#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2w4i s LYS 2 N 0.00 3.69 0.29 2.12 2.20 -1.26 -2.37 119.74 124.41 2w4i s LYS 2 Ca 0.00 -0.48 0.06 0.00 -0.36 0.00 0.00 55.97 55.19 2w4i s LYS 2 Cb 0.00 -3.14 -0.06 0.00 -1.51 0.00 0.00 37.83 33.12 2w4i s LYS 2 CO 0.00 0.03 -0.04 0.96 -0.36 0.00 0.00 175.35 175.94 2w4i s ILE 3 N 0.97 1.60 0.11 5.43 -4.36 -0.28 -0.44 121.20 124.24 2w4i s ILE 3 Ca 0.02 -2.10 0.05 0.00 -0.26 0.00 0.00 60.65 58.36 2w4i s ILE 3 Cb -0.14 -2.52 -0.04 0.00 1.25 0.00 0.00 42.46 41.01 2w4i s ILE 3 CO 0.02 -0.25 0.01 -0.83 0.24 0.00 0.00 174.94 174.13 2w4i s GLY 4 N -3.46 1.87 -0.09 6.27 0.00 -0.52 -0.67 107.32 110.72 2w4i s GLY 4 Ca 0.31 -1.17 0.01 0.00 0.00 0.00 0.00 44.72 43.86 2w4i s GLY 4 CO 0.13 -1.16 -0.10 0.14 0.00 0.00 0.00 173.10 172.11 2w4i s VAL 5 N -1.42 1.07 -0.13 1.40 1.01 0.10 -1.02 120.40 121.41 2w4i s VAL 5 Ca 0.26 -0.39 0.00 0.00 0.00 0.00 0.00 61.98 61.86 2w4i s VAL 5 Cb -0.11 -1.03 -0.01 0.00 0.00 0.00 0.00 36.38 35.23 2w4i s VAL 5 CO 0.19 0.36 -0.14 0.12 0.00 0.00 0.00 175.10 175.62 2w4i s PHE 6 N 1.13 2.79 0.14 5.22 5.36 0.24 -0.63 117.98 132.22 2w4i s PHE 6 Ca -0.06 -0.68 -0.01 0.00 -0.96 0.00 0.00 56.93 55.22 2w4i s PHE 6 Cb -0.14 -1.83 -0.04 0.00 -0.34 0.00 0.00 43.02 40.67 2w4i s PHE 6 CO -0.02 -0.23 0.07 0.34 -1.46 0.00 0.00 175.22 173.92 2w4i s ASP 7 N 0.35 0.28 0.51 6.13 2.15 -0.58 -0.80 116.67 124.71 2w4i s ASP 7 Ca -0.12 -1.21 0.34 0.00 0.43 0.00 0.00 52.55 51.99 2w4i s ASP 7 Cb -0.16 0.31 1.64 0.00 -0.30 0.00 0.00 42.92 44.41 2w4i s ASP 7 CO 0.06 -0.74 2.02 0.77 -0.17 0.00 0.00 175.17 177.11 2w4i h SER 8 N 2.83 0.00 0.00 -0.34 4.64 -1.89 -1.17 113.55 117.62 2w4i h SER 8 Ca -0.35 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.97 2w4i h SER 8 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 2w4i h SER 8 CO 0.58 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 177.15 2w4i n GLY 9 N -0.56 1.14 0.02 -0.77 0.00 -1.26 -2.38 105.19 101.38 2w4i n GLY 9 Ca -0.01 0.35 0.11 0.00 0.00 0.00 0.00 46.02 46.47 2w4i n GLY 9 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2w4i n VAL 10 N 0.00 0.09 -0.09 1.61 0.24 -1.26 -4.39 118.33 114.53 2w4i n VAL 10 Ca 0.00 -0.19 0.14 0.00 -2.04 0.00 0.00 64.34 62.25 2w4i n VAL 10 Cb 0.00 0.40 0.54 0.00 -1.47 0.00 0.00 33.84 33.30 2w4i n VAL 10 CO 0.00 0.00 0.00 1.23 -2.14 0.00 0.00 176.83 175.92 2w4i h GLY 11 N 4.63 0.52 2.00 7.63 0.00 -1.95 -1.08 103.07 114.81 2w4i h GLY 11 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 47.33 47.19 2w4i h GLY 11 CO 0.00 0.07 0.00 -1.33 0.00 0.00 0.00 176.54 175.28 2w4i h GLY 12 N 0.34 0.00 2.00 4.60 0.00 -1.87 -1.12 103.07 107.02 2w4i h GLY 12 Ca 0.30 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.62 2w4i h GLY 12 CO -0.08 0.00 -0.05 0.74 0.00 0.00 0.00 176.54 177.15 2w4i h PHE 13 N 0.00 0.00 -0.11 5.60 0.05 -1.50 0.26 116.94 121.24 2w4i h PHE 13 Ca 0.00 0.00 -0.10 0.00 3.82 0.00 0.00 57.97 61.69 2w4i h PHE 13 Cb 0.04 0.00 -0.01 0.00 2.00 0.00 0.00 35.95 37.98 2w4i h PHE 13 CO 0.00 0.05 -0.40 0.66 -0.18 0.00 0.00 178.31 178.45 2w4i h SER 14 N 0.00 0.24 0.01 2.17 4.64 -1.41 -0.06 113.55 119.14 2w4i h SER 14 Ca -0.00 -0.10 -0.08 0.00 -0.47 0.00 0.00 61.79 61.14 2w4i h SER 14 Cb 0.15 -0.07 0.01 0.00 -0.31 0.00 0.00 62.40 62.18 2w4i h SER 14 CO 0.01 0.62 -0.33 0.58 -0.87 0.00 0.00 176.83 176.84 2w4i h VAL 15 N 0.20 1.54 -0.82 0.95 2.07 -1.36 -3.21 116.25 115.62 2w4i h VAL 15 Ca 0.02 -2.04 0.18 0.00 0.82 0.00 0.00 66.70 65.68 2w4i h VAL 15 Cb 0.79 2.82 -0.11 0.00 -1.52 0.00 0.00 31.29 33.26 2w4i h VAL 15 CO 0.06 0.56 0.29 0.25 0.02 0.00 0.00 177.57 178.76 2w4i h LEU 16 N -0.46 0.19 -0.46 2.57 5.85 -0.96 -0.74 115.31 121.30 2w4i h LEU 16 Ca -0.04 0.14 0.08 0.00 0.84 0.00 0.00 57.88 58.90 2w4i h LEU 16 Cb 1.10 0.15 -0.06 0.00 0.37 0.00 0.00 40.66 42.22 2w4i h LEU 16 CO 0.06 0.00 0.10 0.50 -0.34 0.00 0.00 178.44 178.76 2w4i h LYS 17 N 0.36 0.23 -0.65 1.25 3.64 -1.06 -0.06 116.57 120.27 2w4i h LYS 17 Ca 0.48 -0.01 -0.02 0.00 -1.27 0.00 0.00 60.65 59.82 2w4i h LYS 17 Cb 0.85 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.59 2w4i h LYS 17 CO -0.50 0.15 0.32 0.77 -2.27 0.00 0.00 179.45 177.91 2w4i h SER 18 N 0.23 0.86 -0.72 4.20 0.02 -1.26 -1.54 113.55 115.34 2w4i h SER 18 Ca 0.23 -0.13 -0.06 0.00 -0.84 0.00 0.00 61.79 60.98 2w4i h SER 18 Cb 0.29 -0.22 -0.03 0.00 0.14 0.00 0.00 62.40 62.58 2w4i h SER 18 CO -0.29 0.75 0.20 -0.07 -1.14 0.00 0.00 176.83 176.27 2w4i h LEU 19 N 0.90 1.07 -0.29 5.07 3.38 -0.39 -1.87 115.31 123.19 2w4i h LEU 19 Ca 0.22 -0.22 -0.18 0.00 0.09 0.00 0.00 57.88 57.79 2w4i h LEU 19 Cb 0.12 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.59 2w4i h LEU 19 CO -0.03 1.01 -0.53 -0.07 0.09 0.00 0.00 178.44 178.92 2w4i h LEU 20 N 1.08 0.97 -0.52 1.67 3.38 -0.93 -2.12 115.31 118.83 2w4i h LEU 20 Ca 0.23 -0.53 0.06 0.00 0.09 0.00 0.00 57.88 57.73 2w4i h LEU 20 Cb 0.34 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 40.76 2w4i h LEU 20 CO -0.00 1.32 0.22 0.50 0.09 0.00 0.00 178.44 180.56 2w4i h LYS 21 N 0.66 0.41 0.00 1.13 1.63 -1.12 -2.25 116.57 117.03 2w4i h LYS 21 Ca 0.02 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.79 2w4i h LYS 21 Cb 1.14 -0.09 0.00 0.00 -0.60 0.00 0.00 32.23 32.68 2w4i h LYS 21 CO 0.12 0.27 0.00 0.00 -3.45 0.00 0.00 179.45 176.39 2w4i h ALA 22 N 1.32 1.00 -5.75 5.00 0.00 -1.21 -3.47 119.26 116.15 2w4i h ALA 22 Ca 0.25 0.00 -0.43 0.00 0.00 0.00 0.00 54.91 54.72 2w4i h ALA 22 Cb 0.23 0.00 0.03 0.00 0.00 0.00 0.00 17.79 18.05 2w4i h ALA 22 CO -0.22 0.00 -0.69 0.54 0.00 0.00 0.00 179.25 178.88 2w4i n ARG 23 N -2.62 -5.89 0.08 0.00 1.74 -0.81 -3.89 116.66 105.26 2w4i n ARG 23 Ca 0.02 0.71 -0.10 0.00 -0.77 0.00 0.00 57.85 57.71 2w4i n ARG 23 Cb 0.31 -5.62 -0.02 0.00 -1.02 0.00 0.00 32.46 26.11 2w4i n ARG 23 