 0.00 0.00 55.95 55.85 3dxk s SER 268 Cb -0.02 -0.23 0.00 0.00 0.10 0.00 0.00 66.02 65.86 3dxk s SER 268 CO -0.05 0.20 0.11 0.27 0.98 0.00 0.00 173.24 174.75 3dxk s ILE 269 N -0.81 0.06 0.27 -1.02 -4.36 -0.35 -4.91 121.20 110.08 3dxk s ILE 269 Ca 0.09 -0.49 -0.27 0.00 -0.26 0.00 0.00 60.65 59.73 3dxk s ILE 269 Cb -0.09 -0.33 -0.09 0.00 1.25 0.00 0.00 42.46 43.20 3dxk s ILE 269 CO 0.02 -0.27 0.91 -1.81 0.24 0.00 0.00 174.94 174.03 3dxk s ASP 270 N -0.90 7.43 -0.16 4.36 1.01 -1.26 -1.51 116.67 125.64 3dxk s ASP 270 Ca -0.10 1.83 0.00 0.00 0.71 0.00 0.00 52.55 54.99 3dxk s ASP 270 Cb -0.06 -2.57 0.00 0.00 1.01 0.00 0.00 42.92 41.31 3dxk s ASP 270 CO 0.01 0.05 -0.16 -0.69 0.21 0.00 0.00 175.17 174.58 3dxk s VAL 271 N -1.41 2.51 0.00 -1.27 1.01 0.19 -4.91 120.40 116.52 3dxk s VAL 271 Ca 0.45 -0.82 0.00 0.00 0.00 0.00 0.00 61.98 61.62 3dxk s VAL 271 Cb -0.21 -2.06 0.00 0.00 0.00 0.00 0.00 36.38 34.11 3dxk s VAL 271 CO 0.27 0.52 0.00 0.61 0.00 0.00 0.00 175.10 176.49 3dxk n GLY 272 N 4.20 3.56 0.27 4.51 0.00 -1.26 -1.28 105.19 115.19 3dxk n GLY 272 Ca -0.19 -0.44 0.14 0.00 0.00 0.00 0.00 46.02 45.53 3dxk n GLY 272 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3dxk n TYR 273 N 0.00 0.58 0.32 1.61 0.53 -1.26 -0.09 117.16 118.85 3dxk n TYR 273 Ca 0.00 0.95 0.14 0.00 -1.02 0.00 0.00 57.90 57.97 3dxk n TYR 273 Cb 0.00 -1.14 0.73 0.00 -1.03 0.00 0.00 39.34 37.90 3dxk n TYR 273 CO 0.00 0.00 0.00 1.05 -1.02 0.00 0.00 176.86 176.89 3dxk h GLU 274 N 0.00 0.00 -0.49 -0.72 9.09 -1.95 -1.77 114.58 118.74 3dxk h GLU 274 Ca 0.51 0.00 0.04 0.00 0.05 0.00 0.00 59.36 59.97 3dxk h GLU 274 Cb 1.13 0.00 -0.04 0.00 -1.65 0.00 0.00 28.75 28.19 3dxk h GLU 274 CO -0.72 0.00 0.24 0.00 0.05 0.00 0.00 179.01 178.59 3dxk h ARG 275 N 0.00 0.46 0.00 1.06 3.08 -0.77 -2.82 114.38 115.39 3dxk h ARG 275 Ca 0.01 -0.03 -0.04 0.00 0.07 0.00 0.00 59.98 60.00 3dxk h ARG 275 Cb 0.83 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.77 3dxk h ARG 275 CO -0.00 0.31 -1.99 1.97 -1.07 0.00 0.00 179.97 179.18 3dxk n PHE 276 N -4.90 0.00 0.07 3.04 -1.74 -0.73 -1.11 117.46 112.09 3dxk n PHE 276 Ca 0.04 0.00 -0.07 0.00 -0.56 0.00 0.00 57.45 56.86 3dxk n PHE 276 Cb 0.13 -0.53 0.07 0.00 1.52 0.00 0.00 39.48 40.67 3dxk n PHE 276 CO 0.00 0.00 0.00 -0.07 -0.56 0.00 0.00 176.76 176.13 3dxk h LEU 277 N 0.00 0.34 0.64 5.98 3.38 -1.40 -3.05 115.31 121.21 3dxk h LEU 277 Ca -0.05 -0.22 -0.03 0.00 0.09 0.00 0.00 57.88 57.67 3dxk h LEU 277 Cb 1.08 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 41.73 3dxk h LEU 277 CO 0.00 0.93 -0.35 1.23 0.09 0.00 0.00 178.44 180.34 3dxk h GLY 278 N 1.47 -1.03 2.00 0.83 0.00 -1.72 -2.85 103.07 101.77 3dxk h GLY 278 Ca -0.02 0.40 -0.01 0.00 0.00 0.00 0.00 47.33 47.70 3dxk h GLY 278 CO 0.11 -0.36 -0.04 -2.55 0.00 0.00 0.00 176.54 173.70 3dxk h PRO 279 N -0.91 0.00 -0.48 4.80 0.11 -1.82 -2.19 132.00 131.50 3dxk h PRO 279 Ca -0.09 0.00 0.14 0.00 0.11 0.00 0.00 66.00 66.16 3dxk h PRO 279 Cb 0.72 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.81 3dxk h PRO 279 CO 0.12 0.04 0.39 1.49 -0.21 0.00 0.00 178.00 179.82 3dxk h GLU 280 N 0.00 0.00 0.00 1.05 4.57 -1.38 -1.96 114.58 116.86 3dxk h GLU 280 Ca -0.00 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.18 3dxk h GLU 280 Cb 0.09 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.68 3dxk h GLU 280 CO 0.00 0.00 0.00 -0.84 -1.18 0.00 0.00 179.01 176.99 3dxk h ILE 281 N 0.00 0.00 -0.56 2.32 3.07 -1.38 -0.36 117.51 120.60 3dxk h ILE 281 Ca 0.23 -0.07 -0.07 0.00 1.55 0.00 0.00 64.86 66.50 3dxk h ILE 281 Cb 1.00 0.93 -0.02 0.00 -0.27 0.00 0.00 36.82 38.45 3dxk h ILE 281 CO -0.00 0.00 0.07 -0.26 -1.05 0.00 0.00 178.15 176.91 3dxk h PHE 282 N 0.00 0.95 0.00 0.16 0.04 -1.59 -1.95 116.94 114.56 3dxk h PHE 282 Ca 0.00 -0.12 -0.05 0.00 2.80 0.00 0.00 57.97 60.60 3dxk h PHE 282 Cb 0.07 -0.27 -0.01 0.00 2.20 0.00 0.00 35.95 37.95 3dxk h PHE 282 CO 0.00 0.83 -0.93 0.74 -0.60 0.00 0.00 178.31 178.35 3dxk h PHE 283 N 0.85 0.00 -2.01 -0.55 0.04 -1.30 -2.38 116.94 111.60 3dxk h PHE 283 Ca 0.17 0.00 -0.55 0.00 2.80 0.00 0.00 57.97 60.39 3dxk h PHE 283 Cb 0.40 0.00 -0.39 0.00 2.20 0.00 0.00 35.95 38.16 3dxk h PHE 283 CO 0.02 0.20 -1.09 0.72 -0.60 0.00 0.00 178.31 177.56 3dxk n HIS 284 N -2.84 -0.13 0.14 -0.55 8.25 -0.63 -4.43 115.22 115.02 3dxk n HIS 284 Ca -0.02 -3.61 0.19 0.00 -0.26 0.00 0.00 57.72 54.02 3dxk n HIS 284 Cb 0.64 -0.37 0.76 0.00 1.12 0.00 0.00 29.99 32.15 3dxk n HIS 284 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 3dxk h PRO 285 N 3.92 0.00 0.00 -0.41 0.11 -1.57 -0.53 132.00 133.52 3dxk h PRO 285 Ca 0.08 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.19 3dxk h PRO 285 Cb 0.88 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.99 3dxk h PRO 285 CO 0.48 0.00 0.00 -0.85 -0.21 0.00 0.00 178.00 177.42 3dxk n GLU 286 N -3.61 0.06 -0.10 1.05 