#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dxa s SER 2 N 0.00 4.78 0.27 1.61 1.04 -1.26 -3.73 113.70 116.41 3dxa s SER 2 Ca 0.00 -0.70 0.02 0.00 0.48 0.00 0.00 55.95 55.75 3dxa s SER 2 Cb 0.00 0.24 -0.04 0.00 0.10 0.00 0.00 66.02 66.32 3dxa s SER 2 CO 0.00 -1.57 0.15 -1.00 0.98 0.00 0.00 173.24 171.79 3dxa s HIS 3 N -2.86 1.50 0.06 5.02 4.02 -1.26 -4.89 115.29 116.87 3dxa s HIS 3 Ca 0.64 -1.35 -0.03 0.00 1.02 0.00 0.00 55.06 55.35 3dxa s HIS 3 Cb -0.05 -0.79 -0.03 0.00 -1.02 0.00 0.00 32.58 30.68 3dxa s HIS 3 CO 0.41 -0.53 0.02 -1.54 1.02 0.00 0.00 174.74 174.13 3dxa s SER 4 N -3.31 0.40 -0.01 1.40 1.04 -1.26 -2.02 113.70 109.93 3dxa s SER 4 Ca 0.37 -0.89 0.01 0.00 0.48 0.00 0.00 55.95 55.92 3dxa s SER 4 Cb 0.06 0.22 0.01 0.00 0.10 0.00 0.00 66.02 66.41 3dxa s SER 4 CO 0.16 -0.61 -0.02 -0.32 0.98 0.00 0.00 173.24 173.43 3dxa s MET 5 N -3.77 0.28 -0.11 4.02 -2.45 -0.51 -2.46 119.30 114.30 3dxa s MET 5 Ca 0.05 -0.05 -0.04 0.00 -1.25 0.00 0.00 55.69 54.40 3dxa s MET 5 Cb 0.06 -0.33 0.06 0.00 1.25 0.00 0.00 34.83 35.87 3dxa s MET 5 CO -0.10 -0.00 0.23 1.03 1.05 0.00 0.00 175.02 177.23 3dxa s ARG 6 N 0.31 0.12 0.03 4.11 1.81 -0.89 -1.45 118.95 122.98 3dxa s ARG 6 Ca -0.03 0.66 -0.04 0.00 -1.72 0.00 0.00 55.73 54.60 3dxa s ARG 6 Cb -0.06 -0.11 -0.04 0.00 -0.45 0.00 0.00 34.95 34.29 3dxa s ARG 6 CO -0.01 -0.27 0.25 0.71 -0.68 0.00 0.00 175.30 175.30 3dxa s TYR 7 N 2.19 3.55 -0.04 -0.53 1.51 -0.42 -0.80 117.35 122.81 3dxa s TYR 7 Ca -0.00 0.45 0.04 0.00 -1.01 0.00 0.00 57.07 56.55 3dxa s TYR 7 Cb -0.12 -1.90 -0.00 0.00 -0.11 0.00 0.00 41.96 39.83 3dxa s TYR 7 CO -0.08 0.60 -0.15 -0.06 -1.11 0.00 0.00 175.55 174.75 3dxa s PHE 8 N -1.39 1.52 0.05 2.71 0.40 0.44 -2.56 117.98 119.16 3dxa s PHE 8 Ca 0.30 -0.42 0.06 0.00 -0.60 0.00 0.00 56.93 56.27 3dxa s PHE 8 Cb -0.13 -1.03 -0.04 0.00 0.51 0.00 0.00 43.02 42.33 3dxa s PHE 8 CO 0.20 -0.14 -0.11 0.71 0.70 0.00 0.00 175.22 176.57 3dxa s TYR 9 N 0.06 2.73 -0.21 0.36 2.02 0.32 -1.86 117.35 120.76 3dxa s TYR 9 Ca -0.03 -0.15 -0.04 0.00 -0.37 0.00 0.00 57.07 56.48 3dxa s TYR 9 Cb -0.11 -1.50 0.07 0.00 -0.40 0.00 0.00 41.96 40.03 3dxa s TYR 9 CO 0.02 0.36 0.09 0.99 -1.57 0.00 0.00 175.55 175.44 3dxa s THR 10 N -1.06 0.09 -0.13 -0.71 2.01 -0.22 -2.35 115.64 113.27 3dxa s THR 10 Ca 0.18 -0.47 -0.05 0.00 0.31 0.00 0.00 61.69 61.66 3dxa s THR 10 Cb -0.11 -0.83 -0.04 0.00 0.01 0.00 0.00 72.50 71.53 3dxa s THR 10 CO 0.09 -0.41 0.05 0.00 -0.69 0.00 0.00 174.62 173.66 3dxa s ALA 11 N 2.04 3.44 -0.32 7.40 0.00 0.78 -1.19 121.76 133.91 3dxa s ALA 11 Ca 0.04 -0.75 -0.00 0.00 0.00 0.00 0.00 51.96 51.25 3dxa s ALA 11 Cb -0.16 -1.75 0.13 0.00 0.00 0.00 0.00 23.12 21.34 3dxa s ALA 11 CO -0.17 0.42 0.27 1.41 0.00 0.00 0.00 175.76 177.68 3dxa s MET 12 N -0.36 0.41 0.54 0.00 0.00 -0.42 -0.13 119.30 119.34 3dxa s MET 12 Ca 0.09 -0.58 -0.20 0.00 0.00 0.00 0.00 55.69 54.99 3dxa s MET 12 Cb -0.12 -0.87 -0.06 0.00 0.00 0.00 0.00 34.83 33.78 3dxa s MET 12 CO 0.02 -1.10 1.16 -1.54 0.00 0.00 0.00 175.02 173.56 3dxa s SER 13 N 1.88 5.70 -0.46 1.11 1.04 -0.37 -2.44 113.70 120.16 3dxa s SER 13 Ca 0.13 2.26 0.05 0.00 0.48 0.00 0.00 55.95 58.86 3dxa s SER 13 Cb -0.16 -2.59 0.25 0.00 0.10 0.00 0.00 66.02 63.62 3dxa s SER 13 CO -0.21 -1.24 0.95 -2.11 0.98 0.00 0.00 173.24 171.62 3dxa n ARG 14 N -1.18 0.67 -2.67 4.02 1.85 -1.26 -3.50 116.66 114.59 3dxa n ARG 14 Ca 0.11 -1.56 -0.40 0.00 -1.00 0.00 0.00 57.85 55.00 3dxa n ARG 14 Cb 0.50 -1.25 -0.05 0.00 -1.05 0.00 0.00 32.46 30.61 3dxa n ARG 14 CO 0.00 0.00 0.00 -1.25 -0.01 0.00 0.00 177.63 176.37 3dxa s PRO 15 N 0.59 4.78 0.00 2.89 0.04 -1.26 -2.41 135.00 139.63 3dxa s PRO 15 Ca 0.31 1.58 0.00 0.00 0.04 0.00 0.00 61.00 62.93 3dxa s PRO 15 Cb 0.23 -3.24 0.00 0.00 0.04 0.00 0.00 34.50 31.53 3dxa s PRO 15 CO -0.22 0.42 0.00 0.41 0.04 0.00 0.00 177.00 177.65 3dxa n GLY 16 N 1.37 2.58 1.71 0.56 0.00 -1.26 -4.79 105.19 105.36 3dxa n GLY 16 Ca -0.02 -0.58 -0.13 0.00 0.00 0.00 0.00 46.02 45.30 3dxa n GLY 16 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dxa n ARG 17 N 0.00 1.65 0.00 1.61 1.74 -1.01 -4.95 116.66 115.70 3dxa n ARG 17 Ca 0.00 -1.39 0.00 0.00 -0.77 0.00 0.00 57.85 55.69 3dxa n ARG 17 Cb 0.00 -1.54 0.00 0.00 -1.02 0.00 0.00 32.46 29.90 3dxa n ARG 17 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3dxa n GLY 18 N 0.12 3.64 3.49 -0.13 0.00 -1.22 -4.98 105.19 106.12 3dxa n GLY 18 Ca 0.27 -1.72 -0.36 0.00 0.00 0.00 0.00 46.02 44.20 3dxa n GLY 18 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3dxa n GLU 19 N -1.24 0.36 -1.61 1.61 -0.58 -1.26 -4.29 120.64 113.61 3dxa n GLU 19 Ca 0.00 0.16 -0.36 0.00 -0.42 0.00 0.00 57.16 56.54 3dxa n GLU 19 Cb 0.00 -1.87 0.08 0.00 -0.57 0.00 0.00 31.44 29.08 3dxa n GLU 19 CO 0.00 0.00 0.00 -2.14 -0.48 0.00 0.00 177.13 174.51 3dxa s PRO 20 N -2.76 2.36 0.06 3.49 0.02 -1.26 -4.83 135.00 132.08 3dxa s PRO 20 Ca 0.67 2.01 -0.10 0.00 0.02 0.00 0.00 61.00 63.61 3dxa s PRO 20 Cb -0.36 -1.83 -0.06 0.00 0.02 0.00 0.00 34.50 32.28 3dxa s PRO 20 CO 0.56 -1.73 0.37 0.50 -0.33 0.00 0.00 177.00 176.38 3dxa s ARG 21 N -3.53 3.74 -0.09 5.54 3.52 -1.02 -4.94 118.95 122.17 3dxa s ARG 21 Ca 0.81 0.15 -0.01 0.00 -0.13 0.00 0.00 55.73 56.55 3dxa s ARG 21 Cb -0.36 -3.03 0.03 0.00 -1.56 0.00 0.00 34.95 30.02 3dxa s ARG 21 CO 0.42 0.59 -0.03 0.12 -0.81 0.00 0.00 175.30 175.59 3dxa s PHE 22 N -1.35 0.96 -0.04 5.12 5.36 -1.26 -1.30 117.98 125.48 3dxa s PHE 22 Ca 0.31 -0.37 0.06 0.00 -0.96 0.00 0.00 56.93 55.97 3dxa s PHE 22 Cb -0.14 -0.95 -0.02 0.00 -0.34 0.00 0.00 43.02 41.57 3dxa s PHE 22 CO 0.17 -0.39 -0.21 0.42 -1.46 0.00 0.00 175.22 173.75 3dxa s ILE 23 N 1.83 2.46 -0.06 3.12 1.01 -0.33 -2.13 121.20 127.10 3dxa s ILE 23 Ca 0.04 -0.95 0.03 0.00 0.00 0.00 0.00 60.65 59.78 3dxa s ILE 23 Cb -0.12 -1.90 0.00 0.00 0.01 0.00 0.00 42.46 40.45 3dxa s ILE 23 CO -0.06 0.58 -0.16 -0.89 0.00 0.00 0.00 174.94 174.42 3dxa s THR 24 N -0.62 1.35 0.03 2.92 2.01 0.51 -1.06 115.64 120.78 3dxa s THR 24 Ca 0.10 -0.64 0.06 0.00 0.31 0.00 0.00 61.69 61.52 3dxa s THR 24 Cb -0.11 -1.19 -0.02 0.00 0.01 0.00 0.00 72.50 71.19 3dxa s THR 24 CO -0.00 0.40 -0.18 0.68 -0.69 0.00 0.00 174.62 174.82 3dxa s VAL 25 N 0.34 1.46 -0.11 3.82 -7.23 -0.78 0.19 120.40 118.10 3dxa s VAL 25 Ca -0.10 -1.04 0.02 0.00 -1.81 0.00 0.00 61.98 59.05 3dxa s VAL 25 Cb -0.14 -1.27 0.01 0.00 0.56 0.00 0.00 36.38 35.55 3dxa s VAL 25 CO 0.04 0.21 -0.15 -0.83 -0.31 0.00 0.00 175.10 174.05 3dxa s GLY 26 N -0.97 1.04 0.17 2.32 0.00 0.37 -0.42 107.32 109.83 3dxa s GLY 26 Ca 0.06 -0.73 0.08 0.00 0.00 0.00 0.00 44.72 44.13 3dxa s GLY 26 CO 0.01 0.24 -0.06 -0.19 0.00 0.00 0.00 173.10 173.10 3dxa s TYR 27 N 1.01 2.72 -0.09 1.90 1.51 0.02 -0.83 117.35 123.59 3dxa s TYR 27 Ca -0.06 -0.18 0.02 0.00 -1.01 0.00 0.00 57.07 55.83 3dxa s TYR 27 Cb -0.15 -1.34 0.01 0.00 -0.11 0.00 0.00 41.96 40.38 3dxa s TYR 27 CO -0.02 0.50 -0.14 0.08 -1.11 0.00 0.00 175.55 174.87 3dxa s VAL 28 N -1.65 1.31 0.00 0.71 1.01 -0.28 -2.10 120.40 119.40 3dxa s VAL 28 Ca 0.25 -0.55 0.00 0.00 0.00 0.00 0.00 61.98 61.68 3dxa s VAL 28 Cb -0.09 -1.20 0.00 0.00 0.00 0.00 0.00 36.38 35.08 3dxa s VAL 28 CO 0.16 0.40 0.00 0.47 0.00 0.00 0.00 175.10 176.13 3dxa n ASP 29 N 4.04 0.00 -1.51 3.32 8.00 -1.03 0.08 116.55 129.45 3dxa n ASP 29 Ca -0.20 0.00 -0.05 0.00 0.71 0.00 0.00 54.79 55.24 3dxa n ASP 29 Cb 0.51 0.00 0.24 0.00 -0.02 0.00 0.00 41.12 41.85 3dxa n ASP 29 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 3dxa n ASP 30 N 4.28 3.61 -4.37 -2.24 8.00 -1.26 -4.92 116.55 119.65 3dxa n ASP 30 Ca 0.00 -3.45 -0.38 0.00 0.71 0.00 0.00 54.79 51.67 3dxa n ASP 30 Cb 0.00 -0.68 -0.12 0.00 -0.02 0.00 0.00 41.12 40.30 3dxa n ASP 30 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3dxa s THR 31 N -3.11 4.28 0.02 -3.53 2.01 0.11 -5.03 115.64 110.39 3dxa s THR 31 Ca 0.49 -0.70 -0.30 0.00 0.31 0.00 0.00 61.69 61.49 3dxa s THR 31 Cb 0.42 -3.26 -0.04 0.00 0.01 0.00 0.00 72.50 69.62 3dxa s THR 31 CO 0.07 -0.03 1.15 -0.22 -0.69 0.00 0.00 174.62 174.91 3dxa s LEU 32 N 1.53 4.35 0.00 4.42 2.96 -1.26 -1.12 118.68 129.56 3dxa s LEU 32 Ca 0.03 1.89 0.00 0.00 -0.22 0.00 0.00 54.13 55.83 3dxa s LEU 32 Cb -0.18 -3.57 0.00 0.00 0.50 0.00 0.00 46.19 42.94 3dxa s LEU 32 CO 0.05 -0.46 0.00 2.22 -1.32 0.00 0.00 176.35 176.84 3dxa n PHE 33 N 4.26 0.00 -3.78 5.38 1.16 -0.01 -3.76 117.46 120.71 3dxa n PHE 33 Ca 0.09 0.00 -0.13 0.00 -1.87 0.00 0.00 57.45 55.54 3dxa n PHE 33 Cb 0.47 0.00 -0.12 0.00 -1.61 0.00 0.00 39.48 38.22 3dxa n PHE 33 CO 0.00 0.00 0.00 0.54 -1.87 0.00 0.00 176.76 175.43 3dxa s VAL 34 N -1.21 -0.01 0.00 1.97 0.11 -1.17 -0.86 120.40 119.22 3dxa s VAL 34 Ca 0.00 0.04 0.03 0.00 -2.93 0.00 0.00 61.98 59.12 3dxa s VAL 34 Cb 0.00 -0.33 -0.01 0.00 -1.53 0.00 0.00 36.38 34.51 3dxa s VAL 34 CO 0.00 0.02 -0.10 -0.60 -3.33 0.00 0.00 175.10 171.09 3dxa s ARG 35 N 0.39 0.78 -0.01 1.54 3.52 -0.49 -0.48 118.95 124.20 3dxa s ARG 35 Ca -0.02 -0.41 0.00 0.00 -0.13 0.00 0.00 55.73 55.17 3dxa s ARG 35 Cb -0.04 -0.75 0.01 0.00 -1.56 0.00 0.00 34.95 32.62 3dxa s ARG 35 CO -0.02 0.20 0.01 0.12 -0.81 0.00 0.00 175.30 174.80 3dxa s PHE 36 N -0.35 0.07 -0.13 5.12 5.36 0.13 -0.27 117.98 127.91 3dxa s PHE 36 Ca 0.03 0.04 -0.04 0.00 -0.96 0.00 0.00 56.93 55.99 3dxa s PHE 36 