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 2w4i h LEU 24 N -2.02 0.36 -8.57 0.55 3.38 -1.80 -2.18 115.31 105.04 2w4i h LEU 24 Ca -0.55 -0.29 -0.65 0.00 0.09 0.00 0.00 57.88 56.48 2w4i h LEU 24 Cb 1.36 -0.11 -0.28 0.00 0.09 0.00 0.00 40.66 41.72 2w4i h LEU 24 CO 0.61 1.08 -0.87 -0.36 0.09 0.00 0.00 178.44 178.99 2w4i s PHE 25 N -3.26 2.08 0.17 1.13 0.40 -1.26 -4.71 117.98 112.53 2w4i s PHE 25 Ca -0.04 -0.39 -0.01 0.00 -0.60 0.00 0.00 56.93 55.88 2w4i s PHE 25 Cb 0.10 -1.30 0.04 0.00 0.51 0.00 0.00 43.02 42.36 2w4i s PHE 25 CO 0.84 0.02 1.41 -0.44 0.70 0.00 0.00 175.22 177.76 2w4i h ASP 26 N 5.28 0.46 -3.43 1.36 3.32 -1.81 -3.43 116.42 118.17 2w4i h ASP 26 Ca -0.42 -0.32 -0.21 0.00 0.02 0.00 0.00 57.03 56.10 2w4i h ASP 26 Cb 1.14 -0.14 -0.30 0.00 0.22 0.00 0.00 39.33 40.25 2w4i h ASP 26 CO 0.46 1.07 -0.53 -0.70 -1.72 0.00 0.00 179.24 177.82 2w4i s GLU 27 N -3.54 0.16 -0.09 3.56 2.12 -1.09 -1.38 118.70 118.44 2w4i s GLU 27 Ca -0.05 0.44 0.01 0.00 0.36 0.00 0.00 54.97 55.73 2w4i s GLU 27 Cb 0.10 -0.12 0.02 0.00 0.26 0.00 0.00 34.13 34.39 2w4i s GLU 27 CO 0.84 -0.15 -0.11 0.42 -0.54 0.00 0.00 175.26 175.72 2w4i s ILE 28 N 1.10 1.14 -0.43 -3.70 1.01 -0.37 -1.12 121.20 118.82 2w4i s ILE 28 Ca -0.08 -0.44 -0.12 0.00 0.00 0.00 0.00 60.65 60.01 2w4i s ILE 28 Cb -0.10 -1.08 0.07 0.00 0.01 0.00 0.00 42.46 41.36 2w4i s ILE 28 CO -0.07 0.37 0.31 -0.63 0.00 0.00 0.00 174.94 174.92 2w4i s ILE 29 N 1.06 4.65 -0.14 2.92 -1.09 0.15 -1.12 121.20 127.62 2w4i s ILE 29 Ca -0.07 -1.22 -0.19 0.00 -2.23 0.00 0.00 60.65 56.95 2w4i s ILE 29 Cb -0.15 -3.79 -0.04 0.00 -1.58 0.00 0.00 42.46 36.91 2w4i s ILE 29 CO -0.01 -0.51 0.51 -0.47 -1.23 0.00 0.00 174.94 173.24 2w4i s TYR 30 N 1.52 3.47 -0.16 3.97 5.04 0.03 -0.72 117.35 130.50 2w4i s TYR 30 Ca 0.03 0.89 0.00 0.00 -2.44 0.00 0.00 57.07 55.55 2w4i s TYR 30 Cb -0.23 -2.62 0.03 0.00 0.35 0.00 0.00 41.96 39.49 2w4i s TYR 30 CO 0.04 0.07 -0.10 -0.47 -1.34 0.00 0.00 175.55 173.75 2w4i s TYR 31 N 0.99 2.00 -0.21 4.97 5.04 0.20 -0.67 117.35 129.67 2w4i s TYR 31 Ca 0.26 -1.21 -0.05 0.00 -2.44 0.00 0.00 57.07 53.64 2w4i s TYR 31 Cb -0.15 -1.47 -0.02 0.00 0.35 0.00 0.00 41.96 40.66 2w4i s TYR 31 CO 0.11 -0.65 -0.01 0.20 -1.34 0.00 0.00 175.55 173.85 2w4i s GLY 32 N 1.54 1.68 -0.98 8.97 0.00 -0.44 -1.52 107.32 116.57 2w4i s GLY 32 Ca 0.02 -1.05 -0.08 0.00 0.00 0.00 0.00 44.72 43.62 2w4i s GLY 32 CO -0.09 0.29 3.14 1.34 0.00 0.00 0.00 173.10 177.79 2w4i n ASP 33 N 4.42 7.39 0.28 1.64 2.03 -0.44 -2.28 116.55 129.58 2w4i n ASP 33 Ca -0.17 -2.61 0.19 0.00 0.52 0.00 0.00 54.79 52.71 2w4i n ASP 33 Cb 0.52 -1.48 0.95 0.00 -0.72 0.00 0.00 41.12 40.39 2w4i n ASP 33 CO 0.00 0.00 0.00 0.77 -1.92 0.00 0.00 177.20 176.05 2w4i h SER 34 N 4.18 0.00 0.70 1.67 4.64 -1.78 0.48 113.55 123.45 2w4i h SER 34 Ca 0.60 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.86 2w4i h SER 34 Cb 0.73 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.82 2w4i h SER 34 CO 1.18 0.00 -0.28 0.00 -0.87 0.00 0.00 176.83 176.86 2w4i h ALA 35 N 2.02 1.11 -0.00 5.18 0.00 -1.83 -3.35 119.26 122.38 2w4i h ALA 35 Ca 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 54.66 2w4i h ALA 35 Cb 0.10 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.84 2w4i h ALA 35 CO 0.00 0.35 -0.03 0.54 0.00 0.00 0.00 179.25 180.11 2w4i n ARG 36 N -3.58 2.23 -1.74 0.00 1.74 0.12 -4.97 116.66 110.46 2w4i n ARG 36 Ca -0.01 -0.36 -0.41 0.00 -0.77 0.00 0.00 57.85 56.30 2w4i n ARG 36 Cb 0.42 -0.85 0.00 0.00 -1.02 0.00 0.00 32.46 31.01 2w4i n ARG 36 CO 0.00 0.00 0.00 1.55 -1.52 0.00 0.00 177.63 177.66 2w4i n VAL 37 N -0.37 2.17 -2.65 1.55 3.14 -0.97 -4.47 118.33 116.73 2w4i n VAL 37 Ca 0.01 -0.50 -0.30 0.00 -2.96 0.00 0.00 64.34 60.59 2w4i n VAL 37 Cb 0.04 -1.77 -0.02 0.00 -1.06 0.00 0.00 33.84 31.03 2w4i n VAL 37 CO 0.00 0.00 0.00 -2.16 -6.46 0.00 0.00 176.83 168.21 2w4i s PRO 38 N -2.08 3.69 -0.07 1.45 0.04 -1.26 -5.05 135.00 131.71 2w4i s PRO 38 Ca 0.56 0.45 0.12 0.00 0.04 0.00 0.00 61.00 62.17 2w4i s PRO 38 Cb -0.51 -2.33 -0.23 0.00 0.04 0.00 0.00 34.50 31.46 2w4i s PRO 38 CO 0.62 -0.16 0.55 0.66 0.04 0.00 0.00 177.00 178.70 2w4i n TYR 39 N -1.79 0.85 0.33 0.56 4.02 -1.26 -4.57 117.16 115.30 2w4i n TYR 39 Ca 0.02 0.30 0.21 0.00 -0.01 0.00 0.00 57.90 58.42 2w4i n TYR 39 Cb 0.54 -1.15 1.16 0.00 -0.02 0.00 0.00 39.34 39.87 2w4i n TYR 39 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 2w4i h GLY 40 N 3.45 0.00 -1.32 2.72 0.00 -1.97 -1.13 103.07 104.82 2w4i h GLY 40 Ca -0.34 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.99 2w4i h GLY 40 CO 0.07 0.00 -0.07 -1.30 0.00 0.00 0.00 176.54 175.24 2w4i n THR 41 N -3.26 0.00 -3.72 4.70 -2.24 -1.26 -0.71 114.28 107.80 2w4i n THR 41 Ca -0.03 -0.39 -0.18 0.00 -2.27 0.00 0.00 64.05 61.19 2w4i n THR 41 Cb 0.07 1.15 0.00 0.00 -2.10 0.00 0.00 70.33 69.46 2w4i n THR 41 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2w4i n LYS 42 N 0.77 0.92 -4.03 -0.78 5.02 -0.43 -4.98 118.16 114.65 2w4i n LYS 42 Ca 0.15 -2.34 -0.23 0.00 -2.02 0.00 0.00 58.31 53.86 2w4i n LYS 42 Cb 0.51 0.23 -0.04 0.00 -0.02 0.00 0.00 35.03 35.71 2w4i n LYS 42 CO 0.00 0.00 0.00 0.16 -0.52 0.00 0.00 177.40 177.04 2w4i s ASP 43 N -3.23 5.92 0.30 4.39 1.47 -1.26 -4.72 116.67 119.54 2w4i s ASP 43 Ca 0.23 -0.05 0.02 0.00 1.18 0.00 0.00 52.55 53.92 2w4i s ASP 43 Cb -0.02 -1.65 0.57 0.00 -0.34 0.00 0.00 42.92 41.49 2w4i s ASP 43 CO 0.14 -0.01 1.87 -0.65 0.68 0.00 0.00 175.17 177.21 2w4i h PRO 44 N 1.67 0.95 0.09 2.11 0.11 -1.97 -1.77 132.00 133.20 2w4i h PRO 44 Ca -0.49 -0.06 -0.00 0.00 0.11 0.00 0.00 66.00 65.55 2w4i h PRO 44 Cb 1.22 -0.22 -0.00 0.00 0.11 0.00 0.00 31.00 32.11 2w4i h PRO 44 CO 0.63 0.63 -0.05 1.15 -0.21 0.00 0.00 178.00 180.14 2w4i h THR 45 N 0.98 0.89 -0.17 -1.15 2.02 -1.96 -1.36 112.91 112.16 2w4i h THR 45 Ca 0.44 