0.28 -1.24 -0.64 120.64 116.44 3dxk n GLU 286 Ca 0.05 0.40 -0.12 0.00 -0.16 0.00 0.00 57.16 57.34 3dxk n GLU 286 Cb 0.56 -1.64 -0.04 0.00 1.43 0.00 0.00 31.44 31.75 3dxk n GLU 286 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 177.13 177.71 3dxk h PHE 287 N 0.00 0.63 0.00 -1.84 -1.00 -1.42 -3.37 116.94 109.93 3dxk h PHE 287 Ca 0.00 -0.13 0.00 0.00 2.81 0.00 0.00 57.97 60.65 3dxk h PHE 287 Cb 0.17 -0.15 0.00 0.00 3.61 0.00 0.00 35.95 39.58 3dxk h PHE 287 CO 0.00 0.75 0.00 0.00 -1.61 0.00 0.00 178.31 177.45 3dxk n ALA 288 N -2.40 1.93 -4.03 2.45 0.00 -1.04 -4.99 120.51 112.43 3dxk n ALA 288 Ca -0.03 -0.02 -0.31 0.00 0.00 0.00 0.00 53.44 53.08 3dxk n ALA 288 Cb 0.31 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.60 3dxk n ALA 288 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 3dxk s ASN 289 N -0.92 3.09 0.49 0.00 3.04 0.18 -5.00 114.94 115.82 3dxk s ASN 289 Ca 0.00 -0.70 0.28 0.00 0.04 0.00 0.00 52.86 52.48 3dxk s ASN 289 Cb 0.00 -1.26 0.96 0.00 -1.54 0.00 0.00 41.25 39.40 3dxk s ASN 289 CO 0.00 -0.09 1.83 -0.65 -3.04 0.00 0.00 177.10 175.16 3dxk h PRO 290 N 7.99 0.00 0.00 0.43 0.11 -1.85 -3.29 132.00 135.39 3dxk h PRO 290 Ca -0.35 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.76 3dxk h PRO 290 Cb 1.12 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.23 3dxk h PRO 290 CO 0.52 0.07 -1.27 -0.25 -0.21 0.00 0.00 178.00 176.86 3dxk n ASP 291 N -3.16 0.56 -4.09 -2.05 10.43 -1.26 -4.91 116.55 112.07 3dxk n ASP 291 Ca 0.01 -0.37 -0.25 0.00 2.57 0.00 0.00 54.79 56.76 3dxk n ASP 291 Cb 0.41 1.16 -0.16 0.00 1.84 0.00 0.00 41.12 44.37 3dxk n ASP 291 CO 0.00 0.00 0.00 0.12 -1.07 0.00 0.00 177.20 176.25 3dxk s PHE 292 N -3.23 1.53 0.00 1.24 5.36 -1.24 -5.01 117.98 116.63 3dxk s PHE 292 Ca 0.02 -0.46 0.00 0.00 -0.96 0.00 0.00 56.93 55.53 3dxk s PHE 292 Cb 0.15 -1.05 0.00 0.00 -0.34 0.00 0.00 43.02 41.77 3dxk s PHE 292 CO 0.85 -0.18 0.16 0.25 -1.46 0.00 0.00 175.22 174.84 3dxk n THR 293 N 3.29 0.02 -2.40 0.12 -2.24 -1.26 -3.65 114.28 108.17 3dxk n THR 293 Ca -0.19 -0.07 -0.42 0.00 -2.27 0.00 0.00 64.05 61.10 3dxk n THR 293 Cb 0.53 1.70 -0.03 0.00 -2.10 0.00 0.00 70.33 70.43 3dxk n THR 293 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 3dxk s GLN 294 N -0.02 4.44 0.45 -0.78 -0.21 -1.26 -4.53 119.66 117.74 3dxk s GLN 294 Ca 0.00 1.81 -0.22 0.00 0.02 0.00 0.00 55.36 56.97 3dxk s GLN 294 Cb 0.00 -3.32 -0.09 0.00 1.00 0.00 0.00 33.01 30.61 3dxk s GLN 294 CO 0.00 -0.23 1.05 -2.14 -2.12 0.00 0.00 175.29 171.85 3dxk s PRO 295 N 0.80 3.96 0.49 2.91 0.02 -1.26 -4.61 135.00 137.31 3dxk s PRO 295 Ca 0.58 1.44 0.18 0.00 0.02 0.00 0.00 61.00 63.22 3dxk s PRO 295 Cb -0.31 -2.30 1.22 0.00 0.02 0.00 0.00 34.50 33.13 3dxk s PRO 295 CO 0.31 -0.31 2.04 0.97 -0.33 0.00 0.00 177.00 179.68 3dxk h ILE 296 N 1.85 0.88 -0.66 2.83 2.10 -1.68 0.20 117.51 123.02 3dxk h ILE 296 Ca -0.49 -0.05 -0.04 0.00 1.08 0.00 0.00 64.86 65.36 3dxk h ILE 296 Cb 1.22 0.71 -0.03 0.00 -1.09 0.00 0.00 36.82 37.62 3dxk h ILE 296 CO 0.60 0.03 0.25 0.77 -1.08 0.00 0.00 178.15 178.72 3dxk h SER 297 N 0.16 0.91 -0.20 2.19 4.64 -1.90 -1.66 113.55 117.68 3dxk h SER 297 Ca 0.19 -0.13 -0.12 0.00 -0.47 0.00 0.00 61.79 61.25 3dxk h SER 297 Cb 0.53 -0.23 0.00 0.00 -0.31 0.00 0.00 62.40 62.39 3dxk h SER 297 CO -0.03 0.82 -0.34 -0.33 -0.87 0.00 0.00 176.83 176.08 3dxk h GLU 298 N 0.96 0.58 -0.66 4.77 5.08 -1.01 -2.58 114.58 121.72 3dxk h GLU 298 Ca 0.22 -0.36 0.03 0.00 -1.00 0.00 0.00 59.36 58.25 3dxk h GLU 298 Cb 0.21 0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.46 3dxk h GLU 298 CO -0.02 0.97 0.41 0.28 -1.00 0.00 0.00 179.01 179.65 3dxk h VAL 299 N 0.24 1.09 -0.53 3.13 2.07 -1.07 -0.70 116.25 120.48 3dxk h VAL 299 Ca 0.01 -0.28 -0.00 0.00 0.82 0.00 0.00 66.70 67.26 3dxk h VAL 299 Cb 0.93 0.22 -0.03 0.00 -1.52 0.00 0.00 31.29 30.89 3dxk h VAL 299 CO 0.08 0.15 0.32 0.58 0.02 0.00 0.00 177.57 178.72 3dxk h VAL 300 N 0.80 1.16 -0.07 2.57 2.07 -1.33 -1.91 116.25 119.55 3dxk h VAL 300 Ca 0.26 -0.36 0.02 0.00 0.82 0.00 0.00 66.70 67.44 3dxk h VAL 300 Cb 0.01 0.43 -0.02 0.00 -1.52 0.00 0.00 31.29 30.20 3dxk h VAL 300 CO -0.10 0.16 -0.03 -0.78 0.02 0.00 0.00 177.57 176.84 3dxk h ASP 301 N 0.72 -0.11 -0.35 0.57 -0.00 -0.95 -2.14 116.42 114.16 3dxk h ASP 301 Ca 0.19 0.03 0.06 0.00 -0.00 0.00 0.00 57.03 57.31 3dxk h ASP 301 Cb -0.02 0.06 -0.06 0.00 -0.00 0.00 0.00 39.33 39.32 3dxk h ASP 301 CO -0.04 -0.05 -0.02 -0.08 -0.00 0.00 0.00 179.24 179.06 3dxk h GLU 302 N -0.03 0.07 0.41 0.28 4.81 -0.98 -1.03 114.58 118.11 3dxk h GLU 302 Ca 0.04 -0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.25 3dxk h GLU 302 Cb 0.08 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.43 3dxk h GLU 302 CO -0.09 0.05 -0.39 0.28 -0.73 0.00 0.00 179.01 178.13 3dxk h VAL 303 N 0.08 0.00 -0.48 0.32 2.07 -1.08 -0.66 116.25 116.50 3dxk h VAL 303 Ca 