Cb -0.04 -0.14 0.07 0.00 -0.34 0.00 0.00 43.02 42.56 3dxa s PHE 36 CO -0.00 -0.04 0.23 0.34 -1.46 0.00 0.00 175.22 174.28 3dxa s ASP 37 N 0.46 0.65 -0.03 6.13 -1.08 -1.26 -0.36 116.67 121.18 3dxa s ASP 37 Ca -0.04 0.37 -0.05 0.00 -0.52 0.00 0.00 52.55 52.31 3dxa s ASP 37 Cb -0.06 0.52 -0.21 0.00 -1.46 0.00 0.00 42.92 41.71 3dxa s ASP 37 CO -0.01 -0.26 3.35 -1.54 0.52 0.00 0.00 175.17 177.23 3dxa n SER 38 N 5.34 5.35 -2.69 -0.34 3.41 -0.91 -4.05 113.62 119.74 3dxa n SER 38 Ca -0.05 -2.53 -0.08 0.00 -0.26 0.00 0.00 58.87 55.95 3dxa n SER 38 Cb 0.50 -1.37 0.05 0.00 -0.26 0.00 0.00 64.21 63.13 3dxa n SER 38 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3dxa n ASP 39 N 2.24 0.91 0.04 4.04 9.92 -1.26 -4.76 116.55 127.68 3dxa n ASP 39 Ca 0.38 -2.59 -0.02 0.00 -0.53 0.00 0.00 54.79 52.03 3dxa n ASP 39 Cb 0.84 -0.28 -0.01 0.00 -0.64 0.00 0.00 41.12 41.03 3dxa n ASP 39 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3dxa h ALA 40 N 2.77 -0.91 -0.07 2.24 0.00 -2.00 -3.46 119.26 117.83 3dxa h ALA 40 Ca -0.14 -0.02 -0.21 0.00 0.00 0.00 0.00 54.91 54.54 3dxa h ALA 40 Cb 1.21 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.04 3dxa h ALA 40 CO 0.37 -0.90 -0.82 1.79 0.00 0.00 0.00 179.25 179.69 3dxa h THR 41 N -0.11 1.36 -3.71 0.00 1.35 -1.98 -3.45 112.91 106.37 3dxa h THR 41 Ca -0.01 -2.20 -0.68 0.00 -0.55 0.00 0.00 66.41 62.97 3dxa h THR 41 Cb 0.08 2.19 -0.35 0.00 -1.73 0.00 0.00 68.15 68.34 3dxa h THR 41 CO 0.02 0.67 -0.68 -0.55 -0.25 0.00 0.00 175.52 174.72 3dxa s SER 42 N -7.05 4.90 0.50 5.36 0.15 -1.26 -5.11 113.70 111.19 3dxa s SER 42 Ca -0.07 -1.58 -0.13 0.00 0.70 0.00 0.00 55.95 54.87 3dxa s SER 42 Cb 0.09 -1.71 -0.06 0.00 -1.71 0.00 0.00 66.02 62.63 3dxa s SER 42 CO 0.87 -0.33 0.92 -2.16 1.20 0.00 0.00 173.24 173.73 3dxa s PRO 43 N 1.16 3.80 0.00 5.44 0.04 -1.26 -5.06 135.00 139.11 3dxa s PRO 43 Ca -0.00 0.72 0.00 0.00 0.04 0.00 0.00 61.00 61.75 3dxa s PRO 43 Cb -0.20 -2.22 0.00 0.00 0.04 0.00 0.00 34.50 32.12 3dxa s PRO 43 CO -0.03 -0.26 0.00 2.89 0.04 0.00 0.00 177.00 179.64 3dxa n ARG 44 N -1.79 0.00 -1.69 4.56 1.85 -1.26 -5.09 116.66 113.24 3dxa n ARG 44 Ca 0.05 0.00 -0.42 0.00 -1.00 0.00 0.00 57.85 56.48 3dxa n ARG 44 Cb 0.54 0.00 -0.03 0.00 -1.05 0.00 0.00 32.46 31.92 3dxa n ARG 44 CO 0.00 0.00 0.00 1.63 -0.01 0.00 0.00 177.63 179.25 3dxa n LYS 45 N -0.01 2.83 -4.31 2.89 4.76 -1.26 -4.68 118.16 118.37 3dxa n LYS 45 Ca 0.00 1.03 -0.31 0.00 -2.87 0.00 0.00 58.31 56.16 3dxa n LYS 45 Cb 0.00 -2.93 -0.10 0.00 -1.84 0.00 0.00 35.03 30.16 3dxa n LYS 45 CO 0.00 0.00 0.00 -1.21 -1.37 0.00 0.00 177.40 174.82 3dxa s GLU 46 N 2.85 2.31 -0.23 1.97 2.02 0.63 -4.94 118.70 123.31 3dxa s GLU 46 Ca 0.82 -0.90 -0.18 0.00 0.02 0.00 0.00 54.97 54.73 3dxa s GLU 46 Cb -0.47 -2.39 -0.03 0.00 0.10 0.00 0.00 34.13 31.34 3dxa s GLU 46 CO 0.37 0.54 0.50 -1.25 0.02 0.00 0.00 175.26 175.45 3dxa s PRO 47 N -1.95 4.12 -0.00 0.39 0.04 -1.26 -1.40 135.00 134.94 3dxa s PRO 47 Ca 0.20 0.34 0.10 0.00 0.04 0.00 0.00 61.00 61.69 3dxa s PRO 47 Cb -0.11 -3.61 -0.12 0.00 0.04 0.00 0.00 34.50 30.70 3dxa s PRO 47 CO 0.12 -0.25 0.42 0.54 0.04 0.00 0.00 177.00 177.88 3dxa n ARG 48 N 5.16 3.27 -4.09 4.56 5.12 -0.04 -4.96 116.66 125.68 3dxa n ARG 48 Ca -0.05 -0.01 -0.30 0.00 -1.93 0.00 0.00 57.85 55.56 3dxa n ARG 48 Cb 0.50 -1.01 -0.07 0.00 -1.16 0.00 0.00 32.46 30.71 3dxa n ARG 48 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 3dxa s ALA 49 N -2.05 3.42 0.11 7.54 0.00 -1.19 -4.77 121.76 124.83 3dxa s ALA 49 Ca 0.03 -1.06 0.15 0.00 0.00 0.00 0.00 51.96 51.08 3dxa s ALA 49 Cb 0.08 -1.31 0.39 0.00 0.00 0.00 0.00 23.12 22.27 3dxa s ALA 49 CO 0.43 0.72 1.60 -1.00 0.00 0.00 0.00 175.76 177.51 3dxa h PRO 50 N 3.39 0.00 0.00 0.00 0.13 -1.93 -3.16 132.00 130.43 3dxa h PRO 50 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 3dxa h PRO 50 Cb 1.16 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 3dxa h PRO 50 CO 0.63 0.52 -0.02 -2.67 -0.23 0.00 0.00 178.00 176.22 3dxa n TRP 51 N -3.49 0.66 -0.01 1.56 4.27 -1.26 -3.27 117.44 115.91 3dxa n TRP 51 Ca 0.00 0.19 -0.07 0.00 -3.89 0.00 0.00 57.50 53.73 3dxa n TRP 51 Cb 0.63 -0.81 -0.13 0.00 -1.36 0.00 0.00 31.31 29.64 3dxa n TRP 51 CO 0.00 0.00 0.00 0.97 -2.29 0.00 0.00 177.69 176.37 3dxa h ILE 52 N 0.00 0.83 -0.98 -1.67 6.09 -1.90 -3.36 117.51 116.51 3dxa h ILE 52 Ca 0.00 -2.61 0.30 0.00 -1.37 0.00 0.00 64.86 61.18 3dxa h ILE 52 Cb 0.67 2.37 -0.15 0.00 0.47 0.00 0.00 36.82 40.19 3dxa h ILE 52 CO 0.00 0.47 0.51 -0.33 -3.07 0.00 0.00 178.15 175.73 3dxa h GLU 53 N 0.00 0.32 -5.18 2.19 5.08 -1.56 -3.15 114.58 112.27 3dxa h GLU 53 Ca -0.25 -0.02 -0.65 0.00 -1.00 0.00 0.00 59.36 57.45 3dxa h GLU 53 Cb 1.92 -0.07 -0.05 0.00 0.50 0.00 0.00 28.75 31.04 3dxa h GLU 53 CO 0.08 0.21 2.35 0.00 -1.00 0.00 0.00 179.01 180.64 3dxa n GLN 54 N -5.07 2.79 -4.10 2.33 10.64 -1.26 -4.87 117.38 117.83 3dxa n GLN 54 Ca 0.29 -2.89 -0.10 0.00 -1.83 0.00 0.00 57.00 52.48 3dxa n GLN 54 Cb 0.91 -3.43 -0.09 0.00 -0.86 0.00 0.00 30.24 26.77 3dxa n GLN 54 CO 0.00 0.00 0.00 -1.21 -1.83 0.00 0.00 177.06 174.02 3dxa s GLU 55 N 4.26 1.03 0.73 2.61 0.41 -1.19 -5.09 118.70 121.46 3dxa s GLU 55 Ca 0.54 -1.39 -0.14 0.00 -0.41 0.00 0.00 54.97 53.57 3dxa s GLU 55 Cb 0.07 0.28 0.04 0.00 -1.78 0.00 0.00 34.13 32.74 3dxa s GLU 55 CO 0.04 -0.32 1.14 0.20 -0.49 0.00 0.00 175.26 175.82 3dxa s GLY 56 N -3.04 2.06 0.37 -1.39 0.00 -1.26 -4.93 107.32 99.13 3dxa s GLY 56 Ca 0.24 0.59 0.17 0.00 0.00 0.00 0.00 44.72 45.73 3dxa s GLY 56 CO 0.03 0.97 1.76 -2.55 0.00 0.00 0.00 173.10 173.31 3dxa h PRO 57 N -0.51 0.00 0.00 2.90 0.11 -2.00 -2.65 132.00 129.85 3dxa h PRO 57 Ca -0.46 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.60 3dxa h PRO 57 Cb 1.26 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.36 3dxa h PRO 57 CO 0.51 0.38 -0.23 0.93 -0.21 0.00 0.00 178.00 179.38 3dxa h GLU 58 N 0.00 0.00 -0.44 1.05 5.08 -2.00 -1.51 114.58 116.76 3dxa h GLU 58 Ca -0.00 0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.32 3dxa h GLU 58 Cb 0.83 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.07 3dxa h GLU 58 CO 0.05 0.23 0.12 -0.92 -1.00 0.00 0.00 179.01 177.48 3dxa h TYR 59 N 0.00 0.73 -0.29 4.33 3.20 -1.84 -2.85 116.97 120.25 3dxa h TYR 59 Ca -0.00 -0.08 -0.15 0.00 3.14 0.00 0.00 58.73 61.63 3dxa h TYR 59 Cb 0.56 -0.21 -0.01 0.00 1.54 0.00 0.00 36.73 38.61 3dxa h TYR 59 CO 0.00 0.67 -0.43 -1.49 -1.64 0.00 0.00 178.16 175.27 3dxa h TRP 60 N 0.57 0.89 0.16 -3.82 4.06 -1.36 -2.33 115.95 114.12 3dxa h TRP 60 Ca 0.14 -0.28 -0.01 0.00 2.06 0.00 0.00 58.89 60.81 3dxa h TRP 60 Cb 0.30 -0.18 -0.00 0.00 -1.00 0.00 0.00 29.16 28.28 3dxa h TRP 60 CO 0.02 1.04 -0.08 -0.44 -3.56 0.00 0.00 178.44 175.41 3dxa h ASP 61 N 0.60 -0.20 -0.56 -3.49 5.19 -1.35 0.26 116.42 116.87 3dxa h ASP 61 Ca 0.04 0.01 0.09 0.00 -0.62 0.00 0.00 57.03 56.55 3dxa h ASP 61 Cb 0.99 0.06 -0.11 0.00 0.18 0.00 0.00 39.33 40.45 3dxa h ASP 61 CO 0.09 -0.14 -0.39 0.03 -3.12 0.00 0.00 179.24 175.72 3dxa h ARG 62 N -0.22 -0.20 -0.43 3.56 3.08 -1.47 -1.07 114.38 117.63 3dxa h ARG 62 Ca -0.02 0.01 -0.12 0.00 0.07 0.00 0.00 59.98 59.93 3dxa h ARG 62 Cb 0.18 0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.26 3dxa h ARG 62 CO 0.03 -0.14 -0.19 0.93 -1.07 0.00 0.00 179.97 179.53 3dxa h GLU 63 N -0.21 0.85 0.66 0.04 4.39 -0.87 -1.23 114.58 118.21 3dxa h GLU 63 Ca 0.20 -0.34 -0.03 0.00 0.34 0.00 0.00 59.36 59.53 3dxa h GLU 63 Cb 0.56 -0.04 0.01 0.00 -0.10 0.00 0.00 28.75 29.17 3dxa h GLU 63 CO -0.67 0.97 -0.32 1.15 -1.16 0.00 0.00 179.01 178.99 3dxa h THR 64 N 0.75 0.24 -0.43 1.13 2.02 -0.24 -2.75 112.91 113.63 3dxa h THR 64 Ca 0.11 -0.24 0.12 0.00 0.77 0.00 0.00 66.41 67.17 3dxa h THR 64 Cb 0.72 0.30 -0.02 0.00 -1.74 0.00 0.00 68.15 67.42 3dxa h THR 64 CO 0.06 0.02 0.37 -0.61 0.37 0.00 0.00 175.52 175.73 3dxa h GLN 65 N -1.07 0.00 0.28 6.66 4.15 -1.01 0.53 115.11 124.65 3dxa h GLN 65 Ca -0.09 0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.32 3dxa h GLN 65 Cb 0.72 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.41 3dxa h GLN 65 CO 0.15 0.00 -0.13 0.82 -1.93 0.00 0.00 178.83 177.74 3dxa h ILE 66 N 0.00 0.77 -0.11 2.39 2.04 -1.14 -1.30 117.51 120.16 3dxa h ILE 66 Ca 0.20 -0.48 -0.15 0.00 1.00 0.00 0.00 64.86 65.43 3dxa h ILE 66 Cb 0.94 1.03 -0.01 0.00 -0.74 0.00 0.00 36.82 38.04 3dxa h ILE 66 CO -0.00 0.10 -0.60 0.28 0.00 0.00 0.00 178.15 177.93 3dxa h SER 67 N -0.63 0.40 -0.77 1.72 0.02 -0.27 0.42 113.55 114.45 3dxa h SER 67 Ca -0.04 -0.23 -0.03 0.00 -0.84 0.00 0.00 61.79 60.65 3dxa h SER 67 Cb 0.45 -0.12 -0.03 0.00 0.14 0.00 0.00 62.40 62.84 3dxa h SER 67 CO 0.06 0.90 0.35 0.11 -1.14 0.00 0.00 176.83 177.11 3dxa h LYS 68 N 0.26 1.12 0.60 3.45 1.57 -0.19 0.23 116.57 123.62 3dxa h LYS 68 Ca -0.00 -0.18 -0.03 0.00 -1.87 0.00 0.00 60.65 58.57 3dxa h LYS 68 Cb 1.12 -0.19 -0.00 0.00 0.08 0.00 0.00 32.23 33.23 3dxa h LYS 68 CO 0.10 0.88 -0.33 1.15 -0.57 0.00 0.00 179.45 180.68 3dxa h THR 69 N 1.09 0.32 -0.08 -0.16 2.02 -0.95 -2.88 112.91 112.27 3dxa h THR 69 Ca 0.26 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.46 3dxa h THR 69 Cb 0.15 0.32 -0.00 0.00 -1.74 0.00 0.00 68.15 66.88 3dxa h THR 69 CO -0.03 0.00 0.12 0.78 0.37 0.00 0.00 175.52 176.76 3dxa h ASN 70 N -0.87 0.00 0.11 4.18 -0.26 -0.45 -0.50 115.58 117.79 3dxa h ASN 70 Ca -0.08 0.00 0.02 0.00 -0.56 0.00 0.00 56.30 55.68 3dxa h ASN 70 Cb 0.69 0.00 -0.04 0.00 -1.06 0.00 0.00 38.32 37.90 3dxa h ASN 70 CO 0.10 0.00 -0.39 0.74 -1.06 0.00 0.00 177.43 176.83 3dxa h THR 71 N 0.00 0.21 0.13 2.81 2.02 -0.32 -2.29 112.91 115.47 3dxa h THR 71 Ca 0.04 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.21 3dxa h THR 71 Cb 0.28 0.21 0.00 0.00 -1.74 0.00 0.00 68.15 66.90 3dxa h THR 71 CO -0.00 0.00 -0.06 1.56 0.37 0.00 0.00 175.52 177.39 3dxa h GLN 72 N -0.61 -0.17 -0.96 6.66 1.08 -1.17 -2.80 115.11 117.13 3dxa h GLN 72 Ca 0.03 0.01 0.28 0.00 -1.45 0.00 0.00 58.65 57.52 3dxa h GLN 72 Cb 0.65 0.04 -0.14 0.00 -0.05 0.00 0.00 27.48 27.98 3dxa h GLN 72 CO -0.23 0.16 0.46 1.15 -0.95 0.00 0.00 178.83 179.41 3dxa h THR 73 N -0.52 0.35 0.14 -0.54 2.02 -1.32 -0.43 112.91 112.61 3dxa h THR 73 Ca -0.02 -0.11 -0.29 0.00 0.77 0.00 0.00 66.41 66.76 3dxa h THR 73 Cb 0.41 -0.01 0.01 0.00 -1.74 0.00 0.00 68.15 66.82 3dxa h THR 73 CO 0.03 0.06 -1.35 1.88 0.37 0.00 0.00 175.52 176.51 3dxa h TYR 74 N 0.33 0.55 -0.92 3.16 -1.99 -1.41 -1.35 116.97 115.35 3dxa h TYR 74 Ca 0.65 -0.40 0.18 0.00 2.00 0.00 0.00 58.73 61.16 3dxa h TYR 74 Cb 1.39 -0.02 -0.08 0.00 2.00 0.00 0.00 36.73 40.03 3dxa h TYR 74 CO -0.10 1.35 0.59 0.00 -0.00 0.00 0.00 178.16 180.00 3dxa h ARG 75 N 0.08 0.57 0.13 4.88 3.08 -0.83 0.68 114.38 122.97 3dxa h ARG 75 Ca -0.18 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 59.83 3dxa h ARG 75 Cb 2.01 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 31.93 3dxa h ARG 75 CO 0.20 0.38 -0.06 0.93 -1.07 0.00 0.00 179.97 180.35 3dxa h GLU 76 N 0.59 -0.17 -0.60 0.04 5.08 -1.24 -3.21 114.58 115.07 3dxa h GLU 76 Ca 0.48 0.01 0.07 0.00 -1.00 0.00 0.00 59.36 58.92 3dxa h GLU 76 Cb 0.93 0.04 -0.04 0.00 0.50 0.00 0.00 28.75 30.19 3dxa h GLU 76 CO -0.22 0.18 0.40 -0.91 -1.00 0.00 0.00 179.01 177.46 3dxa h ASN 77 N -0.54 0.50 -0.34 1.42 -0.26 0.38 0.11 115.58 116.84 3dxa h ASN 77 Ca -0.02 0.00 -0.05 0.00 -0.56 0.00 0.00 56.30 55.67 3dxa h ASN 77 Cb 0.43 -0.10 -0.02 0.00 -1.06 0.00 0.00 38.32 37.56 3dxa h ASN 77 CO 0.03 0.32 0.05 -0.07 -1.06 0.00 0.00 177.43 176.70 3dxa h LEU 78 N 0.56 0.63 0.09 1.61 3.38 0.16 -2.08 115.31 119.66 3dxa h LEU 78 Ca 0.26 -0.12 -0.27 0.00 0.09 0.00 0.00 57.88 57.84 3dxa h LEU 78 Cb 0.31 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 40.88 3dxa h LEU 78 CO -0.08 0.67 -1.33 0.03 0.09 0.00 0.00 178.44 177.81 3dxa h ARG 79 N 0.64 0.18 -0.03 1.13 3.08 -1.02 -2.97 114.38 115.40 3dxa h ARG 79 Ca 0.14 -0.31 -0.05 0.00 0.07 0.00 0.00 59.98 59.83 3dxa h ARG 79 Cb 0.33 0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.49 3dxa h ARG 79 CO 0.01 1.08 -0.21 1.15 -1.07 0.00 0.00 179.97 180.93 3dxa h THR 80 N 0.05 1.16 -0.12 2.04 2.02 -0.82 -2.51 112.91 114.73 3dxa h THR 80 Ca -0.16 -0.77 -0.01 0.00 0.77 0.00 0.00 66.41 66.24 3dxa h THR 80 Cb 1.95 1.38 -0.01 0.00 -1.74 0.00 0.00 68.15 69.73 3dxa h THR 80 CO 0.16 0.22 0.05 0.00 0.37 0.00 0.00 175.52 176.33 3dxa h ALA 81 N 1.75 0.16 -0.99 6.16 0.00 -1.33 -2.87 119.26 122.13 3dxa h ALA 81 Ca 0.01 -0.09 0.18 0.00 0.00 0.00 0.00 54.91 55.00 3dxa h ALA 81 Cb 0.39 -0.05 -0.10 0.00 0.00 0.00 0.00 17.79 18.04 3dxa h ALA 81 CO 0.03 -0.26 0.62 -0.07 0.00 0.00 0.00 179.25 179.56 3dxa h LEU 82 N 0.04 0.78 -0.29 0.00 -0.00 -1.29 -0.82 115.31 113.74 3dxa h LEU 82 Ca 0.04 0.08 -0.08 0.00 -0.00 0.00 0.00 57.88 57.92 3dxa h LEU 82 Cb 0.16 -0.06 -0.01 0.00 -0.00 0.00 0.00 40.66 40.75 3dxa h LEU 82 CO -0.00 0.31 -0.12 0.03 -0.00 0.00 0.00 178.44 178.66 3dxa h ARG 83 N 0.78 0.59 -0.38 1.13 3.08 -1.46 0.12 114.38 118.23 3dxa h ARG 83 Ca 0.55 -0.25 -0.00 0.00 0.07 0.00 0.00 59.98 60.35 3dxa h ARG 83 Cb 0.84 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 30.85 3dxa h ARG 83 CO -0.33 0.81 0.23 1.88 -1.07 0.00 0.00 179.97 181.49 3dxa h TYR 84 N 0.34 0.50 -0.02 3.04 0.05 -1.04 -3.05 116.97 116.79 3dxa h TYR 84 Ca 0.07 -0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.84 3dxa h TYR 84 Cb 0.63 -0.17 0.00 0.00 1.01 0.00 0.00 36.73 38.20 3dxa h TYR 84 CO 0.06 0.36 0.00 0.66 -1.05 0.00 0.00 178.16 178.19 3dxa n TYR 85 N -4.78 0.01 -2.75 4.88 4.02 -0.42 -4.95 117.16 113.17 3dxa n TYR 85 Ca -0.00 -0.00 -0.21 0.00 -0.01 0.00 0.00 57.90 57.67 3dxa n TYR 85 Cb 0.06 0.00 0.02 0.00 -0.02 0.00 0.00 39.34 39.39 3dxa n TYR 85 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 176.86 175.94 3dxa n ASN 86 N 0.46 -5.98 -4.83 7.72 3.02 0.17 -4.96 115.26 110.86 3dxa n ASN 86 Ca 0.18 -0.18 -0.33 0.00 -0.03 0.00 0.00 54.58 54.22 3dxa n ASN 86 Cb 0.41 -4.87 -0.06 0.00 -0.61 0.00 0.00 39.78 34.65 3dxa n ASN 86 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 3dxa s GLN 87 N -5.41 4.13 0.60 3.52 -0.21 0.17 -5.01 119.66 117.45 3dxa s GLN 87 Ca 0.18 0.86 -0.19 0.00 0.02 0.00 0.00 55.36 56.23 3dxa s GLN 87 Cb -0.08 -2.45 -0.03 0.00 1.00 0.00 0.00 33.01 31.45 3dxa s GLN 87 CO 0.22 0.15 1.25 -1.54 -2.12 0.00 0.00 175.29 173.25 3dxa s SER 88 N -2.12 5.02 0.21 5.90 1.04 -1.26 -4.85 113.70 117.64 3dxa s SER 88 Ca 0.54 2.51 -0.01 0.00 0.48 0.00 0.00 55.95 59.48 3dxa s SER 88 Cb -0.11 -2.61 0.19 0.00 0.10 0.00 0.00 66.02 63.59 3dxa s SER 88 CO 0.17 -1.71 1.55 -0.33 0.98 0.00 0.00 173.24 173.90 3dxa h GLU 89 N 0.87 0.47 0.00 4.02 5.08 -1.99 -3.20 114.58 119.83 3dxa h GLU 89 Ca -0.51 -0.28 -0.04 0.00 -1.00 0.00 0.00 59.36 57.53 3dxa h GLU 89 Cb 1.31 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 30.58 3dxa h GLU 89 CO 0.55 0.87 -0.19 0.00 -1.00 0.00 0.00 179.01 179.24 3dxa h ALA 90 N 1.07 1.16 -2.97 3.43 0.00 -1.97 -3.45 119.26 116.53 3dxa h ALA 90 Ca 0.01 -0.18 -0.54 0.00 0.00 0.00 0.00 54.91 54.20 3dxa h ALA 90 Cb 1.03 -0.03 0.12 0.00 0.00 0.00 0.00 17.79 18.91 3dxa h ALA 90 CO 0.09 0.24 0.60 0.20 0.00 0.00 0.00 179.25 180.38 3dxa s GLY 91 N -4.25 2.88 -0.17 0.00 0.00 -1.21 -4.66 107.32 99.90 3dxa s GLY 91 Ca -0.01 1.29 -0.06 0.00 0.00 0.00 0.00 44.72 45.93 3dxa s GLY 91 CO 0.62 1.81 0.04 -0.45 0.00 0.00 0.00 173.10 175.11 3dxa s SER 92 N -0.97 5.43 0.31 1.64 0.15 -1.26 -4.73 113.70 114.26 3dxa s SER 92 Ca 0.69 0.04 0.03 0.00 0.70 0.00 0.00 55.95 57.41 3dxa s SER 92 Cb -0.39 -1.91 -0.05 0.00 -1.71 0.00 0.00 66.02 61.96 3dxa s SER 92 CO 0.47 0.18 0.08 -1.00 1.20 0.00 0.00 173.24 174.17 3dxa s HIS 93 N 0.31 1.76 -0.02 3.44 3.76 -1.23 -4.98 115.29 118.34 3dxa s HIS 93 Ca 0.02 -1.09 0.00 0.00 -0.15 0.00 0.00 55.06 53.83 3dxa s HIS 93 Cb -0.13 -1.10 0.03 0.00 1.11 0.00 0.00 32.58 32.49 3dxa s HIS 93 CO 0.01 -0.18 0.02 0.42 -0.85 0.00 0.00 174.74 174.16 3dxa s ILE 94 N -3.49 -0.03 -0.10 0.60 1.01 -1.26 -1.24 121.20 116.70 3dxa s ILE 94 Ca 0.36 0.19 -0.02 0.00 0.00 0.00 0.00 60.65 61.17 3dxa s ILE 94 Cb 0.08 -0.09 -0.03 0.00 0.01 0.00 0.00 42.46 42.42 3dxa s ILE 94 CO 0.15 0.09 0.01 -0.63 0.00 0.00 0.00 174.94 174.55 3dxa s ILE 95 N 0.98 4.37 -0.06 2.92 1.01 0.82 -0.29 121.20 130.95 3dxa s ILE 95 Ca -0.08 -0.22 0.01 0.00 0.00 0.00 0.00 60.65 60.35 3dxa s ILE 95 Cb -0.12 -2.85 0.02 0.00 0.01 0.00 0.00 42.46 39.52 3dxa s ILE 95 CO -0.03 0.59 -0.05 -1.10 0.00 0.00 0.00 174.94 174.36 3dxa s GLN 96 N -0.77 0.98 0.09 2.79 -0.21 0.45 -0.16 119.66 122.83 3dxa s GLN 96 Ca 0.12 -0.13 0.08 0.00 0.02 0.00 0.00 55.36 55.45 3dxa s GLN 96 Cb -0.12 -1.00 -0.03 0.00 1.00 0.00 0.00 33.01 32.86 3dxa s GLN 96 CO 0.02 -0.12 -0.21 0.50 -2.12 0.00 0.00 175.29 173.37 3dxa s ARG 97 N 1.12 1.20 -0.05 2.91 3.52 -0.99 0.01 118.95 126.67 3dxa s ARG 97 Ca -0.08 -1.10 -0.02 0.00 -0.13 0.00 0.00 55.73 54.41 3dxa s ARG 97 Cb -0.14 -1.43 0.04 0.00 -1.56 0.00 0.00 34.95 31.86 3dxa s ARG 97 CO -0.01 0.34 0.09 1.41 -0.81 0.00 0.00 175.30 176.32 3dxa s MET 98 N -1.70 -0.01 0.06 5.12 -2.45 0.15 -0.52 119.30 119.94 3dxa s MET 98 Ca 0.07 0.36 -0.00 0.00 -1.25 0.00 0.00 55.69 54.87 3dxa s MET 98 Cb -0.10 -0.32 -0.04 0.00 1.25 0.00 0.00 34.83 35.63 3dxa s MET 98 CO 0.04 -0.25 -0.04 1.52 1.05 0.00 0.00 175.02 177.34 3dxa s TYR 99 N 1.68 0.60 -4.45 4.11 -0.85 -1.06 -0.50 117.35 116.87 3dxa s TYR 99 Ca -0.02 -1.00 0.00 0.00 -0.52 0.00 0.00 57.07 55.53 3dxa s TYR 99 Cb -0.12 -0.41 0.00 0.00 0.38 0.00 0.00 41.96 41.81 3dxa s TYR 99 CO -0.04 -0.31 0.00 0.41 -1.52 0.00 0.00 175.55 174.09 3dxa n GLY 100 N 0.17 -1.17 3.27 5.49 0.00 -0.82 -1.30 105.19 110.83 3dxa n GLY 100 Ca -0.14 -1.15 -0.13 0.00 0.00 0.00 0.00 46.02 44.59 3dxa n GLY 100 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dxa s ASP 102 N -1.69 3.92 0.00 0.00 1.01 -0.99 -1.43 116.67 117.49 3dxa s ASP 102 Ca -0.09 -0.23 0.00 0.00 0.71 0.00 0.00 52.55 52.94 3dxa s ASP 102 Cb -0.03 -0.79 0.00 0.00 1.01 0.00 0.00 42.92 43.11 3dxa s ASP 102 CO 0.01 0.34 0.00 0.52 0.21 0.00 0.00 175.17 176.25 3dxa n VAL 103 N 2.32 0.00 0.00 -1.27 0.31 -0.85 -0.41 118.33 118.42 3dxa n VAL 103 Ca -0.17 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.16 3dxa n VAL 103 Cb 0.52 -0.27 0.00 0.00 -0.91 0.00 0.00 33.84 33.18 3dxa n VAL 103 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3dxa n GLY 104 N 2.75 0.60 0.09 2.92 0.00 -1.26 -2.19 105.19 108.10 3dxa n GLY 104 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 3dxa n GLY 104 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3dxa h PRO 105 N 0.00 0.17 -6.89 1.61 0.11 -1.90 -3.32 