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.64 2w4i h THR 45 Cb 0.38 0.89 -0.02 0.00 -1.74 0.00 0.00 68.15 67.65 2w4i h THR 45 CO -0.20 0.00 0.04 0.74 0.37 0.00 0.00 175.52 176.47 2w4i h THR 46 N -0.14 0.94 -0.56 3.16 2.02 -1.88 -2.48 112.91 113.96 2w4i h THR 46 Ca -0.01 -0.04 -0.09 0.00 0.77 0.00 0.00 66.41 67.04 2w4i h THR 46 Cb 0.12 0.81 -0.02 0.00 -1.74 0.00 0.00 68.15 67.31 2w4i h THR 46 CO 0.01 0.02 -0.02 0.40 0.37 0.00 0.00 175.52 176.31 2w4i h ILE 47 N 0.12 1.27 -0.45 3.11 1.08 -1.26 -0.64 117.51 120.75 2w4i h ILE 47 Ca 0.08 -1.15 0.06 0.00 -0.39 0.00 0.00 64.86 63.46 2w4i h ILE 47 Cb 0.06 0.88 -0.05 0.00 -3.07 0.00 0.00 36.82 34.64 2w4i h ILE 47 CO -0.09 0.41 0.13 0.11 -0.69 0.00 0.00 178.15 178.02 2w4i h LYS 48 N 0.89 0.28 -0.47 2.37 1.57 -1.18 -0.23 116.57 119.79 2w4i h LYS 48 Ca 0.16 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.91 2w4i h LYS 48 Cb 0.56 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.79 2w4i h LYS 48 CO 0.03 0.18 0.25 0.37 -0.57 0.00 0.00 179.45 179.72 2w4i h GLN 49 N 0.29 0.66 -0.84 3.15 5.75 -1.21 -1.12 115.11 121.78 2w4i h GLN 49 Ca 0.21 -0.08 0.10 0.00 -0.15 0.00 0.00 58.65 58.73 2w4i h GLN 49 Cb 0.23 -0.13 -0.08 0.00 1.07 0.00 0.00 27.48 28.58 2w4i h GLN 49 CO -0.24 0.53 0.48 0.74 -2.65 0.00 0.00 178.83 177.68 2w4i h PHE 50 N 0.62 0.87 -0.33 3.99 0.04 -0.70 -1.41 116.94 120.01 2w4i h PHE 50 Ca 0.16 0.03 -0.02 0.00 2.80 0.00 0.00 57.97 60.95 2w4i h PHE 50 Cb 0.07 -0.26 -0.01 0.00 2.20 0.00 0.00 35.95 37.94 2w4i h PHE 50 CO -0.02 0.34 0.14 0.78 -0.60 0.00 0.00 178.31 178.95 2w4i h GLY 51 N 0.79 0.53 1.16 -1.45 0.00 -0.47 -1.83 103.07 101.80 2w4i h GLY 51 Ca 0.41 -0.28 -0.03 0.00 0.00 0.00 0.00 47.33 47.43 2w4i h GLY 51 CO -0.26 0.27 0.36 1.41 0.00 0.00 0.00 176.54 178.32 2w4i h LEU 52 N 0.40 0.98 -1.35 3.11 3.38 -0.88 -2.31 115.31 118.63 2w4i h LEU 52 Ca 0.11 -0.11 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 2w4i h LEU 52 Cb 0.17 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 2w4i h LEU 52 CO -0.01 0.83 -0.19 -0.33 0.09 0.00 0.00 178.44 178.83 2w4i h GLU 53 N 1.07 0.19 -0.80 1.13 5.08 -1.12 -2.19 114.58 117.95 2w4i h GLU 53 Ca 0.26 -0.05 -0.03 0.00 -1.00 0.00 0.00 59.36 58.54 2w4i h GLU 53 Cb 0.11 -0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.30 2w4i h GLU 53 CO -0.03 0.39 0.39 0.00 -1.00 0.00 0.00 179.01 178.75 2w4i h ALA 54 N 1.63 1.03 -0.62 3.43 0.00 -0.79 -1.67 119.26 122.26 2w4i h ALA 54 Ca 0.03 -0.15 0.06 0.00 0.00 0.00 0.00 54.91 54.85 2w4i h ALA 54 Cb 0.45 -0.32 -0.05 0.00 0.00 0.00 0.00 17.79 17.87 2w4i h ALA 54 CO 0.03 0.59 0.33 -0.07 0.00 0.00 0.00 179.25 180.13 2w4i h LEU 55 N 1.13 0.48 -0.94 0.00 3.38 -1.02 -1.78 115.31 116.55 2w4i h LEU 55 Ca 0.27 0.03 0.03 0.00 0.09 0.00 0.00 57.88 58.30 2w4i h LEU 55 Cb 0.11 -0.06 -0.05 0.00 0.09 0.00 0.00 40.66 40.75 2w4i h LEU 55 CO -0.03 0.31 0.62 0.44 0.09 0.00 0.00 178.44 179.86 2w4i h ASP 56 N 0.61 1.05 -0.80 -0.43 3.32 -1.11 -2.38 116.42 116.68 2w4i h ASP 56 Ca 0.28 -0.02 0.07 0.00 0.02 0.00 0.00 57.03 57.39 2w4i h ASP 56 Cb 0.19 -0.25 -0.06 0.00 0.22 0.00 0.00 39.33 39.43 2w4i h ASP 56 CO -0.19 0.73 0.47 0.15 -1.72 0.00 0.00 179.24 178.68 2w4i h PHE 57 N 1.22 0.86 0.00 4.55 3.57 -0.44 -2.92 116.94 123.78 2w4i h PHE 57 Ca 0.37 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.89 2w4i h PHE 57 Cb -0.05 -0.27 0.00 0.00 2.79 0.00 0.00 35.95 38.42 2w4i h PHE 57 CO -0.01 0.40 -0.09 1.19 -2.23 0.00 0.00 178.31 177.57 2w4i n PHE 58 N -4.71 0.22 -0.08 0.41 3.01 -0.92 -4.34 117.46 111.06 2w4i n PHE 58 Ca 0.12 0.06 -0.07 0.00 1.01 0.00 0.00 57.45 58.57 2w4i n PHE 58 Cb 0.21 -0.57 -0.01 0.00 -0.01 0.00 0.00 39.48 39.10 2w4i n PHE 58 CO 0.00 0.00 0.00 0.87 1.01 0.00 0.00 176.76 178.64 2w4i h LYS 59 N 0.00 -0.21 0.00 -1.08 1.79 -1.30 -1.01 116.57 114.75 2w4i h LYS 59 Ca 0.00 0.01 0.00 0.00 -2.18 0.00 0.00 60.65 58.48 2w4i h LYS 59 Cb 0.56 0.05 0.00 0.00 -1.58 0.00 0.00 32.23 31.26 2w4i h LYS 59 CO 0.00 -0.14 0.00 -0.35 -1.08 0.00 0.00 179.45 177.88 2w4i n PRO 60 N -5.38 0.07 0.04 3.15 -0.04 -1.26 -3.19 135.00 128.39 2w4i n PRO 60 Ca 0.00 0.35 0.13 0.00 -0.04 0.00 0.00 63.50 63.95 2w4i n PRO 60 Cb 0.30 -1.65 0.46 0.00 -0.04 0.00 0.00 33.50 32.57 2w4i n PRO 60 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 2w4i n HIS 61 N -1.80 0.40 -3.72 0.54 8.25 -0.39 -4.94 115.22 113.57 2w4i n HIS 61 Ca 0.02 0.12 -0.30 0.00 -0.26 0.00 0.00 57.72 57.30 2w4i n HIS 61 Cb 0.17 -0.66 0.03 0.00 1.12 0.00 0.00 29.99 30.65 2w4i n HIS 61 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 2w4i n GLU 62 N -1.84 -1.76 -2.77 -0.41 1.02 -1.19 -4.96 120.64 108.72 2w4i n GLU 62 Ca 0.06 0.46 -0.30 0.00 -0.02 0.00 0.00 57.16 57.36 2w4i n GLU 62 Cb 0.38 -4.25 -0.03 0.00 -0.02 0.00 0.00 31.44 27.53 2w4i n GLU 62 CO 0.00 0.00 0.00 0.96 1.18 0.00 0.00 177.13 179.27 2w4i s ILE 63 N -3.55 4.80 -0.13 -3.67 -4.36 -1.26 -4.94 121.20 108.09 2w4i s ILE 63 Ca 0.38 0.58 0.19 0.00 -0.26 0.00 0.00 60.65 61.54 2w4i s ILE 63 Cb -0.13 -3.76 -0.21 0.00 1.25 0.00 0.00 42.46 39.61 2w4i s ILE 63 CO 0.86 -0.60 0.58 -0.62 0.24 0.00 0.00 174.94 175.40 2w4i n GLU 64 N -1.52 0.65 -3.69 0.37 1.02 0.42 -4.95 120.64 112.93 2w4i n GLU 64 Ca 0.02 0.03 -0.14 0.00 -0.02 0.00 0.00 57.16 57.05 2w4i n GLU 64 Cb 0.54 -1.66 -0.09 0.00 -0.02 0.00 0.00 31.44 30.22 2w4i n GLU 64 CO 0.00 0.00 0.00 -1.17 1.18 0.00 0.00 177.13 177.14 2w4i s LEU 65 N -5.26 0.24 -0.20 -4.62 0.20 -1.26 -4.30 118.68 103.47 2w4i s LEU 65 Ca -0.06 0.65 -0.01 0.00 0.69 0.00 0.00 54.13 55.40 2w4i s LEU 65 Cb 0.10 1.68 0.01 0.00 -0.43 0.00 0.00 46.19 47.55 2w4i s LEU 65 CO 0.84 -0.33 -0.12 -0.22 -0.29 0.00 0.00 176.35 176.23 2w4i s LEU 66 N -0.48 2.55 -0.17 -0.68 2.96 -0.67 -1.44 118.68 120.75 2w4i s LEU 66 Ca -0.06 -0.56 -0.19 0.00 -0.22 0.00 0.00 54.13 53.10 2w4i s LEU 