0.17 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.83 3dxk h VAL 303 Cb 0.24 0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 29.99 3dxk h VAL 303 CO -0.30 0.00 0.41 0.40 0.02 0.00 0.00 177.57 178.10 3dxk h ILE 304 N -0.79 0.55 -0.02 4.57 2.04 -1.22 0.77 117.51 123.41 3dxk h ILE 304 Ca -0.05 0.00 -0.19 0.00 1.00 0.00 0.00 64.86 65.62 3dxk h ILE 304 Cb 0.68 0.70 -0.01 0.00 -0.74 0.00 0.00 36.82 37.45 3dxk h ILE 304 CO -0.04 0.00 -0.83 1.56 0.00 0.00 0.00 178.15 178.84 3dxk h GLN 305 N 0.00 0.26 0.00 2.37 1.08 -0.50 -3.06 115.11 115.27 3dxk h GLN 305 Ca 0.23 -0.26 0.00 0.00 -1.45 0.00 0.00 58.65 57.17 3dxk h GLN 305 Cb 1.05 0.07 0.00 0.00 -0.05 0.00 0.00 27.48 28.55 3dxk h GLN 305 CO -0.00 0.95 0.00 -0.91 -0.95 0.00 0.00 178.83 177.92 3dxk h ASN 306 N 0.16 0.00 -4.07 1.46 2.35 0.68 -3.45 115.58 112.71 3dxk h ASN 306 Ca -0.04 0.00 -0.46 0.00 -0.55 0.00 0.00 56.30 55.25 3dxk h ASN 306 Cb 1.43 0.00 0.09 0.00 0.05 0.00 0.00 38.32 39.90 3dxk h ASN 306 CO 0.13 0.00 0.31 0.00 -1.65 0.00 0.00 177.43 176.22 3dxk n PRO 308 N -3.15 2.22 -0.33 0.00 -0.02 -1.26 -4.87 135.00 127.59 3dxk n PRO 308 Ca 0.09 0.79 0.13 0.00 -2.02 0.00 0.00 63.50 62.50 3dxk n PRO 308 Cb 0.61 -2.51 0.35 0.00 -0.02 0.00 0.00 33.50 31.93 3dxk n PRO 308 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 3dxk h ILE 309 N 3.30 0.74 0.00 4.25 6.09 -1.92 -0.67 117.51 129.30 3dxk h ILE 309 Ca -0.45 -0.25 0.00 0.00 -1.37 0.00 0.00 64.86 62.79 3dxk h ILE 309 Cb 1.26 -0.04 0.00 0.00 0.47 0.00 0.00 36.82 38.51 3dxk h ILE 309 CO 0.81 0.13 0.00 -0.90 -3.07 0.00 0.00 178.15 175.12 3dxk n ASP 310 N -4.67 0.00 0.00 2.19 5.75 -1.26 -2.84 116.55 115.72 3dxk n ASP 310 Ca 0.21 -1.19 0.00 0.00 -0.01 0.00 0.00 54.79 53.81 3dxk n ASP 310 Cb 0.56 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.65 3dxk n ASP 310 CO 0.00 0.00 0.00 0.55 -0.11 0.00 0.00 177.20 177.64 3dxk n VAL 311 N -0.68 0.00 -0.12 2.12 3.14 -0.28 -4.84 118.33 117.66 3dxk n VAL 311 Ca 0.06 -0.20 -0.10 0.00 -2.96 0.00 0.00 64.34 61.15 3dxk n VAL 311 Cb 0.03 1.40 -0.02 0.00 -1.06 0.00 0.00 33.84 34.19 3dxk n VAL 311 CO 0.00 0.00 0.00 0.03 -6.46 0.00 0.00 176.83 170.40 3dxk h ARG 312 N 0.00 0.55 -0.51 1.45 3.08 -1.33 -1.85 114.38 115.75 3dxk h ARG 312 Ca 0.00 -0.12 -0.01 0.00 0.07 0.00 0.00 59.98 59.93 3dxk h ARG 312 Cb 0.20 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.15 3dxk h ARG 312 CO 0.00 0.57 0.29 0.00 -1.07 0.00 0.00 179.97 179.76 3dxk h ARG 313 N 0.42 0.71 -0.34 0.04 3.08 -1.89 -0.57 114.38 115.83 3dxk h ARG 313 Ca 0.11 -0.08 -0.02 0.00 0.07 0.00 0.00 59.98 60.07 3dxk h ARG 313 Cb 0.25 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 30.14 3dxk h ARG 313 CO -0.00 0.54 0.13 -1.35 -1.07 0.00 0.00 179.97 178.22 3dxk h PRO 314 N 0.69 0.47 -0.12 0.04 0.11 -1.87 -1.19 132.00 130.13 3dxk h PRO 314 Ca 0.18 -0.06 -0.02 0.00 0.11 0.00 0.00 66.00 66.21 3dxk h PRO 314 Cb 0.03 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 31.04 3dxk h PRO 314 CO -0.03 0.40 -0.01 -0.07 -0.21 0.00 0.00 178.00 178.08 3dxk h LEU 315 N 0.47 0.21 -1.55 2.35 3.38 -0.66 -3.06 115.31 116.46 3dxk h LEU 315 Ca 0.12 -0.33 -0.00 0.00 0.09 0.00 0.00 57.88 57.75 3dxk h LEU 315 Cb 0.11 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 3dxk h LEU 315 CO -0.01 0.50 0.22 1.88 0.09 0.00 0.00 178.44 181.12 3dxk h TYR 316 N -0.07 0.51 0.00 1.13 0.05 -0.60 -2.20 116.97 115.78 3dxk h TYR 316 Ca 0.03 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.81 3dxk h TYR 316 Cb 0.39 -0.17 0.00 0.00 1.01 0.00 0.00 36.73 37.97 3dxk h TYR 316 CO 0.04 0.35 0.00 1.17 -1.05 0.00 0.00 178.16 178.67 3dxk n LYS 317 N -4.45 0.44 -2.94 4.88 4.81 -0.50 -1.13 118.16 119.28 3dxk n LYS 317 Ca 0.03 0.05 -0.14 0.00 -0.87 0.00 0.00 58.31 57.38 3dxk n LYS 317 Cb 0.09 -1.50 0.01 0.00 0.02 0.00 0.00 35.03 33.65 3dxk n LYS 317 CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 3dxk n ASN 318 N -1.19 -1.34 -4.54 3.14 4.05 -0.83 -4.50 115.26 110.05 3dxk n ASN 318 Ca 0.13 -3.15 -0.42 0.00 0.45 0.00 0.00 54.58 51.58 3dxk n ASN 318 Cb 0.14 0.75 -0.07 0.00 1.23 0.00 0.00 39.78 41.84 3dxk n ASN 318 CO 0.00 0.00 0.00 -0.63 -3.05 0.00 0.00 177.26 173.58 3dxk s ILE 319 N -0.40 4.83 -0.12 -1.44 1.01 -0.55 -2.15 121.20 122.37 3dxk s ILE 319 Ca 0.32 0.34 -0.06 0.00 0.00 0.00 0.00 60.65 61.25 3dxk s ILE 319 Cb 0.24 -4.17 -0.04 0.00 0.01 0.00 0.00 42.46 38.50 3dxk s ILE 319 CO -0.15 -0.50 0.10 -0.69 0.00 0.00 0.00 174.94 173.70 3dxk s VAL 320 N 2.84 5.13 0.28 2.92 1.01 -0.24 0.53 120.40 132.87 3dxk s VAL 320 Ca 0.24 0.07 -0.07 0.00 0.00 0.00 0.00 61.98 62.22 3dxk s VAL 320 Cb -0.14 -3.23 -0.06 0.00 0.00 0.00 0.00 36.38 32.95 3dxk s VAL 320 CO 0.18 0.59 0.57 -0.76 0.00 0.00 0.00 175.10 175.67 3dxk s LEU 321 N -0.74 4.07 -0.29 3.92 1.43 -1.18 -1.22 118.68 124.66 3dxk s LEU 321 Ca 0.13 0.81 -0.12 0.00 -1.03 0.00 0.00 54.13 