132.00 121.78 3dxa h PRO 105 Ca 0.00 -0.09 -0.49 0.00 0.11 0.00 0.00 66.00 65.53 3dxa h PRO 105 Cb 0.00 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.11 3dxa h PRO 105 CO 0.00 0.60 0.16 0.16 -0.21 0.00 0.00 178.00 178.71 3dxa s ASP 106 N -5.89 6.58 -0.47 -2.05 -4.77 -1.26 -5.01 116.67 103.79 3dxa s ASP 106 Ca -0.15 1.23 0.03 0.00 -3.30 0.00 0.00 52.55 50.37 3dxa s ASP 106 Cb 0.03 -2.36 0.57 0.00 -1.09 0.00 0.00 42.92 40.07 3dxa s ASP 106 CO 0.71 -0.40 1.83 0.61 0.70 0.00 0.00 175.17 178.62 3dxa n GLY 107 N -1.21 5.07 0.00 2.12 0.00 -1.25 -4.89 105.19 105.03 3dxa n GLY 107 Ca 0.03 -1.54 0.00 0.00 0.00 0.00 0.00 46.02 44.51 3dxa n GLY 107 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dxa n ARG 108 N -1.06 2.57 -3.49 1.61 5.12 -1.25 -4.90 116.66 115.26 3dxa n ARG 108 Ca 0.55 0.00 -0.29 0.00 -1.93 0.00 0.00 57.85 56.18 3dxa n ARG 108 Cb 1.24 0.00 -0.04 0.00 -1.16 0.00 0.00 32.46 32.51 3dxa n ARG 108 CO 0.00 0.00 0.00 -1.17 -1.93 0.00 0.00 177.63 174.53 3dxa s LEU 109 N 0.00 4.15 0.05 0.55 2.96 -1.22 -4.16 118.68 121.01 3dxa s LEU 109 Ca 0.00 0.65 -0.00 0.00 -0.22 0.00 0.00 54.13 54.56 3dxa s LEU 109 Cb 0.00 -3.43 -0.00 0.00 0.50 0.00 0.00 46.19 43.26 3dxa s LEU 109 CO 0.00 -0.10 -0.00 0.18 -1.32 0.00 0.00 176.35 175.11 3dxa n LEU 110 N -0.58 0.60 -3.67 -0.68 4.32 0.45 -4.77 117.00 112.67 3dxa n LEU 110 Ca -0.02 0.08 -0.10 0.00 -0.02 0.00 0.00 56.01 55.94 3dxa n LEU 110 Cb 0.53 -0.19 -0.04 0.00 -1.62 0.00 0.00 43.42 42.10 3dxa n LEU 110 CO 0.48 -0.40 0.20 0.00 -1.22 0.00 0.00 177.39 176.45 3dxa s ARG 111 N -2.01 1.19 0.10 3.23 1.70 -1.24 -5.03 118.95 116.89 3dxa s ARG 111 Ca -0.00 -0.77 0.05 0.00 -0.47 0.00 0.00 55.73 54.54 3dxa s ARG 111 Cb 0.00 0.49 -0.04 0.00 -0.57 0.00 0.00 34.95 34.83 3dxa s ARG 111 CO 0.00 -0.48 -0.01 0.20 -1.08 0.00 0.00 175.30 173.94 3dxa s GLY 112 N -2.83 1.88 -0.03 3.88 0.00 -1.26 -2.35 107.32 106.61 3dxa s GLY 112 Ca 0.06 -1.16 0.04 0.00 0.00 0.00 0.00 44.72 43.66 3dxa s GLY 112 CO -0.08 -1.14 -0.15 -0.19 0.00 0.00 0.00 173.10 171.53 3dxa s TYR 113 N -1.36 1.48 -0.30 1.90 1.51 -0.79 -4.75 117.35 115.04 3dxa s TYR 113 Ca 0.26 -0.37 0.01 0.00 -1.01 0.00 0.00 57.07 55.96 3dxa s TYR 113 Cb -0.11 -0.99 0.19 0.00 -0.11 0.00 0.00 41.96 40.94 3dxa s TYR 113 CO 0.18 -0.11 0.59 0.34 -1.11 0.00 0.00 175.55 175.45 3dxa s ASP 114 N -0.07 -1.45 -0.03 2.29 2.15 -1.25 -1.95 116.67 116.36 3dxa s ASP 114 Ca -0.00 0.64 -0.00 0.00 0.43 0.00 0.00 52.55 53.61 3dxa s ASP 114 Cb -0.09 2.11 0.03 0.00 -0.30 0.00 0.00 42.92 44.67 3dxa s ASP 114 CO 0.01 -0.27 0.02 -1.10 -0.17 0.00 0.00 175.17 173.66 3dxa s GLN 115 N 2.85 0.13 0.23 4.34 -0.21 0.34 0.21 119.66 127.54 3dxa s GLN 115 Ca 0.17 0.19 0.09 0.00 0.02 0.00 0.00 55.36 55.83 3dxa s GLN 115 Cb -0.13 -0.46 -0.04 0.00 1.00 0.00 0.00 33.01 33.38 3dxa s GLN 115 CO -0.23 -0.21 -0.02 0.71 -2.12 0.00 0.00 175.29 173.42 3dxa s TYR 116 N 1.41 2.72 -0.19 0.91 1.51 -0.24 -0.68 117.35 122.78 3dxa s TYR 116 Ca -0.05 -0.20 -0.18 0.00 -1.01 0.00 0.00 57.07 55.63 3dxa s TYR 116 Cb -0.13 -1.25 0.05 0.00 -0.11 0.00 0.00 41.96 40.52 3dxa s TYR 116 CO -0.03 0.58 0.51 0.00 -1.11 0.00 0.00 175.55 175.50 3dxa s ALA 117 N -2.07 -1.27 -0.15 3.71 0.00 0.10 -2.35 121.76 119.73 3dxa s ALA 117 Ca 0.29 1.44 0.00 0.00 0.00 0.00 0.00 51.96 53.69 3dxa s ALA 117 Cb -0.07 -0.82 -0.00 0.00 0.00 0.00 0.00 23.12 22.22 3dxa s ALA 117 CO 0.19 -0.24 -0.15 -0.47 0.00 0.00 0.00 175.76 175.08 3dxa s TYR 118 N 0.23 2.77 -1.62 0.00 5.04 0.05 -0.41 117.35 123.42 3dxa s TYR 118 Ca -0.00 -1.00 -0.13 0.00 -2.44 0.00 0.00 57.07 53.49 3dxa s TYR 118 Cb -0.04 -1.88 0.11 0.00 0.35 0.00 0.00 41.96 40.51 3dxa s TYR 118 CO 0.01 -0.45 0.67 -0.25 -1.34 0.00 0.00 175.55 174.19 3dxa n ASP 119 N 3.99 -2.44 -2.61 4.32 9.92 0.60 -1.17 116.55 129.16 3dxa n ASP 119 Ca -0.19 -1.02 -0.17 0.00 -0.53 0.00 0.00 54.79 52.89 3dxa n ASP 119 Cb 0.52 -2.81 0.05 0.00 -0.64 0.00 0.00 41.12 38.25 3dxa n ASP 119 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3dxa n GLY 120 N -1.60 -0.10 2.92 0.44 0.00 -1.26 -5.02 105.19 100.57 3dxa n GLY 120 Ca -0.04 -0.04 -0.15 0.00 0.00 0.00 0.00 46.02 45.80 3dxa n GLY 120 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dxa s LYS 121 N -5.86 0.29 0.01 1.61 1.02 -0.32 -5.11 119.74 111.38 3dxa s LYS 121 Ca 0.39 -0.11 -0.35 0.00 0.02 0.00 0.00 55.97 55.92 3dxa s LYS 121 Cb -0.17 -0.30 -0.13 0.00 -0.52 0.00 0.00 37.83 36.70 3dxa s LYS 121 CO 0.48 0.05 1.70 -0.25 -0.92 0.00 0.00 175.35 176.41 3dxa n ASP 122 N 3.11 3.02 0.00 2.83 8.00 -1.26 -0.77 116.55 131.48 3dxa n ASP 122 Ca -0.14 1.04 0.00 0.00 0.71 0.00 0.00 54.79 56.40 3dxa n ASP 122 Cb 0.58 -1.35 0.00 0.00 -0.02 0.00 0.00 41.12 40.33 3dxa n ASP 122 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3dxa n TYR 123 N 4.86 0.00 -4.14 1.24 9.36 -0.99 -4.68 117.16 122.80 3dxa n TYR 123 Ca 0.20 0.00 -0.14 0.00 3.32 0.00 0.00 57.90 61.28 3dxa n TYR 123 Cb 0.27 0.00 -0.11 0.00 -0.63 0.00 0.00 39.34 38.86 3dxa n TYR 123 CO 0.00 0.00 0.00 -1.50 0.22 0.00 0.00 176.86 175.58 3dxa s ILE 124 N -0.86 0.84 -0.03 2.97 2.07 -1.20 -1.42 121.20 123.57 3dxa s ILE 124 Ca 0.00 -1.46 -0.02 0.00 -1.41 0.00 0.00 60.65 57.76 3dxa s ILE 124 Cb 0.00 -1.13 0.01 0.00 0.13 0.00 0.00 42.46 41.47 3dxa s ILE 124 CO 0.00 -0.48 0.08 0.00 -1.91 0.00 0.00 174.94 172.63 3dxa s ALA 125 N -2.05 -0.16 -0.20 1.50 0.00 -0.60 -1.08 121.76 119.17 3dxa s ALA 125 Ca 0.01 0.27 -0.26 0.00 0.00 0.00 0.00 51.96 51.98 3dxa s ALA 125 Cb -0.05 -0.17 -0.01 0.00 0.00 0.00 0.00 23.12 22.88 3dxa s ALA 125 CO 0.00 -0.06 0.87 -1.17 0.00 0.00 0.00 175.76 175.40 3dxa s LEU 126 N 0.29 4.14 1.07 0.00 2.96 0.13 -0.17 118.68 127.11 3dxa s LEU 126 Ca -0.02 1.18 -0.14 0.00 -0.22 0.00 0.00 54.13 54.93 3dxa s LEU 126 Cb -0.03 -3.28 0.23 0.00 0.50 0.00 0.00 46.19 43.61 3dxa s LEU 126 CO -0.01 -0.47 1.08 0.20 -1.32 0.00 0.00 176.35 175.83 3dxa s ASN 127 N 1.22 1.97 0.00 3.68 0.01 -1.03 -4.41 114.94 116.39 3dxa s ASN 127 Ca 0.38 1.12 0.28 0.00 -0.71 0.00 0.00 52.86 53.94 3dxa s ASN 127 Cb -0.16 -1.74 1.43 0.00 0.41 0.00 0.00 41.25 41.19 3dxa s ASN 127 CO 0.10 -3.53 1.98 -0.62 -1.51 0.00 0.00 177.10 173.52 3dxa n GLU 128 N -4.43 0.41 0.00 -0.60 1.02 -1.26 -2.38 120.64 113.41 3dxa n GLU 128 Ca 0.06 0.02 0.13 0.00 -0.02 0.00 0.00 57.16 57.35 3dxa n GLU 128 Cb 0.57 -1.50 0.44 0.00 -0.02 0.00 0.00 31.44 30.93 3dxa n GLU 128 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 3dxa n ASP 129 N -1.28 1.06 -2.77 1.62 5.75 -1.26 -4.74 116.55 114.92 3dxa n ASP 129 Ca 0.14 -0.99 -0.21 0.00 -0.01 0.00 0.00 54.79 53.72 3dxa n ASP 129 Cb 0.22 0.08 0.01 0.00 -1.03 0.00 0.00 41.12 40.41 3dxa n ASP 129 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 3dxa n LEU 130 N -0.51 -2.23 0.00 -2.12 4.77 -1.00 -4.75 117.00 111.16 3dxa n LEU 130 Ca 0.14 -0.16 0.00 0.00 -0.03 0.00 0.00 56.01 55.96 3dxa n LEU 130 Cb 0.34 -2.86 0.00 0.00 -2.33 0.00 0.00 43.42 38.57 3dxa n LEU 130 CO 0.23 0.03 0.00 -1.54 -1.33 0.00 0.00 177.39 174.79 3dxa n SER 131 N -2.27 0.00 -4.07 -1.43 3.41 -1.26 -4.59 113.62 103.41 3dxa n SER 131 Ca -0.16 -0.56 -0.09 0.00 -0.26 0.00 0.00 58.87 57.80 3dxa n SER 131 Cb 0.64 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 64.50 3dxa n SER 131 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 3dxa s SER 132 N 0.00 0.23 0.22 4.04 1.04 -1.26 -4.87 113.70 113.09 3dxa s SER 132 Ca 0.00 -1.06 0.11 0.00 0.48 0.00 0.00 55.95 55.48 3dxa s SER 132 Cb 0.00 0.34 -0.05 0.00 0.10 0.00 0.00 66.02 66.41 3dxa s SER 132 CO 0.00 -0.77 -0.21 0.26 0.98 0.00 0.00 173.24 173.50 3dxa s TRP 133 N -4.00 2.15 -0.24 5.02 0.52 -1.26 -2.46 118.94 118.67 3dxa s TRP 133 Ca 0.20 -0.39 -0.05 0.00 0.02 0.00 0.00 56.10 55.88 3dxa s TRP 133 Cb 0.06 -1.01 -0.01 0.00 -1.15 0.00 0.00 33.47 31.36 3dxa s TRP 133 CO -0.00 0.54 -0.00 0.99 0.02 0.00 0.00 176.95 178.49 3dxa s THR 134 N -2.17 3.64 -0.25 2.01 2.01 0.77 -4.91 115.64 116.73 3dxa s THR 134 Ca 0.23 -0.47 -0.15 0.00 0.31 0.00 0.00 61.69 61.61 3dxa s THR 134 Cb -0.06 -2.70 -0.04 0.00 0.01 0.00 0.00 72.50 69.71 3dxa s THR 134 CO 0.11 0.35 0.37 0.00 -0.69 0.00 0.00 174.62 174.76 3dxa s ALA 135 N 1.51 3.57 -0.09 7.40 0.00 -1.26 -1.55 121.76 131.33 3dxa s ALA 135 Ca 0.05 -0.74 -0.23 0.00 0.00 0.00 0.00 51.96 51.04 3dxa s ALA 135 Cb -0.15 -2.68 -0.20 0.00 0.00 0.00 0.00 23.12 20.10 3dxa s ALA 135 CO -0.01 -0.54 0.83 0.00 0.00 0.00 0.00 175.76 176.03 3dxa h ALA 136 N 7.93 -0.06 -1.10 0.00 0.00 -1.51 -3.48 119.26 121.04 3dxa h ALA 136 Ca -0.33 -0.33 -0.61 0.00 0.00 0.00 0.00 54.91 53.64 3dxa h ALA 136 Cb 1.16 0.02 -0.13 0.00 0.00 0.00 0.00 17.79 18.84 3dxa h ALA 136 CO 0.67 -0.14 -0.53 0.16 0.00 0.00 0.00 179.25 179.41 3dxa s ASP 137 N -5.84 3.49 0.52 0.00 1.47 -1.26 -5.03 116.67 110.01 3dxa s ASP 137 Ca -0.15 -1.61 0.34 0.00 1.18 0.00 0.00 52.55 52.32 3dxa s ASP 137 Cb -0.01 0.36 1.60 0.00 -0.34 0.00 0.00 42.92 44.53 3dxa s ASP 137 CO 0.56 -0.81 2.03 0.71 0.68 0.00 0.00 175.17 178.34 3dxa h THR 138 N 1.62 0.00 -0.07 2.11 1.35 -1.98 -2.54 112.91 113.40 3dxa h THR 138 Ca -0.41 -0.28 -0.20 0.00 -0.55 0.00 0.00 66.41 64.97 3dxa h THR 138 Cb 1.29 1.19 0.01 0.00 -1.73 0.00 0.00 68.15 68.91 3dxa h THR 138 CO 0.69 0.00 -0.75 0.00 -0.25 0.00 0.00 175.52 175.21 3dxa h ALA 139 N 2.04 0.18 0.00 6.62 0.00 -1.96 -3.26 