66 Cb -0.03 -1.61 -0.03 0.00 0.50 0.00 0.00 46.19 45.02 2w4i s LEU 66 CO 0.03 -0.02 0.54 -0.63 -1.32 0.00 0.00 176.35 174.96 2w4i s ILE 67 N 1.37 5.11 -0.74 6.68 1.01 -0.19 -0.54 121.20 133.90 2w4i s ILE 67 Ca 0.05 1.03 -0.16 0.00 0.00 0.00 0.00 60.65 61.57 2w4i s ILE 67 Cb -0.14 -3.87 0.17 0.00 0.01 0.00 0.00 42.46 38.64 2w4i s ILE 67 CO -0.08 0.21 0.74 -0.69 0.00 0.00 0.00 174.94 175.12 2w4i s VAL 68 N 1.36 5.31 0.35 2.92 1.01 0.77 -0.59 120.40 131.53 2w4i s VAL 68 Ca 0.26 -1.93 0.18 0.00 0.00 0.00 0.00 61.98 60.49 2w4i s VAL 68 Cb -0.16 -4.48 0.17 0.00 0.00 0.00 0.00 36.38 31.91 2w4i s VAL 68 CO 0.10 -1.06 1.90 0.00 0.00 0.00 0.00 175.10 176.04 2w4i h ALA 69 N 8.36 1.32 -2.32 5.51 0.00 -1.25 -3.18 119.26 127.71 2w4i h ALA 69 Ca -0.04 -0.26 -0.55 0.00 0.00 0.00 0.00 54.91 54.07 2w4i h ALA 69 Cb 1.06 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.79 2w4i h ALA 69 CO 0.91 0.35 0.77 0.00 0.00 0.00 0.00 179.25 181.28 2w4i h ASN 71 N 7.70 0.00 0.13 0.00 4.21 -1.85 -0.97 115.58 124.80 2w4i h ASN 71 Ca -0.35 0.00 -0.01 0.00 1.21 0.00 0.00 56.30 57.16 2w4i h ASN 71 Cb 1.16 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.36 2w4i h ASN 71 CO 0.90 0.50 -0.06 0.74 -1.29 0.00 0.00 177.43 178.21 2w4i h THR 72 N 0.00 1.05 -0.56 2.81 2.02 -1.91 0.86 112.91 117.17 2w4i h THR 72 Ca -0.00 -0.85 -0.01 0.00 0.77 0.00 0.00 66.41 66.31 2w4i h THR 72 Cb 0.88 1.57 -0.03 0.00 -1.74 0.00 0.00 68.15 68.83 2w4i h THR 72 CO 0.06 0.20 0.32 0.00 0.37 0.00 0.00 175.52 176.47 2w4i h ALA 73 N 0.20 1.50 -0.62 6.16 0.00 -1.95 0.63 119.26 125.18 2w4i h ALA 73 Ca -0.02 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.78 2w4i h ALA 73 Cb 0.46 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 2w4i h ALA 73 CO 0.03 0.42 0.25 0.77 0.00 0.00 0.00 179.25 180.72 2w4i h SER 74 N 0.78 0.85 -0.38 0.00 0.02 -1.01 0.20 113.55 114.01 2w4i h SER 74 Ca 0.20 -0.17 -0.11 0.00 -0.84 0.00 0.00 61.79 60.88 2w4i h SER 74 Cb 0.00 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 62.31 2w4i h SER 74 CO -0.04 0.78 -0.18 0.00 -1.14 0.00 0.00 176.83 176.26 2w4i h ALA 75 N 1.10 0.53 0.00 3.77 0.00 0.04 -3.32 119.26 121.38 2w4i h ALA 75 Ca 0.21 -0.36 -0.36 0.00 0.00 0.00 0.00 54.91 54.40 2w4i h ALA 75 Cb 0.20 -0.13 -0.07 0.00 0.00 0.00 0.00 17.79 17.79 2w4i h ALA 75 CO -0.02 0.47 -2.36 1.28 0.00 0.00 0.00 179.25 178.62 2w4i n LEU 76 N -4.28 0.61 -0.00 0.00 4.32 0.13 -4.71 117.00 113.08 2w4i n LEU 76 Ca -0.02 -0.03 0.02 0.00 -0.02 0.00 0.00 56.01 55.97 2w4i n LEU 76 Cb 0.41 0.20 -0.03 0.00 -1.62 0.00 0.00 43.42 42.39 2w4i n LEU 76 CO 0.44 0.57 -0.17 0.00 -1.22 0.00 0.00 177.39 177.02 2w4i n ALA 77 N -2.83 2.52 -0.07 -1.18 0.00 0.66 -4.58 120.51 115.02 2w4i n ALA 77 Ca -0.34 -0.13 -0.09 0.00 0.00 0.00 0.00 53.44 52.87 2w4i n ALA 77 Cb 1.10 -0.18 -0.02 0.00 0.00 0.00 0.00 19.45 20.36 2w4i n ALA 77 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 2w4i h LEU 78 N 0.00 0.24 -0.20 0.00 5.85 -1.54 -0.66 115.31 119.00 2w4i h LEU 78 Ca 0.00 0.00 0.04 0.00 0.84 0.00 0.00 57.88 58.76 2w4i h LEU 78 Cb 0.15 -0.04 -0.04 0.00 0.37 0.00 0.00 40.66 41.10 2w4i h LEU 78 CO 0.00 0.18 -0.04 -0.08 -0.34 0.00 0.00 178.44 178.16 2w4i h GLU 79 N 0.31 0.01 -0.75 1.25 4.81 -1.85 0.10 114.58 118.46 2w4i h GLU 79 Ca 0.11 -0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.31 2w4i h GLU 79 Cb 0.01 -0.00 -0.03 0.00 0.63 0.00 0.00 28.75 29.35 2w4i h GLU 79 CO -0.06 0.01 0.36 1.49 -0.73 0.00 0.00 179.01 180.09 2w4i h GLU 80 N 0.01 1.08 -0.05 1.92 4.57 -1.81 -1.51 114.58 118.79 2w4i h GLU 80 Ca 0.10 -0.16 -0.00 0.00 -1.18 0.00 0.00 59.36 58.12 2w4i h GLU 80 Cb 0.14 -0.20 -0.00 0.00 -0.16 0.00 0.00 28.75 28.53 2w4i h GLU 80 CO -0.20 0.84 0.02 0.52 -1.18 0.00 0.00 179.01 179.02 2w4i h MET 81 N 1.06 0.08 -0.72 1.92 2.86 -0.55 -2.73 114.93 116.85 2w4i h MET 81 Ca 0.26 -0.01 0.08 0.00 -2.06 0.00 0.00 59.70 57.97 2w4i h MET 81 Cb 0.11 -0.01 -0.07 0.00 0.06 0.00 0.00 31.60 31.69 2w4i h MET 81 CO -0.03 0.18 0.38 1.96 1.06 0.00 0.00 176.91 180.46 2w4i h GLN 82 N -0.05 0.63 -0.81 1.72 4.20 -0.84 -2.04 115.11 117.93 2w4i h GLN 82 Ca 0.02 -0.04 0.16 0.00 0.06 0.00 0.00 58.65 58.85 2w4i h GLN 82 Cb 0.13 -0.14 -0.10 0.00 0.30 0.00 0.00 27.48 27.67 2w4i h GLN 82 CO -0.00 0.42 0.36 -0.22 -0.67 0.00 0.00 178.83 178.71 2w4i h LYS 83 N 0.65 0.47 -0.57 1.46 3.64 -0.99 -2.79 116.57 118.45 2w4i h LYS 83 Ca 0.34 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.69 2w4i h LYS 83 Cb 0.32 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 32.03 2w4i h LYS 83 CO -0.24 0.31 0.00 0.66 -2.27 0.00 0.00 179.45 177.91 2w4i n TYR 84 N -4.97 1.29 -4.74 1.91 4.02 -0.85 -4.96 117.16 108.86 2w4i n TYR 84 Ca 0.16 -0.63 -0.33 0.00 -0.01 0.00 0.00 57.90 57.10 2w4i n TYR 84 Cb 0.46 -0.22 -0.12 0.00 -0.02 0.00 0.00 39.34 39.44 2w4i n TYR 84 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 2w4i s SER 85 N -1.04 4.32 0.00 7.72 0.15 -0.83 -5.00 113.70 119.02 2w4i s SER 85 Ca 0.47 -0.14 0.26 0.00 0.70 0.00 0.00 55.95 57.24 2w4i s SER 85 Cb 0.30 -1.14 0.69 0.00 -1.71 0.00 0.00 66.02 64.17 2w4i s SER 85 CO 0.22 0.32 1.54 0.29 1.20 0.00 0.00 173.24 176.81 2w4i n LYS 86 N 2.52 0.06 -4.36 5.44 4.76 -1.26 -4.90 118.16 120.43 2w4i n LYS 86 Ca -0.18 -0.03 -0.24 0.00 -2.87 0.00 0.00 58.31 55.00 2w4i n LYS 86 Cb 0.53 -1.50 -0.08 0.00 -1.84 0.00 0.00 35.03 32.13 2w4i n LYS 86 CO 0.00 0.00 0.00 0.96 -1.37 0.00 0.00 177.40 176.99 2w4i s ILE 87 N -2.96 3.08 0.37 -0.18 -4.36 -1.26 -5.11 121.20 110.79 2w4i s ILE 87 Ca 0.13 -2.06 -0.27 0.00 -0.26 0.00 0.00 60.65 58.18 2w4i s ILE 87 Cb 0.18 -2.63 -0.09 0.00 1.25 0.00 0.00 42.46 41.17 2w4i s ILE 87 CO 0.65 -0.36 1.29 -2.84 0.24 0.00 0.00 174.94 173.92 2w4i s PRO 88 N -3.54 4.15 -0.13 0.37 0.02 -1.26 -4.90 135.00 129.71 2w4i s PRO 88 Ca 0.30 2.15 0.03 0.00 0.02 0.00 0.00 