53.91 3dxk s LEU 321 Cb -0.12 -3.61 0.12 0.00 0.03 0.00 0.00 46.19 42.61 3dxk s LEU 321 CO 0.03 -0.18 0.73 -0.55 0.23 0.00 0.00 176.35 176.61 3dxk s SER 322 N -2.93 -0.98 0.00 2.29 0.15 -0.46 -4.86 113.70 106.91 3dxk s SER 322 Ca 0.45 1.40 0.00 0.00 0.70 0.00 0.00 55.95 58.51 3dxk s SER 322 Cb -0.11 1.93 0.00 0.00 -1.71 0.00 0.00 66.02 66.14 3dxk s SER 322 CO 0.28 -0.20 0.00 0.61 1.20 0.00 0.00 173.24 175.12 3dxk n GLY 323 N 5.01 3.42 0.29 9.45 0.00 -0.98 -0.99 105.19 121.39 3dxk n GLY 323 Ca -0.14 -1.82 0.15 0.00 0.00 0.00 0.00 46.02 44.22 3dxk n GLY 323 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 3dxk h GLY 324 N 0.00 0.00 1.27 -0.02 0.00 -1.70 -2.59 103.07 100.03 3dxk h GLY 324 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3dxk h GLY 324 CO 0.00 0.00 -0.01 1.44 0.00 0.00 0.00 176.54 177.97 3dxk n SER 325 N -3.54 0.07 -1.06 0.19 7.64 -0.94 -2.53 113.62 113.45 3dxk n SER 325 Ca -0.02 -0.51 0.08 0.00 1.01 0.00 0.00 58.87 59.43 3dxk n SER 325 Cb 0.18 -0.16 0.26 0.00 -1.01 0.00 0.00 64.21 63.48 3dxk n SER 325 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 3dxk n THR 326 N -1.13 1.51 0.51 0.44 -2.24 -0.98 -4.48 114.28 107.92 3dxk n THR 326 Ca 0.18 -1.24 0.12 0.00 -2.27 0.00 0.00 64.05 60.84 3dxk n THR 326 Cb 0.20 0.24 0.17 0.00 -2.10 0.00 0.00 70.33 68.84 3dxk n THR 326 CO 0.00 0.00 0.00 0.24 -0.57 0.00 0.00 175.07 174.74 3dxk h MET 327 N 2.86 0.00 -6.75 -0.78 2.86 -1.61 -3.45 114.93 108.06 3dxk h MET 327 Ca 0.00 0.00 -0.57 0.00 -2.06 0.00 0.00 59.70 57.07 3dxk h MET 327 Cb 1.12 0.00 0.13 0.00 0.06 0.00 0.00 31.60 32.91 3dxk h MET 327 CO 0.11 0.00 0.32 1.19 1.06 0.00 0.00 176.91 179.60 3dxk n PHE 328 N -2.22 1.63 -1.70 -0.22 3.72 -1.26 -4.85 117.46 112.56 3dxk n PHE 328 Ca 0.03 0.52 -0.42 0.00 -0.05 0.00 0.00 57.45 57.53 3dxk n PHE 328 Cb 0.45 -2.29 -0.03 0.00 -0.94 0.00 0.00 39.48 36.67 3dxk n PHE 328 CO 0.00 0.00 0.00 -2.13 -0.05 0.00 0.00 176.76 174.58 3dxk n ARG 329 N -0.01 2.79 -1.01 -1.08 0.63 -1.26 -2.05 116.66 114.66 3dxk n ARG 329 Ca 0.08 1.01 -0.00 0.00 -0.92 0.00 0.00 57.85 58.02 3dxk n ARG 329 Cb 0.40 -2.90 -0.00 0.00 0.45 0.00 0.00 32.46 30.41 3dxk n ARG 329 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 3dxk n ASP 330 N 5.29 -3.31 0.22 6.15 8.00 -1.26 -1.76 116.55 129.88 3dxk n ASP 330 Ca 0.18 0.01 -0.16 0.00 0.71 0.00 0.00 54.79 55.53 3dxk n ASP 330 Cb 0.37 -0.85 -0.08 0.00 -0.02 0.00 0.00 41.12 40.54 3dxk n ASP 330 CO 0.00 0.00 0.00 0.15 -0.39 0.00 0.00 177.20 176.96 3dxk h PHE 331 N 0.00 -1.13 -0.68 1.24 3.57 -1.71 -2.18 116.94 116.05 3dxk h PHE 331 Ca -0.01 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.49 3dxk h PHE 331 Cb 0.11 0.45 -0.03 0.00 2.79 0.00 0.00 35.95 39.27 3dxk h PHE 331 CO 0.07 -0.55 0.36 0.78 -2.23 0.00 0.00 178.31 176.74 3dxk h GLY 332 N -0.79 1.03 0.17 2.40 0.00 -1.85 -1.89 103.07 102.14 3dxk h GLY 332 Ca -0.02 -0.48 0.11 0.00 0.00 0.00 0.00 47.33 46.94 3dxk h GLY 332 CO -0.11 0.46 0.06 -0.09 0.00 0.00 0.00 176.54 176.86 3dxk h ARG 333 N 0.94 0.18 -0.23 4.80 2.43 -1.84 0.26 114.38 120.92 3dxk h ARG 333 Ca 0.24 -0.01 -0.11 0.00 -0.81 0.00 0.00 59.98 59.29 3dxk h ARG 333 Cb 0.06 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.56 3dxk h ARG 333 CO -0.04 0.12 -0.32 -0.09 -1.51 0.00 0.00 179.97 178.13 3dxk h ARG 334 N 0.18 0.48 -0.23 0.20 9.65 -1.22 -1.10 114.38 122.33 3dxk h ARG 334 Ca 0.28 -0.21 -0.05 0.00 -1.10 0.00 0.00 59.98 58.91 3dxk h ARG 334 Cb 0.43 -0.01 -0.01 0.00 -1.39 0.00 0.00 29.97 28.98 3dxk h ARG 334 CO -0.41 0.75 -0.05 1.25 2.80 0.00 0.00 179.97 184.31 3dxk h LEU 335 N 0.41 0.44 -0.36 3.80 6.46 -0.34 -1.60 115.31 124.13 3dxk h LEU 335 Ca 0.05 -0.36 -0.03 0.00 -0.12 0.00 0.00 57.88 57.43 3dxk h LEU 335 Cb 0.77 -0.12 -0.02 0.00 -0.73 0.00 0.00 40.66 40.56 3dxk h LEU 335 CO 0.06 0.70 0.12 -0.61 -0.62 0.00 0.00 178.44 178.08 3dxk h GLN 336 N 0.19 0.55 0.55 1.25 4.15 -0.44 0.99 115.11 122.35 3dxk h GLN 336 Ca 0.06 -0.12 -0.02 0.00 0.77 0.00 0.00 58.65 59.34 3dxk h GLN 336 Cb 0.50 -0.08 -0.00 0.00 0.21 0.00 0.00 27.48 28.10 3dxk h GLN 336 CO 0.02 0.57 -0.32 -0.09 -1.93 0.00 0.00 178.83 177.07 3dxk h ARG 337 N 0.42 -0.79 -0.93 1.69 2.43 -1.16 0.78 114.38 116.82 3dxk h ARG 337 Ca 0.12 0.05 0.02 0.00 -0.81 0.00 0.00 59.98 59.36 3dxk h ARG 337 Cb 0.24 0.18 -0.05 0.00 -0.42 0.00 0.00 29.97 29.92 3dxk h ARG 337 CO -0.00 -0.53 0.61 -0.44 -1.51 0.00 0.00 179.97 178.10 3dxk h ASP 338 N -0.83 1.04 -0.61 -3.80 3.32 -1.25 -1.93 116.42 112.38 3dxk h ASP 338 Ca -0.07 -0.02 -0.02 0.00 0.02 0.00 0.00 57.03 56.94 3dxk h ASP 338 Cb 0.66 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.93 3dxk h ASP 338 CO 0.08 0.74 0.29 0.25 -1.72 0.00 0.00 179.24 178.89 3dxk h LEU 339 N 1.23 0.79 -1.35 1.55 5.85 -0.50 -2.30 115.31 120.57 3dxk h LEU 339 Ca 0.35 -0.13 -0.03 0.00 0.84 0.00 0.00 57.88 58.91 3dxk h LEU 339 Cb -0.09 -0.20 -0.02 0.00 0.37 0.00 0.00 40.66 40.72 3dxk h LEU 339 CO -0.09 0.70 0.08 0.11 -0.34 0.00 0.00 178.44 178.90 3dxk h LYS 340 N 0.83 0.51 -0.11 1.25 1.57 -0.33 -1.63 116.57 118.67 3dxk h LYS 340 Ca 0.21 -0.08 -0.01 0.00 -1.87 0.00 0.00 60.65 58.89 3dxk h LYS 340 Cb 0.11 -0.09 -0.00 0.00 0.08 0.00 0.00 32.23 32.33 3dxk h LYS 340 CO -0.03 0.48 0.03 0.00 -0.57 0.00 0.00 179.45 179.36 3dxk h ARG 341 N 0.51 0.17 -0.81 3.15 3.08 -0.84 0.23 114.38 119.87 3dxk h ARG 341 Ca 0.12 -0.04 -0.04 0.00 0.07 0.00 0.00 59.98 60.09 3dxk h ARG 341 Cb 0.21 -0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.20 3dxk h ARG 341 CO -0.00 0.35 0.35 1.15 -1.07 0.00 0.00 179.97 180.74 3dxk h THR 342 N -0.03 1.26 -0.09 2.04 2.02 -1.25 -1.24 112.91 115.61 3dxk h THR 342 Ca 0.03 -0.79 -0.08 0.00 0.77 0.00 0.00 66.41 66.34 3dxk h THR 342 Cb 0.26 0.27 0.00 0.00 -1.74 0.00 0.00 68.15 66.94 3dxk h THR 342 CO 0.00 0.33 -0.26 1.62 0.37 0.00 0.00 175.52 177.58 3dxk h VAL 343 N 1.16 1.41 -0.52 3.16 3.04 -1.18 -2.73 116.25 120.59 3dxk h VAL 343 Ca 0.27 -1.62 -0.07 0.00 -1.01 0.00 0.00 66.70 64.28 3dxk h VAL 343 Cb 0.18 2.23 -0.02 0.00 -2.01 0.00 0.00 31.29 31.67 3dxk h VAL 343 CO -0.03 0.46 0.05 0.44 -1.01 0.00 0.00 177.57 177.49 3dxk h ASP 344 N -0.14 0.80 -0.34 3.17 3.32 -0.52 -2.60 116.42 120.11 3dxk h ASP 344 Ca -0.01 -0.18 0.00 0.00 0.02 0.00 0.00 57.03 56.87 3dxk h ASP 344 Cb 0.89 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 40.21 3dxk h ASP 344 CO 0.06 0.83 0.22 0.00 -1.72 0.00 0.00 179.24 178.63 3dxk h ALA 345 N 1.26 0.43 -1.01 3.45 0.00 -1.24 -0.93 119.26 121.23 3dxk h ALA 345 Ca 0.16 -0.02 0.05 0.00 0.00 0.00 0.00 54.91 55.10 3dxk h ALA 345 Cb 0.40 -0.14 -0.06 0.00 0.00 0.00 0.00 17.79 18.00 3dxk h ALA 345 CO 0.01 -0.11 0.66 -0.09 0.00 0.00 0.00 179.25 179.72 3dxk h ARG 346 N 0.46 1.20 0.00 0.00 2.43 -1.16 -0.59 114.38 116.72 3dxk h ARG 346 Ca 0.13 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.22 3dxk h ARG 346 Cb -0.05 -0.27 0.00 0.00 -0.42 0.00 0.00 29.97 29.23 3dxk h ARG 346 CO -0.03 0.80 0.00 1.28 -1.51 0.00 0.00 179.97 180.51 3dxk n LEU 347 N -4.46 0.67 0.02 3.80 4.32 -0.92 -2.72 117.00 117.71 3dxk n LEU 347 Ca 0.14 0.59 -0.18 0.00 -0.02 0.00 0.00 56.01 56.54 3dxk n LEU 347 Cb 0.13 -0.42 -0.13 0.00 -1.62 0.00 0.00 43.42 41.38 3dxk n LEU 347 CO 0.34 -0.29 0.16 0.50 -1.22 0.00 0.00 177.39 176.88 3dxk h LYS 348 N 0.00 0.33 -0.96 3.23 3.64 0.25 -3.18 116.57 119.88 3dxk h LYS 348 Ca 0.00 -0.45 0.06 0.00 -1.27 0.00 0.00 60.65 58.99 3dxk h LYS 348 Cb 0.58 0.15 -0.06 0.00 -0.41 0.00 0.00 32.23 32.48 3dxk h LYS 348 CO 0.00 1.16 0.62 -0.07 -2.27 0.00 0.00 179.45 178.88 3dxk h LEU 349 N -0.28 0.99 0.09 5.20 4.07 -1.23 -2.63 115.31 121.52 3dxk h LEU 349 Ca -0.10 0.01 -0.00 0.00 0.08 0.00 0.00 57.88 57.86 3dxk h LEU 349 Cb 1.45 -0.20 -0.00 0.00 1.08 0.00 0.00 40.66 42.99 3dxk h LEU 349 CO 0.13 0.64 -0.07 0.28 -1.08 0.00 0.00 178.44 178.33 3dxk h SER 350 N 1.13 -0.19 -0.87 -0.43 0.02 -1.57 -0.29 113.55 111.36 3dxk h SER 350 Ca 0.41 0.01 0.10 0.00 -0.84 0.00 0.00 61.79 61.47 3dxk h SER 350 Cb 0.15 0.06 -0.12 0.00 0.14 0.00 0.00 62.40 62.62 3dxk h SER 350 CO -0.17 -0.10 -0.51 -0.08 -1.14 0.00 0.00 176.83 174.83 3dxk h GLU 351 N -0.16 -0.08 -0.25 3.45 4.81 -1.52 -0.37 114.58 120.46 3dxk h GLU 351 Ca -0.01 0.01 0.06 0.00 -0.13 0.00 0.00 59.36 59.28 3dxk h GLU 351 Cb 0.13 0.02 -0.08 0.00 0.63 0.00 0.00 28.75 29.45 3dxk h GLU 351 CO 0.00 -0.05 -0.37 0.93 -0.73 0.00 0.00 179.01 178.79 3dxk h GLU 352 N -0.08 -0.36 -0.80 1.92 5.08 -1.44 -1.06 114.58 117.84 3dxk h GLU 352 Ca 0.20 0.02 0.17 0.00 -1.00 0.00 0.00 59.36 58.75 3dxk h GLU 352 Cb 0.50 0.08 -0.11 0.00 0.50 0.00 0.00 28.75 29.73 3dxk h GLU 352 CO -0.88 -0.24 0.30 1.25 -1.00 0.00 0.00 179.01 178.45 3dxk h LEU 353 N -0.38 0.24 0.00 1.33 7.12 0.55 -3.52 115.31 120.66 3dxk h LEU 353 Ca 0.12 0.13 0.00 0.00 0.13 0.00 0.00 57.88 58.26 3dxk h LEU 353 Cb 0.58 0.13 0.00 0.00 -0.53 0.00 0.00 40.66 40.83 3dxk h LEU 353 CO -0.45 0.05 0.00 -1.20 -0.13 0.00 0.00 178.44 176.70 3dxk n SER 354 N -5.05 0.00 0.00 1.25 7.64 -0.40 -5.11 113.62 111.95 3dxk n SER 354 Ca 0.17 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.05 3dxk n SER 354 Cb 0.49 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.69 3dxk n SER 354 CO 0.00 0.00 0.00 1.17 -3.01 0.00 0.00 175.04 173.20 3dxk n LYS 359 N 0.00 0.00 -2.63 1.43 4.81 -1.26 -4.98 118.16 115.52 3dxk n LYS 359 Ca 0.00 0.00 -0.42 0.00 -0.87 0.00 0.00 58.31 57.02 3dxk n LYS 359 Cb 0.00 0.00 -0.03 0.00 0.02 0.00 0.00 35.03 35.02 3dxk n LYS 359 CO 0.00 0.00 0.00 -2.14 1.17 0.00 0.00 177.40 176.43 3dxk s PRO 360 N 0.00 4.48 0.27 1.64 0.02 -1.26 -4.96 135.00 135.19 3dxk s PRO 360 Ca 0.00 1.49 -0.29 0.00 0.02 0.00 0.00 61.00 62.22 3dxk s PRO 360 Cb 0.00 -3.48 -0.14 0.00 0.02 0.00 0.00 34.50 30.90 3dxk s PRO 360 CO 0.00 -0.20 1.09 1.17 -0.33 