119.26 122.88 3dxa h ALA 139 Ca 0.00 -0.60 -0.04 0.00 0.00 0.00 0.00 54.91 54.27 3dxa h ALA 139 Cb 0.30 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 3dxa h ALA 139 CO 0.00 0.54 -0.20 0.00 0.00 0.00 0.00 179.25 179.59 3dxa h ALA 140 N 0.44 1.64 -0.47 0.00 0.00 -1.74 -2.92 119.26 116.21 3dxa h ALA 140 Ca -0.07 -0.18 -0.00 0.00 0.00 0.00 0.00 54.91 54.65 3dxa h ALA 140 Cb 1.40 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 19.14 3dxa h ALA 140 CO 0.15 0.25 0.29 1.96 0.00 0.00 0.00 179.25 181.90 3dxa h GLN 141 N 0.00 0.63 -0.37 0.00 4.20 -1.57 0.28 115.11 118.28 3dxa h GLN 141 Ca -0.00 -0.05 0.08 0.00 0.06 0.00 0.00 58.65 58.74 3dxa h GLN 141 Cb 0.36 -0.14 -0.08 0.00 0.30 0.00 0.00 27.48 27.93 3dxa h GLN 141 CO 0.03 0.44 -0.14 0.82 -0.67 0.00 0.00 178.83 179.31 3dxa h ILE 142 N 0.65 0.54 0.00 2.54 1.08 -1.63 -1.62 117.51 119.07 3dxa h ILE 142 Ca 0.17 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.64 3dxa h ILE 142 Cb -0.04 0.54 0.00 0.00 -3.07 0.00 0.00 36.82 34.25 3dxa h ILE 142 CO -0.03 0.00 -0.21 0.74 -0.69 0.00 0.00 178.15 177.96 3dxa h THR 143 N -0.06 0.00 0.36 -0.27 2.02 -0.99 -1.80 112.91 112.17 3dxa h THR 143 Ca 0.18 -0.80 -0.02 0.00 0.77 0.00 0.00 66.41 66.55 3dxa h THR 143 Cb 0.34 1.68 0.00 0.00 -1.74 0.00 0.00 68.15 68.44 3dxa h THR 143 CO -0.42 0.00 -0.17 -0.61 0.37 0.00 0.00 175.52 174.69 3dxa h GLN 144 N 0.00 -0.46 -0.08 6.66 4.15 -0.35 -3.09 115.11 121.94 3dxa h GLN 144 Ca 0.00 0.03 0.02 0.00 0.77 0.00 0.00 58.65 59.48 3dxa h GLN 144 Cb 0.90 0.11 -0.00 0.00 0.21 0.00 0.00 27.48 28.69 3dxa h GLN 144 CO 0.00 -0.14 0.07 0.00 -1.93 0.00 0.00 178.83 176.83 3dxa h ARG 145 N -0.92 0.00 0.01 1.69 3.08 -0.82 0.35 114.38 117.78 3dxa h ARG 145 Ca -0.05 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.00 3dxa h ARG 145 Cb 0.53 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.58 3dxa h ARG 145 CO 0.08 0.00 -0.01 0.87 -1.07 0.00 0.00 179.97 179.85 3dxa h LYS 146 N 0.00 -0.01 0.04 0.04 1.57 -1.42 -2.95 116.57 113.84 3dxa h LYS 146 Ca 0.04 0.00 -0.22 0.00 -1.87 0.00 0.00 60.65 58.60 3dxa h LYS 146 Cb 0.18 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.47 3dxa h LYS 146 CO -0.00 0.03 -1.03 -1.49 -0.57 0.00 0.00 179.45 176.38 3dxa h TRP 147 N -0.05 0.23 0.00 -1.35 6.55 -0.76 -2.28 115.95 118.29 3dxa h TRP 147 Ca -0.00 -0.15 0.03 0.00 0.95 0.00 0.00 58.89 59.71 3dxa h TRP 147 Cb 0.05 -0.01 -0.06 0.00 -0.86 0.00 0.00 29.16 28.28 3dxa h TRP 147 CO -0.07 1.07 -0.47 0.93 -1.05 0.00 0.00 178.44 178.85 3dxa h GLU 148 N 0.05 -0.60 0.00 0.49 5.08 -0.49 -1.84 114.58 117.27 3dxa h GLU 148 Ca -0.06 0.04 -0.08 0.00 -1.00 0.00 0.00 59.36 58.27 3dxa h GLU 148 Cb 1.74 0.14 -0.01 0.00 0.50 0.00 0.00 28.75 31.12 3dxa h GLU 148 CO 0.15 -0.40 -0.36 0.00 -1.00 0.00 0.00 179.01 177.40 3dxa h ALA 149 N -0.21 1.11 -0.05 3.43 0.00 -1.53 -2.54 119.26 119.47 3dxa h ALA 149 Ca 0.03 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.61 3dxa h ALA 149 Cb 0.69 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.42 3dxa h ALA 149 CO -0.34 0.46 0.00 0.00 0.00 0.00 0.00 179.25 179.37 3dxa n ALA 150 N -2.34 2.59 -3.93 0.00 0.00 -0.86 -4.93 120.51 111.03 3dxa n ALA 150 Ca -0.01 -0.31 -0.25 0.00 0.00 0.00 0.00 53.44 52.86 3dxa n ALA 150 Cb 0.46 -1.25 -0.01 0.00 0.00 0.00 0.00 19.45 18.64 3dxa n ALA 150 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 3dxa n ARG 151 N -0.32 -3.55 0.13 0.00 1.74 -0.75 -4.86 116.66 109.06 3dxa n ARG 151 Ca 0.17 0.43 -0.00 0.00 -0.77 0.00 0.00 57.85 57.69 3dxa n ARG 151 Cb 0.20 -4.66 0.14 0.00 -1.02 0.00 0.00 32.46 27.12 3dxa n ARG 151 CO 0.00 0.00 0.00 0.28 -1.52 0.00 0.00 177.63 176.39 3dxa h VAL 152 N -1.83 1.29 -0.61 1.55 2.07 -1.66 -3.32 116.25 113.74 3dxa h VAL 152 Ca -0.63 -2.26 0.06 0.00 0.82 0.00 0.00 66.70 64.70 3dxa h VAL 152 Cb 1.37 2.27 -0.08 0.00 -1.52 0.00 0.00 31.29 33.34 3dxa h VAL 152 CO 0.62 0.61 -0.40 0.00 0.02 0.00 0.00 177.57 178.43 3dxa h ALA 153 N 1.38 -0.42 -0.85 1.67 0.00 -1.89 -1.99 119.26 117.16 3dxa h ALA 153 Ca -0.01 0.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 3dxa h ALA 153 Cb 1.22 1.21 -0.04 0.00 0.00 0.00 0.00 17.79 20.19 3dxa h ALA 153 CO 0.08 -0.69 0.42 0.93 0.00 0.00 0.00 179.25 180.00 3dxa h GLU 154 N -0.05 1.22 -1.58 0.00 5.08 -1.83 0.11 114.58 117.53 3dxa h GLU 154 Ca 0.10 -0.17 -0.44 0.00 -1.00 0.00 0.00 59.36 57.85 3dxa h GLU 154 Cb 0.30 -0.22 -0.17 0.00 0.50 0.00 0.00 28.75 29.15 3dxa h GLU 154 CO -0.60 0.93 0.50 0.94 -1.00 0.00 0.00 179.01 179.77 3dxa n GLN 155 N -4.31 2.12 -0.01 2.33 -0.06 -0.96 0.42 117.38 116.90 3dxa n GLN 155 Ca 0.09 -2.08 -0.05 0.00 -2.00 0.00 0.00 57.00 52.96 3dxa n GLN 155 Cb 0.13 -1.87 -0.02 0.00 -4.06 0.00 0.00 30.24 24.43 3dxa n GLN 155 CO 0.00 0.00 0.00 -0.25 -0.20 0.00 0.00 177.06 176.61 3dxa n ASP 156 N 0.27 1.41 -0.31 1.69 8.00 -0.02 -4.90 116.55 122.69 3dxa n ASP 156 Ca 0.40 0.21 0.19 0.00 0.71 0.00 0.00 54.79 56.30 3dxa n ASP 156 Cb 0.57 -0.50 0.36 0.00 -0.02 0.00 0.00 41.12 41.53 3dxa n ASP 156 CO 0.00 0.00 0.00 -1.14 -0.39 0.00 0.00 177.20 175.67 3dxa n ARG 157 N -3.87 -0.07 -0.22 -1.24 0.63 -0.61 0.22 116.66 111.50 3dxa n ARG 157 Ca -0.07 1.36 -0.05 0.00 -0.92 0.00 0.00 57.85 58.16 3dxa n ARG 157 Cb 0.26 -2.24 0.05 0.00 0.45 0.00 0.00 32.46 30.98 3dxa n ARG 157 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 3dxa h ALA 158 N 1.86 0.81 -0.02 5.13 0.00 -0.32 -0.45 119.26 126.26 3dxa h ALA 158 Ca 0.63 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.49 3dxa h ALA 158 Cb 1.44 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 18.98 3dxa h ALA 158 CO -0.83 0.22 -0.03 -0.92 0.00 0.00 0.00 179.25 177.70 3dxa h TYR 159 N 0.85 0.06 -0.46 0.00 3.20 0.25 -1.12 116.97 119.75 3dxa h TYR 159 Ca 0.24 -0.02 -0.03 0.00 3.14 0.00 0.00 58.73 62.06 3dxa h TYR 159 Cb -0.08 -0.01 -0.02 0.00 1.54 0.00 0.00 36.73 38.16 3dxa h TYR 159 CO -0.03 0.58 0.15 -0.07 -1.64 0.00 0.00 178.16 177.14 3dxa h LEU 160 N -0.48 0.61 0.00 2.82 3.38 -0.61 -0.17 115.31 120.86 3dxa h LEU 160 Ca 0.00 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.89 3dxa h LEU 160 Cb 0.57 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 41.16 3dxa h LEU 160 CO 0.01 0.58 -0.27 -0.33 0.09 0.00 0.00 178.44 178.51 3dxa h GLU 161 N 0.65 0.00 0.00 1.13 5.08 -1.17 -3.34 114.58 116.93 3dxa h GLU 161 Ca 0.15 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.51 3dxa h GLU 161 Cb 0.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.44 3dxa h GLU 161 CO -0.01 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.41 3dxa n GLY 162 N 1.20 0.36 0.39 -3.84 0.00 -0.20 -4.75 105.19 98.36 3dxa n GLY 162 Ca 0.04 0.00 0.21 0.00 0.00 0.00 0.00 46.02 46.27 3dxa n GLY 162 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3dxa h LEU 163 N 0.00 0.00 0.76 0.99 5.85 -1.50 -0.35 115.31 121.06 3dxa h LEU 163 Ca 0.00 0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.68 3dxa h LEU 163 Cb 0.00 0.00 0.01 0.00 0.37 0.00 0.00 40.66 41.04 3dxa h LEU 163 CO 0.00 0.00 -0.36 0.00 -0.34 0.00 0.00 178.44 177.74 3dxa h VAL 165 N -1.21 1.34 0.44 0.00 -1.51 -1.59 -1.78 116.25 111.93 3dxa h VAL 165 Ca -0.10 -1.69 -0.02 0.00 -1.23 0.00 0.00 66.70 63.65 3dxa h VAL 165 Cb 0.79 1.78 0.00 0.00 -2.13 0.00 0.00 31.29 31.74 3dxa h VAL 165 CO 0.17 0.51 -0.21 -0.33 -1.23 0.00 0.00 177.57 176.48 3dxa h GLU 166 N 0.23 -0.57 -0.53 5.19 5.08 -1.05 -1.44 114.58 121.49 3dxa h GLU 166 Ca 0.01 0.04 -0.08 0.00 -1.00 0.00 0.00 59.36 58.33 3dxa h GLU 166 Cb 0.93 0.13 -0.02 0.00 0.50 0.00 0.00 28.75 30.29 3dxa h GLU 166 CO 0.08 -0.38 0.02 0.66 -1.00 0.00 0.00 179.01 178.39 3dxa h SER 167 N -0.59 0.85 0.24 1.42 4.64 -0.94 -2.66 113.55 116.51 3dxa h SER 167 Ca -0.06 -0.21 -0.01 0.00 -0.47 0.00 0.00 61.79 61.04 3dxa h SER 167 Cb 0.45 -0.23 0.00 0.00 -0.31 0.00 0.00 62.40 62.32 3dxa h SER 167 CO 0.10 0.90 -0.12 0.25 -0.87 0.00 0.00 176.83 177.10 3dxa h LEU 168 N 0.83 -0.27 -1.18 5.97 5.85 -1.21 0.15 115.31 125.45 3dxa h LEU 168 Ca 0.16 -0.02 0.18 0.00 0.84 0.00 0.00 57.88 59.04 3dxa h LEU 168 Cb 0.46 0.07 -0.09 0.00 0.37 0.00 0.00 40.66 41.47 3dxa h LEU 168 CO 0.02 -0.16 0.61 0.03 -0.34 0.00 0.00 178.44 178.60 3dxa h ARG 169 N -0.36 0.66 -0.15 1.25 3.08 -1.22 0.90 114.38 118.54 3dxa h ARG 169 Ca -0.03 -0.04 -0.02 0.00 0.07 0.00 0.00 59.98 59.96 3dxa h ARG 169 Cb 0.28 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.17 3dxa h ARG 169 CO 0.05 0.44 0.01 -0.09 -1.07 0.00 0.00 179.97 179.31 3dxa h ARG 170 N 0.68 0.25 -0.63 0.04 2.43 -0.98 -2.56 114.38 113.61 3dxa h ARG 170 Ca 0.53 -0.08 0.02 0.00 -0.81 0.00 0.00 59.98 59.65 3dxa h ARG 170 Cb 0.92 -0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 30.41 3dxa h ARG 170 CO -0.29 0.47 0.40 1.88 -1.51 0.00 0.00 179.97 180.91 3dxa h TYR 171 N 0.01 0.75 0.92 2.20 0.05 0.66 -1.49 116.97 120.07 3dxa h TYR 171 Ca 0.04 0.02 -0.04 0.00 0.05 0.00 0.00 58.73 58.80 3dxa h TYR 171 Cb 0.35 -0.25 0.00 0.00 1.01 0.00 0.00 36.73 37.84 3dxa h TYR 171 CO 0.03 0.44 -0.48 -0.07 -1.05 0.00 0.00 178.16 177.03 3dxa h LEU 172 N 0.79 -1.16 -0.49 3.88 3.38 -0.85 -1.71 115.31 119.15 3dxa h LEU 172 Ca 0.25 0.05 0.10 0.00 0.09 0.00 0.00 57.88 58.37 3dxa h LEU 172 Cb -0.01 0.31 -0.09 0.00 0.09 0.00 0.00 40.66 40.97 3dxa h LEU 172 CO -0.09 -0.78 -0.04 -0.08 0.09 0.00 