61.00 63.50 2w4i s PRO 88 Cb -0.06 -2.89 0.01 0.00 0.02 0.00 0.00 34.50 31.58 2w4i s PRO 88 CO 0.18 -0.34 -0.22 0.42 -0.33 0.00 0.00 177.00 176.71 2w4i s ILE 89 N -1.22 2.10 -0.22 2.83 1.01 -1.26 -1.66 121.20 122.77 2w4i s ILE 89 Ca 0.53 -0.98 -0.02 0.00 0.00 0.00 0.00 60.65 60.18 2w4i s ILE 89 Cb -0.38 -1.83 0.01 0.00 0.01 0.00 0.00 42.46 40.27 2w4i s ILE 89 CO 0.50 0.55 -0.07 -0.69 0.00 0.00 0.00 174.94 175.22 2w4i s VAL 90 N 0.71 3.00 0.70 2.92 1.01 0.30 -4.99 120.40 124.04 2w4i s VAL 90 Ca -0.10 -0.74 -0.02 0.00 0.00 0.00 0.00 61.98 61.13 2w4i s VAL 90 Cb -0.16 -2.40 0.11 0.00 0.00 0.00 0.00 36.38 33.93 2w4i s VAL 90 CO 0.01 0.37 0.97 -0.83 0.00 0.00 0.00 175.10 175.62 2w4i s GLY 91 N 1.40 1.77 0.00 4.51 0.00 -1.26 -0.16 107.32 113.57 2w4i s GLY 91 Ca 0.04 -1.52 0.23 0.00 0.00 0.00 0.00 44.72 43.46 2w4i s GLY 91 CO -0.05 -1.02 1.42 3.33 0.00 0.00 0.00 173.10 176.78 2w4i n VAL 92 N -2.81 0.38 -0.05 1.40 0.24 -1.20 -4.45 118.33 111.84 2w4i n VAL 92 Ca 0.13 -0.63 -0.02 0.00 -2.04 0.00 0.00 64.34 61.78 2w4i n VAL 92 Cb 0.60 0.91 -0.01 0.00 -1.47 0.00 0.00 33.84 33.88 2w4i n VAL 92 CO 0.00 0.00 0.00 0.40 -2.14 0.00 0.00 176.83 175.09 2w4i h ILE 93 N 4.04 0.00 -0.64 1.34 2.04 -1.92 -3.31 117.51 119.06 2w4i h ILE 93 Ca 0.00 -0.87 0.13 0.00 1.00 0.00 0.00 64.86 65.12 2w4i h ILE 93 Cb 0.89 0.00 -0.10 0.00 -0.74 0.00 0.00 36.82 36.86 2w4i h ILE 93 CO 0.00 0.00 0.06 -0.33 0.00 0.00 0.00 178.15 177.88 2w4i h GLU 94 N -0.87 0.17 -0.87 2.37 4.39 -1.98 -0.48 114.58 117.31 2w4i h GLU 94 Ca 0.00 -0.01 0.13 0.00 0.34 0.00 0.00 59.36 59.82 2w4i h GLU 94 Cb 0.21 -0.04 -0.07 0.00 -0.10 0.00 0.00 28.75 28.75 2w4i h GLU 94 CO 0.00 0.11 0.56 -1.35 -1.16 0.00 0.00 179.01 177.17 2w4i h PRO 95 N 0.17 0.69 -0.37 2.33 0.11 -1.78 -1.78 132.00 131.37 2w4i h PRO 95 Ca 0.34 -0.04 -0.11 0.00 0.11 0.00 0.00 66.00 66.30 2w4i h PRO 95 Cb 0.56 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 31.50 2w4i h PRO 95 CO -0.51 0.46 -0.23 0.77 -0.21 0.00 0.00 178.00 178.28 2w4i h SER 96 N 0.71 0.76 -0.56 -2.05 0.02 -1.19 -0.99 113.55 110.25 2w4i h SER 96 Ca 0.42 -0.27 -0.00 0.00 -0.84 0.00 0.00 61.79 61.10 2w4i h SER 96 Cb 0.63 -0.21 -0.03 0.00 0.14 0.00 0.00 62.40 62.93 2w4i h SER 96 CO -0.19 0.97 0.34 0.40 -1.14 0.00 0.00 176.83 177.21 2w4i h ILE 97 N 0.65 1.17 -0.73 3.27 1.08 -0.77 -1.17 117.51 121.01 2w4i h ILE 97 Ca 0.09 -0.38 -0.05 0.00 -0.39 0.00 0.00 64.86 64.13 2w4i h ILE 97 Cb 0.74 0.41 -0.03 0.00 -3.07 0.00 0.00 36.82 34.86 2w4i h ILE 97 CO 0.06 0.17 0.25 -0.07 -0.69 0.00 0.00 178.15 177.87 2w4i h LEU 98 N 0.75 1.03 -0.77 1.44 3.38 -1.03 -0.26 115.31 119.86 2w4i h LEU 98 Ca 0.20 -0.18 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 2w4i h LEU 98 Cb -0.01 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.43 2w4i h LEU 98 CO -0.04 0.94 0.43 0.00 0.09 0.00 0.00 178.44 179.86 2w4i h ALA 99 N 1.20 0.99 -0.33 1.53 0.00 -0.90 -2.07 119.26 119.66 2w4i h ALA 99 Ca 0.24 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 55.02 2w4i h ALA 99 Cb 0.26 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 2w4i h ALA 99 CO -0.01 0.49 0.15 0.82 0.00 0.00 0.00 179.25 180.70 2w4i h ILE 100 N 1.06 1.17 -0.92 0.00 2.04 -0.79 0.11 117.51 120.19 2w4i h ILE 100 Ca 0.27 -0.50 0.15 0.00 1.00 0.00 0.00 64.86 65.78 2w4i h ILE 100 Cb 0.02 0.88 -0.09 0.00 -0.74 0.00 0.00 36.82 36.89 2w4i h ILE 100 CO -0.04 0.18 0.52 0.11 0.00 0.00 0.00 178.15 178.92 2w4i h LYS 101 N 0.40 0.73 -0.12 2.37 1.57 -0.71 0.42 116.57 121.22 2w4i h LYS 101 Ca 0.11 -0.04 -0.07 0.00 -1.87 0.00 0.00 60.65 58.78 2w4i h LYS 101 Cb 0.14 -0.16 -0.00 0.00 0.08 0.00 0.00 32.23 32.29 2w4i h LYS 101 CO -0.01 0.48 -0.20 -0.09 -0.57 0.00 0.00 179.45 179.06 2w4i h ARG 102 N 0.75 0.34 0.00 3.15 2.43 -0.99 -3.37 114.38 116.69 2w4i h ARG 102 Ca 0.49 -0.21 -0.02 0.00 -0.81 0.00 0.00 59.98 59.43 2w4i h ARG 102 Cb 0.66 0.02 -0.00 0.00 -0.42 0.00 0.00 29.97 30.23 2w4i h ARG 102 CO -0.34 0.80 -1.29 1.04 -1.51 0.00 0.00 179.97 178.67 2w4i n GLN 103 N -4.51 0.62 -3.84 0.20 6.02 0.36 -4.61 117.38 111.61 2w4i n GLN 103 Ca -0.07 0.05 -0.29 0.00 -0.01 0.00 0.00 57.00 56.69 2w4i n GLN 103 Cb 0.41 -1.75 -0.12 0.00 1.02 0.00 0.00 30.24 29.80 2w4i n GLN 103 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 2w4i s VAL 104 N -3.35 2.41 0.11 5.09 1.01 0.14 -4.93 120.40 120.87 2w4i s VAL 104 Ca -0.03 -3.72 0.23 0.00 0.00 0.00 0.00 61.98 58.46 2w4i s VAL 104 Cb 0.10 -2.61 0.22 0.00 0.00 0.00 0.00 36.38 34.09 2w4i s VAL 104 CO 0.82 -0.97 1.79 -0.33 0.00 0.00 0.00 175.10 176.41 2w4i h GLU 105 N 5.81 0.00 -6.63 2.72 5.08 -1.79 -3.42 114.58 116.35 2w4i h GLU 105 Ca 0.09 0.00 -0.56 0.00 -1.00 0.00 0.00 59.36 57.89 2w4i h GLU 105 Cb 0.82 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.99 2w4i h GLU 105 CO 0.65 0.25 0.93 0.34 -1.00 0.00 0.00 179.01 180.18 2w4i s ASP 106 N -6.23 6.56 0.34 1.42 -1.08 -1.26 -4.89 116.67 111.53 2w4i s ASP 106 Ca 0.01 0.31 0.25 0.00 -0.52 0.00 0.00 52.55 52.60 2w4i s ASP 106 Cb 0.10 -2.54 1.19 0.00 -1.46 0.00 0.00 42.92 40.21 2w4i s ASP 106 CO 0.65 -1.33 1.77 0.11 0.52 0.00 0.00 175.17 176.89 2w4i h LYS 107 N 9.34 0.00 -0.00 4.34 1.79 -1.89 -2.19 116.57 127.96 2w4i h LYS 107 Ca -0.24 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.23 2w4i h LYS 107 Cb 1.06 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.71 2w4i h LYS 107 CO 1.14 0.00 -0.27 0.09 -1.08 0.00 0.00 179.45 179.33 2w4i n ASN 108 N -2.39 0.50 -4.72 0.86 3.02 -1.26 -1.26 115.26 110.00 2w4i n ASN 108 Ca 0.00 -0.31 -0.42 0.00 -0.03 0.00 0.00 54.58 53.82 2w4i n ASN 108 Cb 0.16 0.02 -0.03 0.00 -0.61 0.00 0.00 39.78 39.32 2w4i n ASN 108 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2w4i s ALA 109 N -2.78 3.81 -0.35 5.41 0.00 -0.83 -4.63 121.76 122.39 2w4i s ALA 109 Ca 0.18 1.44 -0.29 0.00 0.00 0.00 0.00 