0.00 0.00 177.00 178.73 3dxk n LYS 361 N 4.38 1.44 -1.57 5.54 4.81 -1.26 -4.86 118.16 126.64 3dxk n LYS 361 Ca 0.08 0.51 -0.37 0.00 -0.87 0.00 0.00 58.31 57.65 3dxk n LYS 361 Cb 0.49 -1.94 0.06 0.00 0.02 0.00 0.00 35.03 33.66 3dxk n LYS 361 CO 0.00 0.00 0.00 -2.30 1.17 0.00 0.00 177.40 176.27 3dxk n PRO 362 N 0.98 0.78 -3.61 1.64 -0.02 -1.26 -4.96 135.00 128.55 3dxk n PRO 362 Ca 0.10 0.31 -0.37 0.00 -2.02 0.00 0.00 63.50 61.51 3dxk n PRO 362 Cb 0.31 -2.11 -0.10 0.00 -0.02 0.00 0.00 33.50 31.57 3dxk n PRO 362 CO 0.00 0.00 0.00 0.96 1.98 0.00 0.00 175.50 178.44 3dxk s ILE 363 N -1.58 5.32 -0.34 4.25 -4.36 -1.26 -5.05 121.20 118.18 3dxk s ILE 363 Ca 0.75 0.19 -0.29 0.00 -0.26 0.00 0.00 60.65 61.04 3dxk s ILE 363 Cb -0.41 -3.52 0.00 0.00 1.25 0.00 0.00 42.46 39.78 3dxk s ILE 363 CO 0.48 0.28 1.37 -0.62 0.24 0.00 0.00 174.94 176.69 3dxk s ASP 364 N 1.51 6.52 -0.36 4.36 3.68 -1.26 -5.00 116.67 126.12 3dxk s ASP 364 Ca 0.07 1.10 -0.07 0.00 2.13 0.00 0.00 52.55 55.78 3dxk s ASP 364 Cb -0.15 -2.54 0.05 0.00 -1.45 0.00 0.00 42.92 38.83 3dxk s ASP 364 CO 0.09 -1.23 0.14 -0.69 0.13 0.00 0.00 175.17 173.61 3dxk s VAL 365 N 4.84 3.86 -0.13 1.11 1.01 -1.26 -3.05 120.40 126.79 3dxk s VAL 365 Ca 0.59 -1.23 -0.00 0.00 0.00 0.00 0.00 61.98 61.34 3dxk s VAL 365 Cb -0.16 -3.25 -0.02 0.00 0.00 0.00 0.00 36.38 32.95 3dxk s VAL 365 CO 0.27 -0.28 -0.13 -1.10 0.00 0.00 0.00 175.10 173.86 3dxk s GLN 366 N 1.40 3.36 -0.39 2.72 -0.21 -0.28 -4.97 119.66 121.28 3dxk s GLN 366 Ca -0.00 -0.69 -0.02 0.00 0.02 0.00 0.00 55.36 54.68 3dxk s GLN 366 Cb -0.20 -2.62 0.10 0.00 1.00 0.00 0.00 33.01 31.29 3dxk s GLN 366 CO 0.02 0.23 0.16 0.08 -2.12 0.00 0.00 175.29 173.67 3dxk s VAL 367 N 0.31 3.13 0.21 1.09 1.01 -1.26 -1.49 120.40 123.39 3dxk s VAL 367 Ca -0.10 -2.02 -0.30 0.00 0.00 0.00 0.00 61.98 59.56 3dxk s VAL 367 Cb -0.16 -3.13 -0.08 0.00 0.00 0.00 0.00 36.38 33.01 3dxk s VAL 367 CO 0.06 -0.62 1.13 -0.63 0.00 0.00 0.00 175.10 175.04 3dxk s ILE 368 N 1.12 3.66 -0.02 2.22 -1.09 0.19 -4.85 121.20 122.43 3dxk s ILE 368 Ca 0.07 1.48 0.02 0.00 -2.23 0.00 0.00 60.65 59.98 3dxk s ILE 368 Cb -0.22 -3.94 0.01 0.00 -1.58 0.00 0.00 42.46 36.72 3dxk s ILE 368 CO -0.04 0.27 -0.06 0.42 -1.23 0.00 0.00 174.94 174.30 3dxk s THR 369 N -0.42 0.52 0.36 2.92 -4.23 -1.26 -3.12 115.64 110.41 3dxk s THR 369 Ca 0.49 -0.22 0.06 0.00 -1.18 0.00 0.00 61.69 60.84 3dxk s THR 369 Cb -0.31 -0.48 -0.02 0.00 1.34 0.00 0.00 72.50 73.03 3dxk s THR 369 CO 0.37 0.17 0.22 0.00 -0.54 0.00 0.00 174.62 174.85 3dxk n HIS 370 N 3.33 -0.39 0.29 3.99 1.44 -1.26 -5.04 115.22 117.58 3dxk n HIS 370 Ca -0.18 -2.72 0.14 0.00 -2.01 0.00 0.00 57.72 52.95 3dxk n HIS 370 Cb 0.55 0.16 0.36 0.00 0.12 0.00 0.00 29.99 31.18 3dxk n HIS 370 CO 0.00 0.00 0.00 0.45 -2.81 0.00 0.00 176.34 173.98 3dxk h HIS 371 N 1.90 0.00 -0.58 -1.40 3.86 -1.95 -3.28 115.15 113.70 3dxk h HIS 371 Ca -0.27 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.94 3dxk h HIS 371 Cb 1.20 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.67 3dxk h HIS 371 CO 0.00 0.00 0.00 -1.33 0.86 0.00 0.00 177.93 177.46 3dxk n MET 372 N -2.97 2.69 -0.28 2.45 2.81 -1.26 -4.76 117.12 115.81 3dxk n MET 372 Ca 0.03 -2.43 0.00 0.00 -1.81 0.00 0.00 57.70 53.49 3dxk n MET 372 Cb 0.44 -1.48 0.07 0.00 -0.71 0.00 0.00 33.22 31.54 3dxk n MET 372 CO 0.00 0.00 0.00 1.96 1.51 0.00 0.00 175.97 179.44 3dxk h GLN 373 N 3.68 -0.04 -1.04 0.03 4.20 -1.89 -0.59 115.11 119.46 3dxk h GLN 373 Ca 0.00 0.00 0.27 0.00 0.06 0.00 0.00 58.65 58.98 3dxk h GLN 373 Cb 0.91 0.01 -0.11 0.00 0.30 0.00 0.00 27.48 28.59 3dxk h GLN 373 CO 0.00 -0.02 0.64 -0.09 -0.67 0.00 0.00 178.83 178.69 3dxk h ARG 374 N -0.04 0.44 -0.93 1.46 2.43 -1.86 -0.60 114.38 115.29 3dxk h ARG 374 Ca 0.35 -0.03 -0.43 0.00 -0.81 0.00 0.00 59.98 59.06 3dxk h ARG 374 Cb 0.59 -0.10 -0.41 0.00 -0.42 0.00 0.00 29.97 29.63 3dxk h ARG 374 CO -0.83 0.29 -0.98 0.66 -1.51 0.00 0.00 179.97 177.60 3dxk n TYR 375 N -4.75 2.11 -0.07 2.20 4.02 -0.93 -4.08 117.16 115.65 3dxk n TYR 375 Ca 0.27 -2.58 -0.07 0.00 -0.01 0.00 0.00 57.90 55.51 3dxk n TYR 375 Cb 0.86 -0.26 -0.00 0.00 -0.02 0.00 0.00 39.34 39.92 3dxk n TYR 375 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 3dxk h ALA 376 N 2.61 0.09 -0.33 -0.72 0.00 0.48 -1.32 119.26 120.07 3dxk h ALA 376 Ca 0.10 0.11 0.06 0.00 0.00 0.00 0.00 54.91 55.18 3dxk h ALA 376 Cb 1.22 0.35 -0.06 0.00 0.00 0.00 0.00 17.79 19.30 3dxk h ALA 376 CO 0.57 -0.54 -0.04 0.28 0.00 0.00 0.00 179.25 179.51 3dxk h VAL 377 N -0.10 0.71 -0.72 0.00 2.07 -1.85 -0.94 116.25 115.42 3dxk h VAL 377 Ca 0.15 -0.01 -0.05 0.00 0.82 0.00 0.00 66.70 67.61 3dxk h VAL 377 Cb 0.34 0.67 -0.03 0.00 -1.52 0.00 0.00 31.29 30.74 3dxk h VAL 377 CO -0.36 0.01 0.27 -0.25 0.02 0.00 0.00 177.57 177.26 3dxk h TRP 378 N 0.04 1.11 -0.58 1.57 7.01 -1.82 -1.26 115.95 122.02 3dxk h TRP 378 Ca 0.16 -0.09 -0.06 0.00 2.11 0.00 0.00 58.89 61.01 3dxk h TRP 378 Cb 0.23 -0.33 -0.03 0.00 -2.10 0.00 0.00 29.16 26.93 3dxk h TRP 378 CO -0.27 0.86 0.12 0.35 -2.79 0.00 0.00 178.44 176.71 3dxk h PHE 379 N 1.04 0.95 0.12 2.65 3.57 -0.86 0.29 116.94 124.70 3dxk h PHE 379 Ca 0.24 -0.10 -0.01 0.00 3.53 0.00 0.00 57.97 61.63 3dxk h PHE 379 Cb 0.24 -0.27 0.00 0.00 2.79 0.00 0.00 35.95 38.70 3dxk h PHE 379 CO 0.02 0.80 -0.06 0.78 -2.23 0.00 0.00 178.31 177.63 3dxk h GLY 380 N 1.01 -0.16 0.41 2.40 0.00 -0.80 0.30 103.07 106.24 3dxk h GLY 380 Ca 0.18 0.06 0.12 0.00 0.00 0.00 0.00 47.33 47.70 3dxk h GLY 380 CO 0.00 -0.06 0.56 -1.33 0.00 0.00 0.00 176.54 175.71 3dxk h GLY 381 N -0.32 1.52 1.02 4.60 0.00 -0.77 0.34 103.07 109.47 3dxk h GLY 381 Ca -0.02 -0.36 -0.11 0.00 0.00 0.00 0.00 47.33 46.84 3dxk h GLY 381 CO 0.03 0.10 -0.16 0.23 0.00 0.00 0.00 176.54 176.74 3dxk h SER 382 N 0.86 0.86 -0.29 0.19 0.87 -0.09 -1.85 113.55 114.10 3dxk h SER 382 Ca 0.47 -0.39 -0.11 0.00 -1.23 0.00 0.00 61.79 60.53 3dxk h SER 382 Cb 0.52 -0.24 -0.01 0.00 -0.44 0.00 0.00 62.40 62.23 3dxk h SER 382 CO -0.29 1.05 -0.22 0.24 -0.53 0.00 0.00 176.83 177.09 3dxk h MET 383 N 0.66 0.77 -0.33 2.24 2.86 -0.07 -2.84 114.93 118.21 3dxk h MET 383 Ca 0.10 -0.31 -0.13 0.00 -2.06 0.00 0.00 59.70 57.30 3dxk h MET 383 Cb 0.71 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 32.33 3dxk h MET 383 CO 0.05 0.92 -0.32 1.25 1.06 0.00 0.00 176.91 179.87 3dxk h LEU 384 N 0.67 0.85 0.00 1.22 5.85 -0.91 -3.07 115.31 119.93 3dxk h LEU 384 Ca 0.09 -0.47 0.00 0.00 0.84 0.00 0.00 57.88 58.35 3dxk h LEU 384 Cb 0.72 -0.24 0.00 0.00 0.37 0.00 0.00 40.66 41.52 3dxk h LEU 384 CO 0.06 1.14 0.00 0.00 -0.34 0.00 0.00 178.44 179.30 3dxk n ALA 385 N -2.51 1.79 0.72 1.25 0.00 -0.70 -2.20 120.51 118.86 3dxk n ALA 385 Ca -0.03 -0.06 0.11 0.00 0.00 0.00 0.00 53.44 53.46 3dxk n ALA 385 Cb 0.50 -1.24 0.04 0.00 0.00 0.00 0.00 19.45 18.74 3dxk n ALA 385 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3dxk n SER 386 N -1.34 0.65 -4.86 0.00 7.64 -1.15 -4.61 113.62 109.95 3dxk n SER 386 Ca 0.06 -0.36 -0.33 0.00 1.01 0.00 0.00 58.87 59.25 3dxk n SER 386 Cb 0.13 0.75 -0.06 0.00 -1.01 0.00 0.00 64.21 64.02 3dxk n SER 386 CO 0.00 0.00 0.00 0.42 -3.01 0.00 0.00 175.04 172.45 3dxk s THR 387 N -3.13 4.80 0.48 0.44 -4.23 -0.93 -4.85 115.64 108.21 3dxk s THR 387 Ca 0.06 0.77 0.13 0.00 -1.18 0.00 0.00 61.69 61.47 3dxk s THR 387 Cb 0.15 -3.65 0.25 0.00 1.34 0.00 0.00 72.50 70.59 3dxk s THR 387 CO 0.80 -0.04 2.09 -0.65 -0.54 0.00 0.00 174.62 176.27 3dxk h PRO 388 N 2.67 0.14 -0.54 3.99 0.11 -1.92 -2.36 132.00 134.08 3dxk h PRO 388 Ca -0.48 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.62 3dxk h PRO 388 Cb 1.18 -0.03 -0.03 0.00 0.11 0.00 0.00 31.00 32.23 3dxk h PRO 388 CO 0.67 0.13 0.34 1.49 -0.21 0.00 0.00 178.00 180.43 3dxk h GLU 389 N 0.14 0.71 -0.09 1.05 4.81 -1.94 -2.45 114.58 116.81 3dxk h GLU 389 Ca 0.04 -0.05 0.03 0.00 -0.13 0.00 0.00 59.36 59.25 3dxk h GLU 389 Cb 0.06 -0.16 -0.00 0.00 0.63 0.00 0.00 28.75 29.28 3dxk h GLU 389 CO -0.00 0.48 0.08 0.35 -0.73 0.00 0.00 179.01 179.20 3dxk h PHE 390 N 0.73 0.00 0.00 0.92 3.57 -1.62 -2.20 116.94 118.35 3dxk h PHE 390 Ca 0.20 0.00 -0.09 0.00 3.53 0.00 0.00 57.97 61.60 3dxk h PHE 390 Cb -0.06 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 38.66 3dxk h PHE 390 CO 0.00 0.00 -0.45 1.88 -2.23 0.00 0.00 178.31 177.51 3dxk h TYR 391 N 0.00 0.00 0.00 0.41 -1.99 -1.58 -3.10 116.97 110.71 3dxk h TYR 391 Ca 0.04 0.00 -0.07 0.00 2.00 0.00 0.00 58.73 60.71 3dxk h TYR 391 Cb 0.21 0.00 -0.01 0.00 2.00 0.00 0.00 36.73 38.93 3dxk h TYR 391 CO 0.00 0.45 -0.33 1.96 -0.00 0.00 0.00 178.16 180.24 3dxk h GLN 392 N 0.00 0.00 -0.02 4.88 4.20 -1.48 -3.31 115.11 119.37 3dxk h GLN 392 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 3dxk h GLN 392 Cb 1.35 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.13 3dxk h GLN 392 CO 0.06 0.33 -0.09 1.33 -0.67 0.00 0.00 178.83 179.79 3dxk n VAL 393 N -3.20 0.00 -3.17 -0.54 0.24 -1.09 -4.95 118.33 105.62 3dxk n VAL 393 Ca 0.02 -0.39 -0.35 0.00 -2.04 0.00 0.00 64.34 61.58 3dxk n VAL 393 Cb 0.65 1.18 -0.06 0.00 -1.47 0.00 0.00 33.84 34.14 3dxk n VAL 393 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3dxk s HIS 395 N -1.57 3.30 0.76 0.00 0.09 -1.14 -4.86 115.29 111.87 3dxk s HIS 395 Ca 0.43 1.21 -0.09 0.00 -0.00 0.00 0.00 55.06 56.61 3dxk s HIS 395 Cb -0.15 -3.15 0.07 0.00 -0.00 0.00 0.00 32.58 29.34 3dxk s HIS 395 CO 0.20 -0.45 1.09 0.95 -0.00 0.00 0.00 174.74 176.53 3dxk s THR 396 N 2.99 2.14 0.14 1.30 -4.23 -1.26 -1.66 115.64 115.07 3dxk s THR 396 Ca 0.38 -0.15 -0.13 0.00 -1.18 0.00 0.00 61.69 60.61 3dxk s THR 396 Cb -0.15 -3.00 0.01 0.00 1.34 0.00 0.00 72.50 70.71 3dxk s THR 396 CO 0.08 0.00 1.62 0.50 -0.54 0.00 0.00 174.62 176.28 3dxk h LYS 397 N -0.82 0.79 -0.52 3.99 3.64 -1.46 -1.63 116.57 