0.00 178.44 177.53 3dxa h GLU 173 N -1.28 0.07 -0.84 1.13 4.57 -1.43 0.46 114.58 117.26 3dxa h GLU 173 Ca -0.12 -0.00 0.05 0.00 -1.18 0.00 0.00 59.36 58.10 3dxa h GLU 173 Cb 1.00 -0.02 -0.05 0.00 -0.16 0.00 0.00 28.75 29.52 3dxa h GLU 173 CO 0.18 0.05 0.55 -0.91 -1.18 0.00 0.00 179.01 177.70 3dxa h ASN 174 N 0.07 0.85 -0.32 1.04 4.21 -1.09 -2.59 115.58 117.75 3dxa h ASN 174 Ca 0.25 -0.00 -0.22 0.00 1.21 0.00 0.00 56.30 57.53 3dxa h ASN 174 Cb 0.38 -0.19 -0.16 0.00 -1.12 0.00 0.00 38.32 37.23 3dxa h ASN 174 CO -0.45 0.57 -0.49 0.61 -1.29 0.00 0.00 177.43 176.38 3dxa n GLY 175 N -1.41 5.53 0.26 2.83 0.00 -0.66 -4.87 105.19 106.87 3dxa n GLY 175 Ca 0.12 -1.75 0.04 0.00 0.00 0.00 0.00 46.02 44.42 3dxa n GLY 175 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 3dxa h LYS 176 N 1.40 0.35 0.00 1.61 2.10 0.33 -1.93 116.57 120.43 3dxa h LYS 176 Ca 0.17 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.80 3dxa h LYS 176 Cb 1.27 -0.08 0.00 0.00 -0.90 0.00 0.00 32.23 32.52 3dxa h LYS 176 CO 0.35 0.23 0.00 0.39 -2.00 0.00 0.00 179.45 178.42 3dxa n GLU 177 N -5.07 0.08 -0.06 0.07 1.02 -1.26 0.72 120.64 116.14 3dxa n GLU 177 Ca 0.13 0.22 -0.07 0.00 -0.02 0.00 0.00 57.16 57.42 3dxa n GLU 177 Cb 0.39 -1.50 -0.08 0.00 -0.02 0.00 0.00 31.44 30.23 3dxa n GLU 177 CO 0.00 0.00 0.00 0.25 1.18 0.00 0.00 177.13 178.56 3dxa n THR 178 N -1.41 0.77 0.02 2.62 -2.24 -0.83 -4.44 114.28 108.77 3dxa n THR 178 Ca 0.05 -0.41 -0.17 0.00 -2.27 0.00 0.00 64.05 61.24 3dxa n THR 178 Cb 0.14 -0.81 -0.14 0.00 -2.10 0.00 0.00 70.33 67.42 3dxa n THR 178 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 3dxa h LEU 179 N 0.00 0.33 -3.38 3.22 3.38 -0.60 -3.36 115.31 114.90 3dxa h LEU 179 Ca -0.30 -0.60 -0.12 0.00 0.09 0.00 0.00 57.88 56.94 3dxa h LEU 179 Cb 1.61 -0.11 -0.07 0.00 0.09 0.00 0.00 40.66 42.18 3dxa h LEU 179 CO -0.01 1.52 0.03 0.00 0.09 0.00 0.00 178.44 180.08 3dxa n GLN 180 N -3.38 2.51 -3.62 1.13 6.02 0.22 -4.81 117.38 115.44 3dxa n GLN 180 Ca -0.23 -3.02 -0.28 0.00 -0.01 0.00 0.00 57.00 53.47 3dxa n GLN 180 Cb 1.05 -1.89 -0.12 0.00 1.02 0.00 0.00 30.24 30.31 3dxa n GLN 180 CO 0.00 0.00 0.00 0.50 -1.01 0.00 0.00 177.06 176.55 3dxa s ARG 181 N -3.05 1.38 0.41 -1.09 3.52 -1.22 -4.92 118.95 113.97 3dxa s ARG 181 Ca 0.45 -2.31 -0.27 0.00 -0.13 0.00 0.00 55.73 53.47 3dxa s ARG 181 Cb 0.39 -2.19 -0.10 0.00 -1.56 0.00 0.00 34.95 31.49 3dxa s ARG 181 CO 0.06 -1.28 1.44 0.00 -0.81 0.00 0.00 175.30 174.71 3dxa s ALA 182 N -0.13 3.40 -0.14 6.12 0.00 -1.26 -4.79 121.76 124.96 3dxa s ALA 182 Ca 0.25 1.48 -0.04 0.00 0.00 0.00 0.00 51.96 53.65 3dxa s ALA 182 Cb -0.09 -3.58 -0.03 0.00 0.00 0.00 0.00 23.12 19.41 3dxa s ALA 182 CO -0.11 -1.07 -0.00 -0.51 0.00 0.00 0.00 175.76 174.06 3dxa s ASP 183 N -0.37 5.10 0.42 0.00 1.11 -0.93 -4.76 116.67 117.24 3dxa s ASP 183 Ca 0.56 -0.01 -0.23 0.00 0.18 0.00 0.00 52.55 53.05 3dxa s ASP 183 Cb -0.44 -1.75 -0.09 0.00 1.07 0.00 0.00 42.92 41.71 3dxa s ASP 183 CO 0.59 0.22 1.06 -2.16 1.18 0.00 0.00 175.17 176.06 3dxa s PRO 184 N 0.06 4.05 0.15 8.23 0.04 -1.26 -3.14 135.00 143.14 3dxa s PRO 184 Ca 0.02 1.53 -0.30 0.00 0.04 0.00 0.00 61.00 62.29 3dxa s PRO 184 Cb -0.13 -2.46 -0.07 0.00 0.04 0.00 0.00 34.50 31.88 3dxa s PRO 184 CO 0.02 -0.24 1.07 -1.25 0.04 0.00 0.00 177.00 176.64 3dxa s PRO 185 N -2.63 4.61 -0.55 0.56 0.04 -1.26 -4.52 135.00 131.25 3dxa s PRO 185 Ca 0.60 1.66 -0.26 0.00 0.04 0.00 0.00 61.00 63.03 3dxa s PRO 185 Cb -0.22 -3.31 0.03 0.00 0.04 0.00 0.00 34.50 31.05 3dxa s PRO 185 CO 0.27 0.09 1.06 0.15 0.04 0.00 0.00 177.00 178.61 3dxa s LYS 186 N -0.20 3.45 -0.11 4.56 1.02 0.05 -4.79 119.74 123.73 3dxa s LYS 186 Ca 0.49 0.05 -0.05 0.00 0.02 0.00 0.00 55.97 56.48 3dxa s LYS 186 Cb -0.28 -4.01 -0.04 0.00 -0.52 0.00 0.00 37.83 32.98 3dxa s LYS 186 CO 0.33 -1.53 0.08 0.95 -0.92 0.00 0.00 175.35 174.26 3dxa s THR 187 N 4.38 4.97 0.18 2.17 -4.23 -1.26 -3.31 115.64 118.53 3dxa s THR 187 Ca 0.37 0.00 -0.11 0.00 -1.18 0.00 0.00 61.69 60.78 3dxa s THR 187 Cb -0.10 -3.14 -0.00 0.00 1.34 0.00 0.00 72.50 70.60 3dxa s THR 187 CO 0.23 0.61 0.35 -1.38 -0.54 0.00 0.00 174.62 173.89 3dxa s HIS 188 N -0.89 0.29 -0.12 3.99 -3.43 -1.09 -5.01 115.29 109.03 3dxa s HIS 188 Ca 0.14 -0.65 0.00 0.00 -0.80 0.00 0.00 55.06 53.75 3dxa s HIS 188 Cb -0.12 0.05 0.02 0.00 -1.43 0.00 0.00 32.58 31.11 3dxa s HIS 188 CO 0.03 -0.78 -0.10 0.08 -2.00 0.00 0.00 174.74 171.96 3dxa s VAL 189 N -3.95 1.24 0.16 -5.38 1.01 -1.26 -0.09 120.40 112.13 3dxa s VAL 189 Ca 0.16 -0.43 0.05 0.00 0.00 0.00 0.00 61.98 61.75 3dxa s VAL 189 Cb 0.02 -1.21 -0.04 0.00 0.00 0.00 0.00 36.38 35.15 3dxa s VAL 189 CO 0.00 0.40 0.15 0.42 0.00 0.00 0.00 175.10 176.07 3dxa s THR 190 N 1.55 4.58 -0.15 3.92 -4.23 -0.50 -4.68 115.64 116.13 3dxa s THR 190 Ca 0.04 -1.02 -0.04 0.00 -1.18 0.00 0.00 61.69 59.48 3dxa s THR 190 Cb -0.13 -3.34 -0.03 0.00 1.34 0.00 0.00 72.50 70.34 3dxa s THR 190 CO -0.08 -0.09 -0.01 -2.28 -0.54 0.00 0.00 174.62 171.62 3dxa s HIS 191 N -1.73 3.10 -0.15 3.99 2.46 -1.26 -1.64 115.29 120.06 3dxa s HIS 191 Ca 0.31 -0.14 -0.04 0.00 0.47 0.00 0.00 55.06 55.66 3dxa s HIS 191 Cb -0.10 -1.97 0.07 0.00 -0.13 0.00 0.00 32.58 30.45 3dxa s HIS 191 CO 0.24 0.07 0.23 -1.01 -2.47 0.00 0.00 174.74 171.80 3dxa s HIS 192 N 0.23 -0.32 0.03 3.88 3.76 -0.14 -5.03 115.29 117.70 3dxa s HIS 192 Ca -0.00 0.59 -0.19 0.00 -0.15 0.00 0.00 55.06 55.31 3dxa s HIS 192 Cb -0.13 -0.21 -0.10 0.00 1.11 0.00 0.00 32.58 33.24 3dxa s HIS 192 CO 0.02 -0.44 1.29 -1.35 -0.85 0.00 0.00 174.74 173.41 3dxa h PRO 193 N 8.31 -0.65 0.00 8.40 0.11 -1.92 -0.32 132.00 145.94 3dxa h PRO 193 Ca -0.15 0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.00 3dxa h PRO 193 Cb 1.13 0.15 0.00 0.00 0.11 0.00 0.00 31.00 32.39 3dxa h PRO 193 CO 0.20 -0.43 0.00 1.51 -0.21 0.00 0.00 178.00 179.07 3dxa n ILE 194 N -3.91 0.62 0.08 4.15 3.06 -1.01 -4.32 119.36 118.04 3dxa n ILE 194 Ca -0.08 0.21 -0.03 0.00 -2.50 0.00 0.00 62.75 60.34 3dxa n ILE 194 Cb 0.27 -1.06 -0.07 0.00 0.54 0.00 0.00 39.64 39.32 3dxa n ILE 194 CO 0.00 0.00 0.00 0.28 -2.50 0.00 0.00 176.55 174.33 3dxa h SER 195 N 0.00 0.00 0.99 9.51 0.02 -0.97 -3.46 113.55 119.64 3dxa h SER 195 Ca 0.00 0.00 -0.19 0.00 -0.84 0.00 0.00 61.79 60.76 3dxa h SER 195 Cb 0.00 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.51 3dxa h SER 195 CO 0.00 0.80 -1.06 -2.24 -1.14 0.00 0.00 176.83 173.19 3dxa h ASP 196 N 0.00 0.00 0.00 3.07 2.03 -2.04 -3.47 116.42 116.01 3dxa h ASP 196 Ca -0.03 0.00 -0.35 0.00 -0.73 0.00 0.00 57.03 55.91 3dxa h ASP 196 Cb 1.64 0.00 0.02 0.00 -0.83 0.00 0.00 39.33 40.16 3dxa h ASP 196 CO 0.10 0.83 2.51 0.00 -1.03 0.00 0.00 179.24 181.65 3dxa n HIS 197 N -3.21 1.27 0.00 4.15 1.44 -1.26 -4.40 115.22 113.21 3dxa n HIS 197 Ca -0.04 -1.87 0.00 0.00 -2.01 0.00 0.00 57.72 53.80 3dxa n HIS 197 Cb 0.90 -1.60 0.00 0.00 0.12 0.00 0.00 29.99 29.41 3dxa n HIS 197 CO 0.00 0.00 0.00 0.39 -2.81 0.00 0.00 176.34 173.92 3dxa n GLU 198 N 4.26 0.00 -4.48 -1.40 -0.58 -1.26 -4.54 120.64 112.64 3dxa n GLU 198 Ca 0.42 0.00 -0.23 0.00 -0.42 0.00 0.00 57.16 56.93 3dxa n GLU 198 Cb 0.12 0.00 -0.10 0.00 -0.57 0.00 0.00 31.44 30.89 3dxa n GLU 198 CO 0.00 0.00 0.00 0.14 -0.48 0.00 0.00 177.13 176.79 3dxa s VAL 199 N -0.26 1.15 -0.19 2.62 -7.23 0.26 -0.24 120.40 116.52 3dxa s VAL 199 Ca 0.00 -2.00 0.00 0.00 -1.81 0.00 0.00 61.98 58.17 3dxa s VAL 199 Cb 0.00 -2.73 0.04 0.00 0.56 0.00 0.00 36.38 34.25 3dxa s VAL 199 CO 0.00 0.00 -0.08 -0.89 -0.31 0.00 0.00 175.10 173.82 3dxa s THR 200 N -3.24 1.43 0.73 5.32 2.01 -0.13 -0.82 115.64 120.94 3dxa s THR 200 Ca 0.34 -0.86 -0.09 0.00 0.31 0.00 0.00 61.69 61.39 3dxa s THR 200 Cb 0.08 -1.55 0.06 0.00 0.01 0.00 0.00 72.50 71.09 3dxa s THR 200 CO 0.15 0.15 1.07 -0.76 -0.69 0.00 0.00 174.62 174.55 3dxa s LEU 201 N 1.49 2.75 -0.25 4.42 1.43 0.52 -0.96 118.68 128.08 3dxa s LEU 201 Ca -0.00 0.68 -0.03 0.00 -1.03 0.00 0.00 54.13 53.74 3dxa s LEU 201 Cb -0.16 -3.30 0.14 0.00 0.03 0.00 0.00 46.19 42.90 3dxa s LEU 201 CO -0.08 -1.63 0.45 -0.60 0.23 0.00 0.00 176.35 174.72 3dxa s ARG 202 N -5.35 0.41 -0.44 1.70 3.52 -0.65 -2.28 118.95 115.85 3dxa s ARG 202 Ca 0.60 0.77 -0.24 0.00 -0.13 0.00 0.00 55.73 56.74 3dxa s ARG 202 Cb -0.11 -0.04 0.02 0.00 -1.56 0.00 0.00 34.95 33.27 3dxa s ARG 202 CO 0.47 -0.55 0.81 0.00 -0.81 0.00 0.00 175.30 175.22 3dxa s TRP 204 N 3.37 3.52 -0.12 0.00 0.52 0.88 -3.40 118.94 123.70 3dxa s TRP 204 Ca 0.32 0.74 0.02 0.00 0.02 0.00 0.00 56.10 57.20 3dxa s TRP 204 Cb -0.12 -2.39 -0.00 0.00 -1.15 0.00 0.00 33.47 29.81 3dxa s TRP 204 CO 0.23 0.28 -0.19 0.00 0.02 0.00 0.00 176.95 177.30 3dxa s ALA 205 N 0.27 2.39 0.00 0.98 0.00 0.14 -2.66 121.76 122.88 3dxa s ALA 205 Ca 0.20 -0.97 -0.06 0.00 0.00 0.00 0.00 51.96 51.14 3dxa s ALA 205 Cb -0.14 -1.03 -0.00 0.00 0.00 0.00 0.00 23.12 21.94 3dxa s ALA 205 CO 0.07 0.20 0.11 -0.51 0.00 0.00 0.00 175.76 175.63 3dxa s LEU 206 N 0.46 1.67 -1.12 0.00 1.43 -1.21 -1.79 118.68 118.12 3dxa s LEU 206 Ca -0.13 -0.24 -0.01 0.00 -1.03 0.00 0.00 54.13 52.72 3dxa s LEU 206 Cb -0.17 0.57 0.00 0.00 0.03 0.00 0.00 46.19 46.62 3dxa s LEU 206 CO 0.05 -0.35 0.94 0.61 0.23 0.00 0.00 176.35 177.84 3dxa n GLY 207 N 1.53 -0.31 3.34 -3.19 0.00 -0.89 -0.77 105.19 104.90 3dxa n GLY 207 Ca -0.23 0.07 -0.18 0.00 0.00 