51.96 53.30 2w4i s ALA 109 Cb 0.19 -3.64 -0.01 0.00 0.00 0.00 0.00 23.12 19.66 2w4i s ALA 109 CO 0.58 -0.83 1.66 -1.25 0.00 0.00 0.00 175.76 175.92 2w4i s PRO 110 N 0.96 3.44 -0.15 0.00 0.04 -1.26 -4.48 135.00 133.55 2w4i s PRO 110 Ca 0.70 1.29 -0.05 0.00 0.04 0.00 0.00 61.00 62.98 2w4i s PRO 110 Cb -0.46 -4.13 -0.03 0.00 0.04 0.00 0.00 34.50 29.92 2w4i s PRO 110 CO 0.33 -1.73 0.00 0.42 0.04 0.00 0.00 177.00 176.07 2w4i s ILE 111 N 6.31 4.26 -0.18 0.56 1.01 -0.20 -1.21 121.20 131.75 2w4i s ILE 111 Ca 0.73 -0.23 -0.01 0.00 0.00 0.00 0.00 60.65 61.14 2w4i s ILE 111 Cb -0.20 -2.87 -0.00 0.00 0.01 0.00 0.00 42.46 39.40 2w4i s ILE 111 CO 0.33 0.50 -0.12 -0.22 0.00 0.00 0.00 174.94 175.44 2w4i s LEU 112 N 0.12 2.60 -0.23 2.97 2.96 -0.02 -0.16 118.68 126.91 2w4i s LEU 112 Ca 0.01 -0.45 -0.18 0.00 -0.22 0.00 0.00 54.13 53.29 2w4i s LEU 112 Cb -0.13 -1.62 -0.03 0.00 0.50 0.00 0.00 46.19 44.91 2w4i s LEU 112 CO 0.02 0.04 0.50 -0.69 -1.32 0.00 0.00 176.35 174.90 2w4i s VAL 113 N 1.08 5.10 -0.09 1.68 1.01 0.01 -0.52 120.40 128.66 2w4i s VAL 113 Ca -0.00 0.88 -0.03 0.00 0.00 0.00 0.00 61.98 62.84 2w4i s VAL 113 Cb -0.15 -3.82 -0.03 0.00 0.00 0.00 0.00 36.38 32.38 2w4i s VAL 113 CO -0.03 0.14 0.02 -0.76 0.00 0.00 0.00 175.10 174.46 2w4i s LEU 114 N 1.97 3.67 0.00 3.92 1.43 -0.60 -0.59 118.68 128.48 2w4i s LEU 114 Ca 0.22 0.18 -0.05 0.00 -1.03 0.00 0.00 54.13 53.44 2w4i s LEU 114 Cb -0.15 -1.85 0.02 0.00 0.03 0.00 0.00 46.19 44.23 2w4i s LEU 114 CO 0.09 0.37 0.25 0.61 0.23 0.00 0.00 176.35 177.90 2w4i n GLY 115 N 2.19 1.19 3.75 -3.19 0.00 -1.03 -1.04 105.19 107.05 2w4i n GLY 115 Ca -0.19 -0.98 -0.30 0.00 0.00 0.00 0.00 46.02 44.55 2w4i n GLY 115 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2w4i s THR 116 N -2.48 2.76 0.18 2.61 -4.23 -1.26 -1.75 115.64 111.47 2w4i s THR 116 Ca 0.05 0.25 -0.15 0.00 -1.18 0.00 0.00 61.69 60.66 2w4i s THR 116 Cb -0.01 -2.83 0.11 0.00 1.34 0.00 0.00 72.50 71.11 2w4i s THR 116 CO 0.01 -0.32 1.67 0.50 -0.54 0.00 0.00 174.62 175.95 2w4i h LYS 117 N -1.39 0.05 -0.27 3.99 3.64 -1.89 -1.41 116.57 119.29 2w4i h LYS 117 Ca -0.49 -0.00 0.03 0.00 -1.27 0.00 0.00 60.65 58.92 2w4i h LYS 117 Cb 1.28 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 33.06 2w4i h LYS 117 CO 0.57 0.03 0.09 0.00 -2.27 0.00 0.00 179.45 177.87 2w4i h ALA 118 N 1.43 0.30 -0.06 5.00 0.00 -1.20 -0.12 119.26 124.60 2w4i h ALA 118 Ca 0.22 0.03 0.03 0.00 0.00 0.00 0.00 54.91 55.19 2w4i h ALA 118 Cb 0.34 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.11 2w4i h ALA 118 CO -0.42 -0.32 -0.10 1.15 0.00 0.00 0.00 179.25 179.56 2w4i h THR 119 N 0.21 0.74 -0.39 0.00 2.02 -1.75 -1.96 112.91 111.78 2w4i h THR 119 Ca 0.12 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.27 2w4i h THR 119 Cb 0.09 0.74 -0.02 0.00 -1.74 0.00 0.00 68.15 67.22 2w4i h THR 119 CO -0.13 0.00 0.13 0.40 0.37 0.00 0.00 175.52 176.29 2w4i h ILE 120 N -0.14 1.21 0.00 3.11 1.08 -1.10 -2.82 117.51 118.85 2w4i h ILE 120 Ca 0.06 -0.68 -0.03 0.00 -0.39 0.00 0.00 64.86 63.82 2w4i h ILE 120 Cb 0.22 0.93 -0.00 0.00 -3.07 0.00 0.00 36.82 34.89 2w4i h ILE 120 CO -0.14 0.24 -0.12 1.56 -0.69 0.00 0.00 178.15 178.99 2w4i h GLN 121 N 0.48 0.00 0.00 2.37 4.20 -0.90 -1.81 115.11 119.46 2w4i h GLN 121 Ca 0.13 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.83 2w4i h GLN 121 Cb 0.24 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.02 2w4i h GLN 121 CO -0.01 0.12 -0.01 0.66 -0.67 0.00 0.00 178.83 178.93 2w4i h SER 122 N 0.00 0.00 -1.44 1.46 4.64 -1.09 -3.46 113.55 113.66 2w4i h SER 122 Ca -0.00 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 61.12 2w4i h SER 122 Cb 0.32 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 62.33 2w4i h SER 122 CO 0.02 0.01 -0.18 0.59 -0.87 0.00 0.00 176.83 176.39 2w4i n ASN 123 N -3.11 -2.72 -0.19 4.97 3.02 -0.68 -4.88 115.26 111.67 2w4i n ASN 123 Ca -0.00 0.24 -0.02 0.00 -0.03 0.00 0.00 54.58 54.77 2w4i n ASN 123 Cb 0.27 -2.61 0.05 0.00 -0.61 0.00 0.00 39.78 36.88 2w4i n ASN 123 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2w4i h ALA 124 N 0.97 0.31 -0.18 5.41 0.00 -1.85 0.25 119.26 124.19 2w4i h ALA 124 Ca -0.20 0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 2w4i h ALA 124 Cb 0.66 0.50 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 2w4i h ALA 124 CO 0.29 -0.47 0.07 1.88 0.00 0.00 0.00 179.25 181.02 2w4i h TYR 125 N -0.04 0.27 -0.51 0.00 -1.99 -1.90 -2.49 116.97 110.32 2w4i h TYR 125 Ca 0.27 -0.02 -0.01 0.00 2.00 0.00 0.00 58.73 60.98 2w4i h TYR 125 Cb 0.46 -0.08 -0.02 0.00 2.00 0.00 0.00 36.73 39.08 2w4i h TYR 125 CO -0.51 0.34 0.30 -0.44 -0.00 0.00 0.00 178.16 177.86 2w4i h ASP 126 N 0.13 0.63 -0.40 3.88 5.19 -1.86 0.25 116.42 124.24 2w4i h ASP 126 Ca 0.06 -0.07 0.01 0.00 -0.62 0.00 0.00 57.03 56.41 2w4i h ASP 126 Cb 0.19 -0.16 -0.02 0.00 0.18 0.00 0.00 39.33 39.52 2w4i h ASP 126 CO -0.00 0.51 0.25 0.78 -3.12 0.00 0.00 179.24 177.66 2w4i h ASN 127 N 0.69 0.43 -0.42 6.45 2.35 -0.96 0.17 115.58 124.28 2w4i h ASN 127 Ca 0.18 -0.01 -0.14 0.00 -0.55 0.00 0.00 56.30 55.78 2w4i h ASN 127 Cb 0.01 -0.10 -0.01 0.00 0.05 0.00 0.00 38.32 38.27 2w4i h ASN 127 CO -0.03 0.31 -0.29 0.00 -1.65 0.00 0.00 177.43 175.77 2w4i h ALA 128 N 1.15 0.61 -0.49 -0.83 0.00 -1.17 -1.85 119.26 116.68 2w4i h ALA 128 Ca 0.15 -0.42 -0.07 0.00 0.00 0.00 0.00 54.91 54.57 2w4i h ALA 128 Cb -0.04 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 17.59 2w4i h ALA 128 CO -0.04 0.65 0.03 -0.07 0.00 0.00 0.00 179.25 179.82 2w4i h LEU 129 N 0.78 0.83 -0.73 0.00 3.38 -0.82 -2.67 115.31 116.07 2w4i h LEU 129 Ca 0.08 -0.29 -0.01 0.00 0.09 0.00 0.00 57.88 57.76 2w4i h LEU 129 Cb 0.88 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.37 2w4i h LEU 129 CO 0.08 0.91 0.42 0.11 0.09 0.00 0.00 178.44 180.05 2w4i h LYS 130 N 0.72 1.01 -0.64 1.13 1.57 -0.90 -1.67 116.57 117.79 2w4i h LYS 130 Ca 0.14 -0.11 0.08 0.00 -1.87 0.00 0.00 60.65 58.90 2w4i h LYS 130 Cb 0.47 -0.20 -0.04 0.00 0.08 0.00 0.00 32.23 32.53 2w4i h LYS 130 CO 0.02 0.73 0.42 0.37 -0.57 0.00 0.00 179.45 180.43 2w4i h GLN 131 N 1.00 0.52 -0.50 3.15 4.15 -1.24 -1.13 115.11 121.07 2w4i h GLN 131 Ca 0.26 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.65 2w4i h GLN 131 Cb 0.00 -0.12 0.00 0.00 0.21 0.00 0.00 27.48 27.57 2w4i h GLN 131 CO -0.05 0.35 0.00 1.04 -1.93 0.00 0.00 178.83 178.24 2w4i n GLN 132 N -4.48 2.21 -0.59 1.69 1.13 -0.79 -4.92 117.38 111.63 2w4i n GLN 132 Ca 0.10 -1.43 0.00 0.00 -1.94 0.00 0.00 57.00 53.73 2w4i n GLN 132 Cb 0.31 -1.48 0.00 0.00 0.11 0.00 0.00 30.24 29.18 2w4i n GLN 132 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 2w4i n GLY 133 N 0.86 0.76 3.72 1.08 0.00 -0.43 -5.04 105.19 106.14 2w4i n GLY 133 Ca 0.13 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.73 2w4i n GLY 133 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2w4i s TYR 134 N -2.73 3.49 -0.59 1.61 1.51 -0.70 -4.85 117.35 115.09 2w4i s TYR 134 Ca 0.00 1.40 0.17 0.00 -1.01 0.00 0.00 57.07 57.63 2w4i s TYR 134 Cb 0.00 -3.37 -0.20 0.00 -0.11 0.00 0.00 41.96 38.28 2w4i s TYR 134 CO 0.00 -1.04 0.63 1.28 -1.11 0.00 0.00 175.55 175.31 2w4i n LEU 135 N 3.53 0.59 -3.45 -1.29 4.77 -0.39 -4.29 117.00 116.47 2w4i n LEU 135 Ca 0.07 -0.37 -0.26 0.00 -0.03 0.00 0.00 56.01 55.42 2w4i n LEU 135 Cb 0.47 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.46 2w4i n LEU 135 CO 0.55 0.15 -0.20 -3.20 -1.33 0.00 0.00 177.39 173.36 2w4i n ASN 136 N -1.58 0.99 -4.30 -1.43 2.85 -1.26 -5.05 115.26 105.48 2w4i n ASN 136 Ca 0.02 -2.77 -0.33 0.00 -0.11 0.00 0.00 54.58 51.38 2w4i n ASN 136 Cb 0.31 -0.63 -0.15 0.00 1.24 0.00 0.00 39.78 40.55 2w4i n ASN 136 CO 0.00 0.00 0.00 -0.63 -2.11 0.00 0.00 177.26 174.52 2w4i s ILE 137 N -0.91 2.86 0.24 -1.44 1.01 -1.26 -1.03 121.20 120.65 2w4i s ILE 137 Ca 0.33 -0.71 0.11 0.00 0.00 0.00 0.00 60.65 60.38 2w4i s ILE 137 Cb 0.07 -2.22 -0.05 0.00 0.01 0.00 0.00 42.46 40.28 2w4i s ILE 137 CO -0.15 0.51 -0.21 -0.44 0.00 0.00 0.00 174.94 174.65 2w4i s SER 138 N 0.77 3.44 0.04 3.58 0.01 0.77 -4.98 113.70 117.32 2w4i s SER 138 Ca -0.05 -0.95 0.01 0.00 1.31 0.00 0.00 55.95 56.26 2w4i s SER 138 Cb -0.15 -0.27 -0.02 0.00 0.21 0.00 0.00 66.02 65.79 2w4i s SER 138 CO 0.01 0.06 -0.05 -1.38 0.41 0.00 0.00 173.24 172.29 2w4i s HIS 139 N -2.16 0.48 -0.18 2.43 -3.43 -1.26 -0.81 115.29 110.36 2w4i s HIS 139 Ca 0.25 -0.58 -0.06 0.00 -0.80 0.00 0.00 55.06 53.87 2w4i s HIS 139 Cb -0.06 -0.31 0.08 0.00 -1.43 0.00 0.00 32.58 30.86 2w4i s HIS 139 CO 0.12 -0.16 0.36 -1.17 -2.00 0.00 0.00 174.74 171.89 2w4i s LEU 140 N -1.71 -0.52 -0.66 5.38 2.96 0.24 -4.92 118.68 119.47 2w4i s LEU 140 Ca -0.10 0.79 -0.27 0.00 -0.22 0.00 0.00 54.13 54.32 2w4i s LEU 140 Cb -0.08 1.09 0.02 0.00 0.50 0.00 0.00 46.19 47.72 2w4i s LEU 140 CO -0.01 -0.24 1.42 0.00 -1.32 0.00 0.00 176.35 176.20 2w4i s ALA 141 N 2.54 2.67 -1.19 5.97 0.00 -1.26 -2.46 121.76 128.03 2w4i s ALA 141 Ca 0.00 -1.00 -0.05 0.00 0.00 0.00 0.00 51.96 50.91 2w4i s ALA 141 Cb -0.12 -4.21 0.22 0.00 0.00 0.00 0.00 23.12 19.01 2w4i s ALA 141 CO -0.11 -3.26 1.95 0.25 0.00 0.00 0.00 175.76 174.59 2w4i n THR 142 N 6.69 5.29 -0.25 0.00 -2.24 -0.71 -4.85 114.28 118.21 2w4i n THR 142 Ca 0.09 -5.09 -0.03 0.00 -2.27 0.00 0.00 64.05 56.75 2w4i n THR 142 Cb 0.50 -2.00 0.08 0.00 -2.10 0.00 0.00 70.33 66.80 2w4i n THR 142 CO 0.00 0.00 0.00 0.28 -0.57 0.00 0.00 175.07 174.78 2w4i h SER 143 N 4.92 0.72 0.83 3.42 0.02 -1.92 -2.26 113.55 119.28 2w4i h SER 143 Ca 0.49 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.44 2w4i h SER 143 Cb 0.44 -0.16 0.00 0.00 0.14 0.00 0.00 62.40 62.82 2w4i h SER 143 CO 1.41 0.50 0.00 0.18 -1.14 0.00 0.00 176.83 177.78 2w4i n LEU 144 N -4.66 0.66 -0.35 5.07 4.77 -1.26 -2.18 117.00 119.06 2w4i n LEU 144 Ca 0.07 0.65 0.04 0.00 -0.03 0.00 0.00 56.01 56.74 2w4i n LEU 144 Cb 0.08 -0.54 0.20 0.00 -2.33 0.00 0.00 43.42 40.83 2w4i n LEU 144 CO 0.33 -0.49 1.22 -0.26 -1.33 0.00 0.00 177.39 176.86 2w4i h PHE 145 N 0.00 1.09 0.48 -1.77 0.05 -1.81 -2.73 116.94 112.24 2w4i h PHE 145 Ca 0.00 0.03 -0.01 0.00 3.82 0.00 0.00 57.97 61.81 2w4i h PHE 145 Cb 0.41 -0.35 -0.02 0.00 2.00 0.00 0.00 35.95 37.99 2w4i h PHE 145 CO 0.00 0.49 -0.47 0.28 -0.18 0.00 0.00 178.31 178.42 2w4i h VAL 146 N 1.01 0.07 -0.23 -0.55 2.07 -1.61 -1.30 116.25 115.71 2w4i h VAL 146 Ca 0.45 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.92 2w4i h VAL 146 Cb 0.34 0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.16 2w4i h VAL 146 CO -0.23 0.00 -0.08 1.55 0.02 0.00 0.00 177.57 178.83 2w4i h PRO 147 N -0.96 0.36 -0.38 1.57 0.13 -1.73 -1.47 132.00 129.53 2w4i h PRO 147 Ca -0.05 -0.08 0.01 0.00 -0.87 0.00 0.00 66.00 65.01 2w4i h PRO 147 Cb 0.84 -0.05 -0.02 0.00 0.13 0.00 0.00 31.00 31.89 2w4i h PRO 147 CO -0.06 0.45 0.23 -0.07 -0.23 0.00 0.00 178.00 178.32 2w4i h LEU 148 N 0.34 0.37 -0.61 1.56 4.07 -1.29 -1.32 115.31 118.42 2w4i h LEU 148 Ca 0.07 0.00 -0.11 0.00 0.08 0.00 0.00 57.88 57.92 2w4i h LEU 148 Cb 0.36 -0.08 -0.02 0.00 1.08 0.00 0.00 40.66 42.01 2w4i h LEU 148 CO 0.02 0.27 -0.12 0.40 -1.08 0.00 0.00 178.44 177.93 2w4i h ILE 149 N 0.46 1.27 -0.26 1.22 2.04 -0.86 0.96 117.51 122.34 2w4i h ILE 149 Ca 0.15 -1.26 0.01 0.00 1.00 0.00 0.00 64.86 64.76 2w4i h ILE 149 Cb -0.00 0.99 -0.01 0.00 -0.74 0.00 0.00 36.82 37.05 2w4i h ILE 149 CO -0.06 0.44 0.17 -0.33 0.00 0.00 0.00 178.15 178.37 2w4i h GLU 150 N 0.87 0.32 -0.37 2.37 4.39 -0.98 -0.18 114.58 121.00 2w4i h GLU 150 Ca 0.14 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.82 2w4i h GLU 150 Cb 0.67 -0.07 0.00 0.00 -0.10 0.00 0.00 28.75 29.24 2w4i h GLU 150 CO 0.05 0.21 0.00 0.39 -1.16 0.00 0.00 179.01 