120.55 3dxk h LYS 397 Ca -0.45 -0.22 0.08 0.00 -1.27 0.00 0.00 60.65 58.79 3dxk h LYS 397 Cb 1.32 -0.09 -0.07 0.00 -0.41 0.00 0.00 32.23 32.99 3dxk h LYS 397 CO 0.62 0.81 0.15 -0.22 -2.27 0.00 0.00 179.45 178.54 3dxk h LYS 398 N 0.66 0.30 -0.29 1.90 3.64 -1.94 0.12 116.57 120.95 3dxk h LYS 398 Ca 0.14 -0.02 -0.07 0.00 -1.27 0.00 0.00 60.65 59.43 3dxk h LYS 398 Cb 0.41 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.15 3dxk h LYS 398 CO 0.01 0.20 -0.13 -0.44 -2.27 0.00 0.00 179.45 176.81 3dxk h ASP 399 N 0.31 0.48 -0.42 4.20 3.32 -1.90 -1.25 116.42 121.16 3dxk h ASP 399 Ca 0.26 -0.13 -0.02 0.00 0.02 0.00 0.00 57.03 57.16 3dxk h ASP 399 Cb 0.32 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 39.73 3dxk h ASP 399 CO -0.30 0.65 0.18 0.22 -1.72 0.00 0.00 179.24 178.27 3dxk h TYR 400 N 0.46 0.63 0.00 4.55 3.20 -0.03 -0.79 116.97 124.98 3dxk h TYR 400 Ca 0.08 -0.04 -0.11 0.00 3.14 0.00 0.00 58.73 61.80 3dxk h TYR 400 Cb 0.51 -0.19 -0.02 0.00 1.54 0.00 0.00 36.73 38.57 3dxk h TYR 400 CO 0.02 0.54 -0.52 0.93 -1.64 0.00 0.00 178.16 177.48 3dxk h GLU 401 N 0.54 0.00 -0.02 1.82 5.08 -0.56 0.65 114.58 122.09 3dxk h GLU 401 Ca 0.14 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.50 3dxk h GLU 401 Cb 0.17 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.42 3dxk h GLU 401 CO -0.01 0.52 -0.25 0.39 -1.00 0.00 0.00 179.01 178.66 3dxk n GLU 402 N -3.69 1.68 0.00 2.33 1.02 -0.50 -4.59 120.64 116.90 3dxk n GLU 402 Ca -0.01 -1.37 0.00 0.00 -0.02 0.00 0.00 57.16 55.77 3dxk n GLU 402 Cb 0.58 -1.44 0.00 0.00 -0.02 0.00 0.00 31.44 30.56 3dxk n GLU 402 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 3dxk n ILE 403 N 0.55 0.00 0.00 -3.67 5.41 -0.31 -5.05 119.36 116.29 3dxk n ILE 403 Ca 0.11 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.86 3dxk n ILE 403 Cb 0.50 0.06 0.00 0.00 -0.71 0.00 0.00 39.64 39.49 3dxk n ILE 403 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3dxk n GLY 404 N 0.36 0.89 0.25 7.39 0.00 0.22 -4.66 105.19 109.65 3dxk n GLY 404 Ca 0.00 -2.10 0.16 0.00 0.00 0.00 0.00 46.02 44.09 3dxk n GLY 404 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3dxk h PRO 405 N 0.00 0.00 0.00 1.61 0.13 -1.93 -3.07 132.00 128.74 3dxk h PRO 405 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 3dxk h PRO 405 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 3dxk h PRO 405 CO 0.00 0.00 0.00 -1.13 -0.23 0.00 0.00 178.00 176.64 3dxk n SER 406 N -2.90 0.38 0.18 1.44 3.41 -1.26 -1.64 113.62 113.23 3dxk n SER 406 Ca 0.01 0.66 0.04 0.00 -0.26 0.00 0.00 58.87 59.32 3dxk n SER 406 Cb 0.28 -0.71 0.33 0.00 -0.26 0.00 0.00 64.21 63.85 3dxk n SER 406 CO 0.00 0.00 0.00 0.16 -0.16 0.00 0.00 175.04 175.04 3dxk h ILE 407 N 0.00 1.02 -0.18 -1.33 3.07 -1.83 -2.92 117.51 115.34 3dxk h ILE 407 Ca 0.00 -1.55 0.00 0.00 1.55 0.00 0.00 64.86 64.86 3dxk h ILE 407 Cb 0.08 1.91 0.00 0.00 -0.27 0.00 0.00 36.82 38.53 3dxk h ILE 407 CO 0.00 0.40 0.00 0.00 -1.05 0.00 0.00 178.15 177.50 3dxk h ARG 409 N 1.05 0.13 -4.57 0.00 3.08 -1.68 -3.43 114.38 108.95 3dxk h ARG 409 Ca 0.00 -0.12 -0.60 0.00 0.07 0.00 0.00 59.98 59.33 3dxk h ARG 409 Cb 0.27 0.03 -0.37 0.00 0.08 0.00 0.00 29.97 29.98 3dxk h ARG 409 CO 0.01 0.84 -0.82 -1.58 -1.07 0.00 0.00 179.97 177.34 3dxk s HIS 410 N -3.36 2.22 -0.35 3.04 5.04 -1.25 -4.93 115.29 115.70 3dxk s HIS 410 Ca -0.02 -1.35 -0.07 0.00 -1.54 0.00 0.00 55.06 52.07 3dxk s HIS 410 Cb 0.11 -1.58 0.04 0.00 0.04 0.00 0.00 32.58 31.19 3dxk s HIS 410 CO 0.80 -0.69 0.13 -0.80 -2.34 0.00 0.00 174.74 171.84 3dxk s ASN 411 N 1.47 5.39 0.22 9.88 0.01 -1.26 -5.05 114.94 125.59 3dxk s ASN 411 Ca 0.02 -1.17 -0.32 0.00 -0.71 0.00 0.00 52.86 50.68 3dxk s ASN 411 Cb -0.14 -1.90 -0.12 0.00 0.41 0.00 0.00 41.25 39.50 3dxk s ASN 411 CO -0.09 -0.36 1.69 -2.84 -1.51 0.00 0.00 177.10 174.00 3dxk s PRO 412 N 1.42 4.13 0.29 -0.60 0.02 -1.26 -4.95 135.00 134.05 3dxk s PRO 412 Ca -0.01 2.59 -0.29 0.00 0.02 0.00 0.00 61.00 63.31 3dxk s PRO 412 Cb -0.20 -3.07 -0.10 0.00 0.02 0.00 0.00 34.50 31.16 3dxk s PRO 412 CO 0.03 -0.73 1.15 0.54 -0.33 0.00 0.00 177.00 177.67 3dxk s VAL 413 N 0.98 3.28 0.24 3.83 0.11 -1.26 -5.04 120.40 122.55 3dxk s VAL 413 Ca 0.73 1.29 -0.08 0.00 -2.93 0.00 0.00 61.98 60.99 3dxk s VAL 413 Cb -0.49 -3.82 -0.02 0.00 -1.53 0.00 0.00 36.38 30.52 3dxk s VAL 413 CO 0.35 0.31 0.36 -0.36 -3.33 0.00 0.00 175.10 172.43 3dxk s PHE 414 N -1.16 0.71 0.00 1.54 0.08 -1.26 -5.00 117.98 112.89 3dxk s PHE 414 Ca 0.46 -1.01 0.00 0.00 0.12 0.00 0.00 56.93 56.50 3dxk s PHE 414 Cb -0.34 -0.09 0.00 0.00 -0.57 0.00 0.00 43.02 42.02 3dxk s PHE 414 CO 0.44 -0.89 0.00 0.41 -0.10 0.00 0.00 175.22 175.08 3dxk n GLY 415 N -0.37 1.94 0.06 4.36 0.00 -1.26 -5.11 105.19 104.81 3dxk n GLY 415 Ca -0.00 -0.38 0.16 0.00 0.00 0.00 0.00 46.02 45.79 3dxk n GLY 415 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70