0.00 0.00 46.02 45.69 3dxa n GLY 207 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 3dxa s PHE 208 N -3.33 1.62 -0.21 1.61 -0.12 -1.21 -4.59 117.98 111.76 3dxa s PHE 208 Ca 0.07 -0.87 -0.22 0.00 -0.05 0.00 0.00 56.93 55.86 3dxa s PHE 208 Cb -0.03 -0.93 0.06 0.00 -0.63 0.00 0.00 43.02 41.49 3dxa s PHE 208 CO 0.67 0.03 0.61 -0.47 -0.05 0.00 0.00 175.22 176.01 3dxa s TYR 209 N -3.33 -0.66 0.10 3.49 5.04 -1.19 -0.59 117.35 120.22 3dxa s TYR 209 Ca 0.28 1.57 -0.02 0.00 -2.44 0.00 0.00 57.07 56.46 3dxa s TYR 209 Cb 0.05 0.24 0.02 0.00 0.35 0.00 0.00 41.96 42.62 3dxa s TYR 209 CO 0.09 -0.35 0.11 -0.35 -1.34 0.00 0.00 175.55 173.72 3dxa n PRO 210 N 2.58 -0.65 0.22 4.97 -0.04 -1.26 -2.19 135.00 138.62 3dxa n PRO 210 Ca -0.14 -0.18 0.09 0.00 -0.04 0.00 0.00 63.50 63.23 3dxa n PRO 210 Cb 0.56 -0.14 0.42 0.00 -0.04 0.00 0.00 33.50 34.30 3dxa n PRO 210 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3dxa h ALA 211 N -2.02 0.99 -2.52 0.55 0.00 -1.96 -3.45 119.26 110.85 3dxa h ALA 211 Ca -0.04 -0.22 -0.53 0.00 0.00 0.00 0.00 54.91 54.13 3dxa h ALA 211 Cb 0.11 -0.04 0.04 0.00 0.00 0.00 0.00 17.79 17.91 3dxa h ALA 211 CO 0.03 0.30 1.12 -1.91 0.00 0.00 0.00 179.25 178.79 3dxa n GLU 212 N -3.37 2.83 -3.54 0.00 4.07 -1.26 -4.96 120.64 114.40 3dxa n GLU 212 Ca 0.00 1.03 -0.08 0.00 -0.06 0.00 0.00 57.16 58.05 3dxa n GLU 212 Cb 0.46 -2.93 -0.03 0.00 -0.06 0.00 0.00 31.44 28.88 3dxa n GLU 212 CO 0.00 0.00 0.00 -1.50 -0.06 0.00 0.00 177.13 175.57 3dxa s ILE 213 N 2.68 0.00 -0.06 6.31 2.07 -1.26 -4.69 121.20 126.24 3dxa s ILE 213 Ca 0.81 0.00 -0.02 0.00 -1.41 0.00 0.00 60.65 60.04 3dxa s ILE 213 Cb -0.47 -1.00 0.03 0.00 0.13 0.00 0.00 42.46 41.15 3dxa s ILE 213 CO 0.37 0.00 0.03 -0.89 -1.91 0.00 0.00 174.94 172.53 3dxa s THR 214 N -2.32 0.17 -0.24 4.00 2.01 -0.75 -4.99 115.64 113.52 3dxa s THR 214 Ca 0.04 0.25 0.02 0.00 0.31 0.00 0.00 61.69 62.31 3dxa s THR 214 Cb -0.01 -0.37 0.05 0.00 0.01 0.00 0.00 72.50 72.18 3dxa s THR 214 CO -0.05 0.22 -0.12 -0.76 -0.69 0.00 0.00 174.62 173.22 3dxa s LEU 215 N 2.06 2.99 -0.29 4.42 1.43 -1.26 -1.16 118.68 126.87 3dxa s LEU 215 Ca 0.05 -1.18 -0.17 0.00 -1.03 0.00 0.00 54.13 51.80 3dxa s LEU 215 Cb -0.12 -1.47 0.17 0.00 0.03 0.00 0.00 46.19 44.80 3dxa s LEU 215 CO -0.04 -0.15 1.12 0.42 0.23 0.00 0.00 176.35 177.92 3dxa s THR 216 N 1.20 0.00 0.02 5.49 -4.23 -0.94 -4.59 115.64 112.58 3dxa s THR 216 Ca -0.05 0.00 -0.28 0.00 -1.18 0.00 0.00 61.69 60.18 3dxa s THR 216 Cb -0.18 -1.00 0.08 0.00 1.34 0.00 0.00 72.50 72.74 3dxa s THR 216 CO -0.07 0.00 0.69 -1.66 -0.54 0.00 0.00 174.62 173.04 3dxa s TRP 217 N 1.08 -0.57 0.16 3.99 1.48 -1.26 -4.60 118.94 119.21 3dxa s TRP 217 Ca -0.07 0.75 0.02 0.00 -1.06 0.00 0.00 56.10 55.74 3dxa s TRP 217 Cb -0.03 0.47 0.02 0.00 -1.16 0.00 0.00 33.47 32.78 3dxa s TRP 217 CO -0.12 -0.67 0.19 1.04 -4.06 0.00 0.00 176.95 173.33 3dxa n GLN 218 N 0.36 1.02 0.04 3.25 6.02 0.80 -4.13 117.38 124.75 3dxa n GLN 218 Ca -0.17 -0.92 0.00 0.00 -0.01 0.00 0.00 57.00 55.90 3dxa n GLN 218 Cb 0.60 -0.01 0.00 0.00 1.02 0.00 0.00 30.24 31.85 3dxa n GLN 218 CO 0.00 0.00 0.00 2.89 -1.01 0.00 0.00 177.06 178.94 3dxa n ARG 219 N -1.19 0.00 0.02 -1.09 1.85 -1.26 -3.54 116.66 111.45 3dxa n ARG 219 Ca 0.03 0.00 -0.22 0.00 -1.00 0.00 0.00 57.85 56.66 3dxa n ARG 219 Cb 0.17 -0.15 -0.14 0.00 -1.05 0.00 0.00 32.46 31.29 3dxa n ARG 219 CO 0.00 0.00 0.00 -0.44 -0.01 0.00 0.00 177.63 177.18 3dxa h ASP 220 N 0.00 0.45 0.00 2.89 5.19 -1.99 -3.41 116.42 119.55 3dxa h ASP 220 Ca 0.00 -0.93 0.00 0.00 -0.62 0.00 0.00 57.03 55.48 3dxa h ASP 220 Cb 0.00 -0.15 0.00 0.00 0.18 0.00 0.00 39.33 39.36 3dxa h ASP 220 CO 0.00 1.81 0.00 0.61 -3.12 0.00 0.00 179.24 178.54 3dxa n GLY 221 N 1.92 3.45 0.46 2.75 0.00 -1.26 -5.12 105.19 107.39 3dxa n GLY 221 Ca -0.30 -0.61 -0.07 0.00 0.00 0.00 0.00 46.02 45.04 3dxa n GLY 221 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3dxa n GLU 222 N 0.00 0.33 0.00 1.61 1.02 -1.26 -5.10 120.64 117.23 3dxa n GLU 222 Ca 0.00 0.13 0.00 0.00 -0.02 0.00 0.00 57.16 57.27 3dxa n GLU 222 Cb 0.00 -1.07 0.00 0.00 -0.02 0.00 0.00 31.44 30.35 3dxa n GLU 222 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 3dxa n ASP 223 N -4.05 0.00 0.10 1.62 2.03 -1.26 -4.67 116.55 110.32 3dxa n ASP 223 Ca -0.12 0.00 -0.03 0.00 0.52 0.00 0.00 54.79 55.16 3dxa n ASP 223 Cb 0.37 -0.21 0.17 0.00 -0.72 0.00 0.00 41.12 40.74 3dxa n ASP 223 CO 0.00 0.00 0.00 0.06 -1.92 0.00 0.00 177.20 175.34 3dxa h GLN 224 N 0.00 0.21 -0.29 -0.67 3.07 -1.93 -3.46 115.11 112.03 3dxa h GLN 224 Ca 0.00 -0.12 -0.01 0.00 0.09 0.00 0.00 58.65 58.60 3dxa h GLN 224 Cb 0.00 0.01 -0.01 0.00 0.08 0.00 0.00 27.48 27.56 3dxa h GLN 224 CO 0.00 0.68 0.00 2.41 0.09 0.00 0.00 178.83 182.01 3dxa n THR 225 N -3.93 2.35 -0.01 1.86 -1.04 -1.26 -3.91 114.28 108.33 3dxa n THR 225 Ca -0.02 -1.89 0.00 0.00 -2.04 0.00 0.00 64.05 60.10 3dxa n THR 225 Cb 0.56 -0.26 0.00 0.00 -1.82 0.00 0.00 70.33 68.80 3dxa n THR 225 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 3dxa n GLN 226 N -0.47 0.00 0.18 -2.82 6.02 -1.26 -4.99 117.38 114.05 3dxa n GLN 226 Ca 0.23 0.00 -0.15 0.00 -0.01 0.00 0.00 57.00 57.07 3dxa n GLN 226 Cb 0.93 0.00 -0.07 0.00 1.02 0.00 0.00 30.24 32.12 3dxa n GLN 226 CO 0.00 0.00 0.00 -0.44 -1.01 0.00 0.00 177.06 175.61 3dxa h ASP 227 N 0.00 -0.88 0.00 1.08 5.19 -2.00 -3.49 116.42 116.31 3dxa h ASP 227 Ca 0.00 0.08 0.00 0.00 -0.62 0.00 0.00 57.03 56.49 3dxa h ASP 227 Cb 0.00 0.31 0.00 0.00 0.18 0.00 0.00 39.33 39.82 3dxa h ASP 227 CO 0.00 -0.44 -0.04 0.41 -3.12 0.00 0.00 179.24 176.05 3dxa n THR 228 N -5.43 0.06 -4.07 0.35 -1.04 -1.26 -4.99 114.28 97.90 3dxa n THR 228 Ca -0.09 0.49 -0.33 0.00 -2.04 0.00 0.00 64.05 62.08 3dxa n THR 228 Cb 0.34 -1.53 -0.16 0.00 -1.82 0.00 0.00 70.33 67.16 3dxa n THR 228 CO 0.00 0.00 0.00 -0.70 -0.64 0.00 0.00 175.07 173.73 3dxa s GLU 229 N -1.07 3.04 0.59 -2.82 2.12 -1.26 -4.27 118.70 115.03 3dxa s GLU 229 Ca -0.01 -0.81 -0.10 0.00 0.36 0.00 0.00 54.97 54.41 3dxa s GLU 229 Cb 0.00 -2.67 -0.04 0.00 0.26 0.00 0.00 34.13 31.68 3dxa s GLU 229 CO 0.02 -0.22 0.98 -1.17 -0.54 0.00 0.00 175.26 174.32 3dxa s LEU 230 N 1.32 3.31 0.05 2.70 2.96 -1.26 -1.87 118.68 125.89 3dxa s LEU 230 Ca 0.05 1.30 0.03 0.00 -0.22 0.00 0.00 54.13 55.29 3dxa s LEU 230 Cb -0.14 -4.32 -0.03 0.00 0.50 0.00 0.00 46.19 42.20 3dxa s LEU 230 CO -0.11 -0.82 -0.09 0.54 -1.32 0.00 0.00 176.35 174.55 3dxa s VAL 231 N -3.09 0.68 0.22 1.68 0.11 -1.00 -4.97 120.40 114.04 3dxa s VAL 231 Ca 0.53 -1.20 -0.32 0.00 -2.93 0.00 0.00 61.98 58.07 3dxa s VAL 231 Cb -0.11 -0.79 -0.13 0.00 -1.53 0.00 0.00 36.38 33.82 3dxa s VAL 231 CO 0.52 -0.38 1.49 -0.62 -3.33 0.00 0.00 175.10 172.77 3dxa n GLU 232 N 1.30 2.15 -1.92 1.54 1.02 -1.26 -4.62 120.64 118.85 3dxa n GLU 232 Ca -0.22 0.77 -0.42 0.00 -0.02 0.00 0.00 57.16 57.27 3dxa n GLU 232 Cb 0.55 -2.48 -0.03 0.00 -0.02 0.00 0.00 31.44 29.47 3dxa n GLU 232 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 3dxa s THR 233 N 0.28 3.36 0.07 2.62 2.01 -1.26 -4.84 115.64 117.88 3dxa s THR 233 Ca 0.71 0.35 0.02 0.00 0.31 0.00 0.00 61.69 63.08 3dxa s THR 233 Cb -0.64 -3.55 -0.04 0.00 0.01 0.00 0.00 72.50 68.28 3dxa s THR 233 CO 0.45 -0.39 0.13 0.00 -0.69 0.00 0.00 174.62 174.13 3dxa s ARG 234 N 6.11 3.12 -0.02 4.92 1.70 -0.91 -4.89 118.95 128.97 3dxa s ARG 234 Ca 0.82 -0.58 -0.27 0.00 -0.47 0.00 0.00 55.73 55.23 3dxa s ARG 234 Cb -0.22 -2.86 -0.04 0.00 -0.57 0.00 0.00 34.95 31.26 3dxa s ARG 234 CO 0.32 0.58 0.83 -1.25 -1.08 0.00 0.00 175.30 174.70 3dxa s PRO 235 N -2.44 4.50 0.24 3.89 0.04 -1.26 -0.17 135.00 139.80 3dxa s PRO 235 Ca 0.32 1.15 -0.02 0.00 0.04 0.00 0.00 61.00 62.48 3dxa s PRO 235 Cb -0.13 -3.44 0.28 0.00 0.04 0.00 0.00 34.50 31.25 3dxa s PRO 235 CO 0.25 0.04 1.69 0.00 0.04 0.00 0.00 177.00 179.02 3dxa h ALA 236 N 6.62 1.00 0.00 8.56 0.00 -1.15 -3.47 119.26 130.83 3dxa h ALA 236 Ca -0.41 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.17 3dxa h ALA 236 Cb 1.21 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.84 3dxa h ALA 236 CO 0.75 0.60 0.00 0.41 0.00 0.00 0.00 179.25 181.00 3dxa n GLY 237 N -0.42 1.11 2.29 0.00 0.00 -1.25 -4.96 105.19 101.96 3dxa n GLY 237 Ca 0.01 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.72 3dxa n GLY 237 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 3dxa n ASP 238 N 0.00 6.42 -2.17 1.61 5.75 -1.26 -4.85 116.55 122.06 3dxa n ASP 238 Ca 0.00 -3.72 -0.19 0.00 -0.01 0.00 0.00 54.79 50.87 3dxa n ASP 238 Cb 0.00 -0.93 -0.03 0.00 -1.03 0.00 0.00 41.12 39.13 3dxa n ASP 238 CO 0.00 0.00 0.00 -1.14 -0.11 0.00 0.00 177.20 175.95 3dxa n ARG 239 N -0.98 -1.70 -4.57 0.11 0.63 -1.26 -4.99 116.66 103.90 3dxa n ARG 239 Ca 0.62 0.97 -0.26 0.00 -0.92 0.00 0.00 57.85 58.26 3dxa n ARG 239 Cb 0.99 -5.54 -0.10 0.00 0.45 0.00 0.00 32.46 28.25 3dxa n ARG 239 CO 0.00 0.00 0.00 0.95 -2.51 0.00 0.00 177.63 176.07 3dxa s THR 240 N -2.85 1.58 0.28 5.15 -4.23 -1.26 -4.80 115.64 109.51 3dxa s THR 240 Ca 0.00 -2.00 0.02 0.00 -1.18 0.00 0.00 61.69 58.53 3dxa s THR 240 Cb 0.00 -2.83 -0.05 0.00 1.34 0.00 0.00 72.50 70.95 3dxa s THR 240 CO 0.00 0.00 0.09 -0.36 -0.54 0.00 0.00 174.62 173.81 3dxa s PHE 241 N -2.96 1.68 0.09 3.99 0.40 0.24 -0.61 117.98 120.81 3dxa s PHE 241 Ca 0.33 -1.12 0.00 0.00 -0.60 0.00 0.00 56.93 55.54 3dxa s PHE 241 Cb 0.09 -1.02 -0.04 0.00 0.51 0.00 0.00 43.02 42.55 3dxa s PHE 241 CO 0.16 -0.23 -0.03 -0.65 0.70 0.00 0.00 175.22 175.16 3dxa s GLN 242 N -3.98 0.77 -0.20 0.44 -0.21 0.76 -2.10 119.66 115.13 3dxa s GLN 242 Ca 0.37 -1.31 -0.31 0.00 0.02 0.00 0.00 55.36 54.13 3dxa s GLN 242 Cb 0.08 0.01 0.15 0.00 1.00 0.00 0.00 33.01 34.26 3dxa s GLN 242 CO 0.14 -0.09 1.17 0.21 -2.12 0.00 0.00 175.29 174.61 3dxa s LYS 243 N -3.90 0.34 -0.13 2.91 2.20 -0.74 -2.13 119.74 118.29 3dxa s LYS 243 Ca 0.12 0.01 -0.10 0.00 -0.36 0.00 0.00 55.97 55.64 3dxa s LYS 243 Cb 0.07 0.16 0.04 0.00 -1.51 0.00 0.00 37.83 36.59 3dxa s LYS 243 CO -0.06 -0.12 0.33 1.67 -0.36 0.00 0.00 175.35 176.81 3dxa s TRP 244 N -1.51 -0.39 0.57 4.03 1.48 -1.26 -0.68 118.94 121.18 3dxa s TRP 244 Ca 0.05 0.93 -0.14 0.00 -1.06 0.00 0.00 56.10 55.88 3dxa s TRP 244 Cb -0.01 0.13 -0.06 0.00 -1.16 0.00 0.00 33.47 32.38 3dxa s TRP 244 CO -0.04 -0.21 1.01 0.00 -4.06 0.00 0.00 176.95 173.66 3dxa s ALA 245 N 0.51 3.01 0.00 2.67 0.00 -1.22 -2.37 121.76 124.36 3dxa s ALA 245 Ca -0.03 0.11 0.00 0.00 0.00 0.00 0.00 51.96 52.05 3dxa s ALA 245 Cb -0.04 -3.12 0.00 0.00 0.00 0.00 0.00 23.12 19.95 3dxa s ALA 245 CO -0.03 -0.52 0.00 0.00 0.00 0.00 0.00 175.76 175.22 3dxa n ALA 246 N -2.11 0.00 -4.29 0.00 0.00 -0.78 -1.30 120.51 112.02 3dxa n ALA 246 Ca 0.07 0.00 -0.15 0.00 0.00 0.00 0.00 53.44 53.36 3dxa n ALA 246 Cb 0.54 0.00 -0.03 0.00 0.00 0.00 0.00 19.45 19.96 3dxa n ALA 246 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 3dxa n VAL 247 N 0.00 0.00 -3.66 0.00 0.24 -0.97 -2.19 118.33 111.76 3dxa n VAL 247 Ca 0.00 -1.12 -0.38 0.00 -2.04 0.00 0.00 64.34 60.80 3dxa n VAL 247 Cb 0.00 0.25 -0.12 0.00 -1.47 0.00 0.00 33.84 32.50 3dxa n VAL 247 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 3dxa s VAL 248 N -1.91 4.77 0.08 3.34 1.01 -1.26 -0.35 120.40 126.08 3dxa s VAL 248 Ca 0.01 -0.16 0.02 0.00 0.00 0.00 0.00 61.98 61.86 3dxa s VAL 248 Cb 0.00 -3.33 -0.03 0.00 0.00 0.00 0.00 36.38 33.02 3dxa s VAL 248 CO 0.01 0.20 -0.08 0.68 0.00 0.00 0.00 175.10 175.91 3dxa s VAL 249 N 1.67 0.69 0.66 2.92 -7.23 -0.00 -4.98 120.40 114.13 3dxa s VAL 249 Ca 0.06 -1.60 -0.17 0.00 -1.81 0.00 0.00 61.98 58.47 3dxa s VAL 249 Cb -0.16 -1.27 -0.00 0.00 0.56 0.00 0.00 36.38 35.51 3dxa s VAL 249 CO 0.07 -0.65 1.20 -2.84 -0.31 0.00 0.00 175.10 172.58 3dxa s PRO 250 N -2.89 2.59 0.29 4.82 0.02 -1.26 0.92 135.00 139.49 3dxa s PRO 250 Ca 0.03 1.77 -0.25 0.00 0.02 0.00 0.00 61.00 62.58 3dxa s PRO 250 Cb -0.01 -1.89 -0.09 0.00 0.02 0.00 0.00 34.50 32.53 3dxa s PRO 250 CO -0.02 -1.49 0.89 -1.54 -0.33 0.00 0.00 177.00 174.51 3dxa s SER 251 N -1.86 7.30 -0.42 2.53 1.04 -1.26 -3.36 113.70 117.67 3dxa s SER 251 Ca 0.76 1.75 0.00 0.00 0.48 0.00 0.00 55.95 58.93 3dxa s SER 251 Cb -0.29 -2.54 0.00 0.00 0.10 0.00 0.00 66.02 63.28 3dxa s SER 251 CO 0.39 -0.03 0.00 0.61 0.98 0.00 0.00 173.24 175.20 3dxa n GLY 252 N 0.67 0.63 0.00 7.32 0.00 -1.26 -4.83 105.19 107.73 3dxa n GLY 252 Ca 0.01 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.76 3dxa n GLY 252 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3dxa n GLU 253 N -1.88 0.00 0.00 1.61 -0.58 -1.21 -4.94 120.64 113.63 3dxa n GLU 253 Ca -0.04 0.21 0.00 0.00 -0.42 0.00 0.00 57.16 56.91 3dxa n GLU 253 Cb 0.25 -1.19 0.00 0.00 -0.57 0.00 0.00 31.44 29.94 3dxa n GLU 253 CO 0.00 0.00 0.00 -1.91 -0.48 0.00 0.00 177.13 174.74 3dxa n GLU 254 N -1.13 0.00 0.00 3.49 2.13 -1.26 -4.77 120.64 119.10 3dxa n GLU 254 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 3dxa n GLU 254 Cb 0.00 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.71 3dxa n GLU 254 CO 0.00 0.00 0.00 1.04 -0.41 0.00 0.00 177.13 177.76 3dxa n GLN 255 N -0.49 0.29 -0.18 5.31 1.13 -1.26 -3.07 117.38 119.11 3dxa n GLN 255 Ca 0.00 0.00 -0.10 0.00 -1.94 0.00 0.00 57.00 54.96 3dxa n GLN 255 Cb 0.00 -1.02 0.01 0.00 0.11 0.00 0.00 30.24 29.34 3dxa n GLN 255 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 3dxa h ARG 256 N 0.09 0.94 -6.02 -1.09 3.08 -1.89 -3.45 114.38 106.03 3dxa h ARG 256 Ca 0.00 -0.33 -0.57 0.00 0.07 0.00 0.00 59.98 59.15 3dxa h ARG 256 Cb 0.02 -0.07 -0.06 0.00 0.08 0.00 0.00 29.97 29.94 3dxa h ARG 256 CO 0.00 0.99 0.40 0.71 -1.07 0.00 0.00 179.97 181.00 3dxa s TYR 257 N -4.90 3.46 -0.06 3.04 1.51 -1.17 -4.46 117.35 114.75 3dxa s TYR 257 Ca -0.12 1.33 0.05 0.00 -1.01 0.00 0.00 57.07 57.31 3dxa s TYR 257 Cb 0.12 -3.03 -0.00 0.00 -0.11 0.00 0.00 41.96 38.94 3dxa s TYR 257 CO 0.84 -0.20 -0.20 0.95 -1.11 0.00 0.00 175.55 175.83 3dxa s THR 258 N 1.97 1.68 0.40 -0.71 -4.23 -1.23 -4.62 115.64 108.89 3dxa s THR 258 Ca 0.40 -0.84 0.06 0.00 -1.18 0.00 0.00 61.69 60.13 3dxa s THR 258 Cb -0.17 -1.44 0.00 0.00 1.34 0.00 0.00 72.50 72.23 3dxa s THR 258 CO 0.14 0.48 0.56 0.00 -0.54 0.00 0.00 174.62 175.25 3dxa s HIS 260 N -2.33 -0.59 -0.42 0.00 3.76 -1.26 -1.83 115.29 112.62 3dxa s HIS 260 Ca 0.49 0.61 0.09 0.00 -0.15 0.00 0.00 55.06 56.10 3dxa s HIS 260 Cb -0.10 0.20 0.32 0.00 1.11 0.00 0.00 32.58 34.11 3dxa s HIS 260 CO 0.33 -0.32 0.87 0.28 -0.85 0.00 0.00 174.74 175.05 3dxa n VAL 261 N 5.45 -0.15 -2.49 -0.90 0.31 -1.23 -2.21 118.33 117.12 3dxa n VAL 261 Ca -0.06 -3.09 -0.43 0.00 -0.01 0.00 0.00 64.34 60.76 3dxa n VAL 261 Cb 0.54 0.39 -0.02 0.00 -0.91 0.00 0.00 33.84 33.83 3dxa n VAL 261 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 3dxa s GLN 262 N -1.00 4.31 0.03 5.55 -0.21 -0.31 -4.19 119.66 123.84 3dxa s GLN 262 Ca 0.32 1.61 -0.06 0.00 0.02 0.00 0.00 55.36 57.25 3dxa s GLN 262 Cb 0.30 -3.64 -0.01 0.00 1.00 0.00 0.00 33.01 30.66 3dxa s GLN 262 CO -0.09 -0.55 0.12 -1.58 -2.12 0.00 0.00 175.29 171.08 3dxa s HIS 263 N 2.76 0.15 -0.61 0.91 2.46 -1.26 -1.81 115.29 117.89 3dxa s HIS 263 Ca 0.54 -0.42 0.25 0.00 0.47 0.00 0.00 55.06 55.90 3dxa s HIS 263 Cb -0.22 -0.11 0.51 0.00 -0.13 0.00 0.00 32.58 32.63 3dxa s HIS 263 CO 0.17 -0.37 1.54 1.05 -2.47 0.00 0.00 174.74 174.66 3dxa h GLU 264 N 3.69 0.00 0.27 2.88 4.11 -1.94 -3.23 114.58 120.35 3dxa h GLU 264 Ca -0.32 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.09 3dxa h GLU 264 Cb 1.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.44 3dxa h GLU 264 CO 0.49 0.00 -0.13 0.78 0.07 0.00 0.00 179.01 180.22 3dxa h GLY 265 N 4.38 -0.37 -4.03 1.06 0.00 -1.85 -3.44 103.07 98.82 3dxa h GLY 265 Ca 0.00 0.14 -0.52 0.00 0.00 0.00 0.00 47.33 46.94 3dxa h GLY 265 CO 0.00 -0.14 0.68 1.08 0.00 0.00 0.00 176.54 178.17 3dxa s LEU 266 N -9.84 4.41 -0.56 3.11 1.43 -1.22 -4.71 118.68 111.29 3dxa s LEU 266 Ca -0.15 2.68 -0.23 0.00 -1.03 0.00 0.00 54.13 55.40 3dxa s LEU 266 Cb 0.04 -3.64 0.05 0.00 0.03 0.00 0.00 46.19 42.67 3dxa s LEU 266 CO 0.61 -0.60 0.88 -2.16 0.23 0.00 0.00 176.35 175.31 3dxa s PRO 267 N -1.22 3.24 0.00 1.29 0.04 -1.26 -4.82 135.00 132.28 3dxa s PRO 267 Ca 0.53 -0.51 0.00 0.00 0.04 0.00 0.00 61.00 61.06 3dxa s PRO 267 Cb -0.40 -4.10 0.00 0.00 0.04 0.00 0.00 34.50 30.04 3dxa s PRO 267 CO 0.49 -1.49 0.00 1.63 0.04 0.00 0.00 177.00 177.67 3dxa n LYS 268 N 7.24 0.00 -2.79 4.56 4.76 -1.26 -4.90 118.16 125.76 3dxa n LYS 268 Ca -0.01 0.00 -0.31 0.00 -2.87 0.00 0.00 58.31 55.12 3dxa n LYS 268 Cb 0.47 0.00 -0.04 0.00 -1.84 0.00 0.00 35.03 33.62 3dxa n LYS 268 CO 0.00 0.00 0.00 -1.25 -1.37 0.00 0.00 177.40 174.78 3dxa s PRO 269 N -0.38 3.86 1.02 1.97 0.04 -1.26 -5.14 135.00 135.10 3dxa s PRO 269 Ca 0.00 0.62 -0.12 0.00 0.04 0.00 0.00 61.00 61.54 3dxa s PRO 269 Cb 0.00 -2.33 0.20 0.00 0.04 0.00 0.00 34.50 32.41 3dxa s PRO 269 CO 0.00 -0.06 1.08 -0.51 0.04 0.00 0.00 177.00 177.55 3dxa s LEU 270 N -3.75 1.67 -0.09 -3.56 2.01 -1.26 -4.85 118.68 108.84 3dxa s LEU 270 Ca 0.54 1.51 -0.02 0.00 0.01 0.00 0.00 54.13 56.16 3dxa s LEU 270 Cb -0.10 -3.69 0.04 0.00 0.01 0.00 0.00 46.19 42.45 3dxa s LEU 270 CO 0.29 -3.36 0.05 -0.89 1.01 0.00 0.00 176.35 173.44 3dxa s THR 271 N -2.74 0.11 0.32 5.49 2.01 -1.25 -3.97 115.64 115.60 3dxa s THR 271 Ca 0.66 0.11 0.10 0.00 0.31 0.00 0.00 61.69 62.86 3dxa s THR 271 Cb -0.21 -0.45 -0.05 0.00 0.01 0.00 0.00 72.50 71.80 3dxa s THR 271 CO 0.60 0.07 -0.06 -0.76 -0.69 0.00 0.00 174.62 173.78 3dxa s LEU 272 N 2.07 2.87 0.20 4.42 1.02 -0.76 -4.89 118.68 123.62 3dxa s LEU 272 Ca 0.04 -1.00 -0.08 0.00 0.02 0.00 0.00 54.13 53.11 3dxa s LEU 272 Cb -0.13 -1.27 -0.02 0.00 0.02 0.00 0.00 46.19 44.79 3dxa s LEU 272 CO -0.05 -0.14 0.30 -0.13 0.02 0.00 0.00 176.35 176.34 3dxa s ARG 273 N -3.64 1.30 0.33 1.70 0.52 -1.26 0.47 118.95 118.36 3dxa s ARG 273 Ca 0.33 -1.36 -0.29 0.00 -0.52 0.00 0.00 55.73 53.89 3dxa s ARG 273 Cb -0.01 0.37 -0.11 0.00 0.52 0.00 0.00 34.95 35.72 3dxa s ARG 273 CO 0.18 -0.49 1.45 -0.46 0.02 0.00 0.00 175.30 176.00 3dxa s TRP 274 N -4.05 2.81 -0.06 -0.53 -0.00 -1.26 -4.66 118.94 111.18 3dxa s TRP 274 Ca 0.26 1.14 -0.04 0.00 -0.00 0.00 0.00 56.10 57.46 3dxa s TRP 274 Cb 0.03 -3.91 -0.01 0.00 -0.00 0.00 0.00 33.47 29.58 3dxa s TRP 274 CO 0.07 -2.76 -0.07 1.49 -0.00 0.00 0.00 176.95 175.68 3dxa h GLU 275 N 3.79 0.00 -0.00 5.86 4.57 -2.01 -3.48 114.58 123.30 3dxa h GLU 275 Ca -0.49 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.69 3dxa h GLU 275 Cb 1.23 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.82 3dxa h GLU 275 CO 0.70 0.00 0.00 -0.35 -1.18 0.00 0.00 179.01 178.18