178.50 2w4i n GLU 151 N -4.50 1.76 -3.09 2.33 -0.58 -0.53 -4.92 120.64 111.12 2w4i n GLU 151 Ca 0.01 -1.01 -0.21 0.00 -0.42 0.00 0.00 57.16 55.53 2w4i n GLU 151 Cb 0.09 -1.31 0.00 0.00 -0.57 0.00 0.00 31.44 29.66 2w4i n GLU 151 CO 0.00 0.00 0.00 0.43 -0.48 0.00 0.00 177.13 177.08 2w4i n SER 152 N 0.29 -4.28 -4.53 1.62 7.64 -0.08 -4.92 113.62 109.36 2w4i n SER 152 Ca 0.09 -0.24 -0.43 0.00 1.01 0.00 0.00 58.87 59.31 2w4i n SER 152 Cb 0.29 -3.53 -0.02 0.00 -1.01 0.00 0.00 64.21 59.94 2w4i n SER 152 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 2w4i s ILE 153 N -2.92 4.31 -1.11 0.44 -1.09 0.28 -4.75 121.20 116.35 2w4i s ILE 153 Ca 0.29 -1.53 0.11 0.00 -2.23 0.00 0.00 60.65 57.30 2w4i s ILE 153 Cb -0.15 -5.02 0.26 0.00 -1.58 0.00 0.00 42.46 35.97 2w4i s ILE 153 CO 0.36 -1.83 1.15 0.18 -1.23 0.00 0.00 174.94 173.57 2w4i n LEU 154 N 7.79 2.69 -3.83 2.97 4.77 -1.26 -4.41 117.00 125.72 2w4i n LEU 154 Ca 0.36 -1.71 -0.06 0.00 -0.03 0.00 0.00 56.01 54.57 2w4i n LEU 154 Cb 0.48 -0.17 0.01 0.00 -2.33 0.00 0.00 43.42 41.40 2w4i n LEU 154 CO 0.65 0.64 0.63 -1.83 -1.33 0.00 0.00 177.39 176.15 2w4i s GLU 155 N -0.99 1.70 0.02 3.23 -1.05 -1.26 -4.93 118.70 115.42 2w4i s GLU 155 Ca 0.21 -1.04 0.00 0.00 -0.15 0.00 0.00 54.97 54.00 2w4i s GLU 155 Cb 0.12 0.51 0.00 0.00 -0.44 0.00 0.00 34.13 34.32 2w4i s GLU 155 CO 0.16 -0.79 0.00 0.41 0.95 0.00 0.00 175.26 175.99 2w4i n GLY 156 N -0.54 -3.45 0.30 -3.83 0.00 -1.26 -4.25 105.19 92.15 2w4i n GLY 156 Ca -0.06 -1.88 -0.05 0.00 0.00 0.00 0.00 46.02 44.04 2w4i n GLY 156 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2w4i h GLU 157 N 0.00 0.88 -0.37 1.61 4.57 -2.03 -1.36 114.58 117.89 2w4i h GLU 157 Ca 0.00 -0.22 -0.04 0.00 -1.18 0.00 0.00 59.36 57.93 2w4i h GLU 157 Cb 0.00 -0.11 -0.02 0.00 -0.16 0.00 0.00 28.75 28.46 2w4i h GLU 157 CO 0.00 0.83 0.09 1.25 -1.18 0.00 0.00 179.01 180.01 2w4i h LEU 158 N 0.83 0.56 -0.13 1.64 5.85 -1.99 0.21 115.31 122.27 2w4i h LEU 158 Ca 0.17 -0.23 -0.00 0.00 0.84 0.00 0.00 57.88 58.66 2w4i h LEU 158 Cb 0.40 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.28 2w4i h LEU 158 CO 0.01 0.64 0.08 0.25 -0.34 0.00 0.00 178.44 179.08 2w4i h LEU 159 N 0.44 0.16 -0.67 2.25 5.85 -1.70 -0.74 115.31 120.91 2w4i h LEU 159 Ca 0.12 -0.05 0.05 0.00 0.84 0.00 0.00 57.88 58.84 2w4i h LEU 159 Cb 0.30 -0.04 -0.05 0.00 0.37 0.00 0.00 40.66 41.24 2w4i h LEU 159 CO 0.00 0.16 0.38 -0.08 -0.34 0.00 0.00 178.44 178.56 2w4i h GLU 160 N 0.15 0.69 -0.46 1.25 4.57 -1.08 -0.03 114.58 119.67 2w4i h GLU 160 Ca 0.05 -0.04 -0.08 0.00 -1.18 0.00 0.00 59.36 58.11 2w4i h GLU 160 Cb 0.03 -0.16 -0.02 0.00 -0.16 0.00 0.00 28.75 28.44 2w4i h GLU 160 CO -0.01 0.46 -0.03 1.15 -1.18 0.00 0.00 179.01 179.40 2w4i h THR 161 N 0.71 1.25 -0.22 0.32 2.02 -0.80 0.26 112.91 116.45 2w4i h THR 161 Ca 0.29 -1.05 -0.02 0.00 0.77 0.00 0.00 66.41 66.40 2w4i h THR 161 Cb 0.15 0.93 -0.01 0.00 -1.74 0.00 0.00 68.15 67.48 2w4i h THR 161 CO -0.16 0.37 0.05 0.00 0.37 0.00 0.00 175.52 176.14 2w4i h MET 163 N 0.16 0.50 -0.43 0.00 2.07 -0.80 -2.44 114.93 114.00 2w4i h MET 163 Ca 0.07 -0.03 0.00 0.00 -2.07 0.00 0.00 59.70 57.67 2w4i h MET 163 Cb 0.29 -0.11 -0.02 0.00 -1.87 0.00 0.00 31.60 29.88 2w4i h MET 163 CO 0.00 0.33 0.28 1.25 1.07 0.00 0.00 176.91 179.84 2w4i h HIS 164 N 0.52 0.55 -0.55 -0.22 6.17 -0.83 0.12 115.15 120.90 2w4i h HIS 164 Ca 0.21 0.01 0.11 0.00 0.71 0.00 0.00 60.37 61.41 2w4i h HIS 164 Cb 0.08 -0.18 -0.11 0.00 2.52 0.00 0.00 27.41 29.72 2w4i h HIS 164 CO -0.09 0.35 -0.20 -0.92 0.71 0.00 0.00 177.93 177.79 2w4i h TYR 165 N 0.58 -0.49 0.17 5.26 3.20 -0.61 -1.22 116.97 123.86 2w4i h TYR 165 Ca 0.16 0.06 -0.30 0.00 3.14 0.00 0.00 58.73 61.78 2w4i h TYR 165 Cb -0.05 0.30 0.03 0.00 1.54 0.00 0.00 36.73 38.54 2w4i h TYR 165 CO -0.04 -0.29 -1.32 1.88 -1.64 0.00 0.00 178.16 176.75 2w4i h TYR 166 N -0.07 0.87 0.00 -3.82 0.99 -1.05 -3.39 116.97 110.50 2w4i h TYR 166 Ca 0.26 -0.59 -0.27 0.00 2.00 0.00 0.00 58.73 60.12 2w4i h TYR 166 Cb 0.47 -0.05 -0.05 0.00 1.00 0.00 0.00 36.73 38.10 2w4i h TYR 166 CO -0.51 1.45 -1.55 0.74 -0.00 0.00 0.00 178.16 178.29 2w4i h PHE 167 N 0.18 0.00 -0.79 4.88 0.05 -0.72 -3.38 116.94 117.16 2w4i h PHE 167 Ca -0.20 0.00 0.14 0.00 3.82 0.00 0.00 57.97 61.73 2w4i h PHE 167 Cb 2.00 0.00 -0.09 0.00 2.00 0.00 0.00 35.95 39.86 2w4i h PHE 167 CO 0.11 1.00 0.37 1.15 -0.18 0.00 0.00 178.31 180.75 2w4i h THR 168 N 0.00 0.71 0.00 -1.55 2.02 -1.41 -1.42 112.91 111.26 2w4i h THR 168 Ca -0.22 -0.18 0.00 0.00 0.77 0.00 0.00 66.41 66.77 2w4i h THR 168 Cb 1.96 0.12 0.00 0.00 -1.74 0.00 0.00 68.15 68.49 2w4i h THR 168 CO 0.09 0.10 0.00 -2.65 0.37 0.00 0.00 175.52 173.43 2w4i n PRO 169 N -4.93 0.02 -1.78 6.66 -0.02 -1.26 -4.87 135.00 128.83 2w4i n PRO 169 Ca 0.15 0.30 -0.42 0.00 -2.02 0.00 0.00 63.50 61.52 2w4i n PRO 169 Cb 0.41 -1.50 -0.02 0.00 -0.02 0.00 0.00 33.50 32.37 2w4i n PRO 169 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2w4i s LEU 170 N -2.93 4.36 0.10 2.45 1.43 -0.54 -4.90 118.68 118.65 2w4i s LEU 170 Ca 0.06 2.88 0.23 0.00 -1.03 0.00 0.00 54.13 56.27 2w4i s LEU 170 Cb 0.07 -3.62 0.12 0.00 0.03 0.00 0.00 46.19 42.79 2w4i s LEU 170 CO 0.18 -0.93 1.11 -0.62 0.23 0.00 0.00 176.35 176.32 2w4i n GLU 171 N 3.10 0.36 -5.27 1.70 1.02 -1.26 -4.86 120.64 115.42 2w4i n GLU 171 Ca 0.12 0.04 -0.31 0.00 -0.02 0.00 0.00 57.16 56.99 2w4i n GLU 171 Cb 0.37 -1.66 -0.16 0.00 -0.02 0.00 0.00 31.44 29.97 2w4i n GLU 171 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 2w4i s ILE 172 N -3.23 2.15 -0.47 -3.67 1.01 -1.26 -5.10 121.20 110.63 2w4i s ILE 172 Ca 0.03 -1.07 -0.26 0.00 0.00 0.00 0.00 60.65 59.35 2w4i s ILE 172 Cb 0.13 -1.75 0.03 0.00 0.01 0.00 0.00 42.46 40.88 2w4i s ILE 172 CO 0.78 0.58 0.98 -0.22 0.00 0.00 0.00 174.94 177.06 2w4i s LEU 173 N -0.58 3.91 0.40 2.97 2.96 -1.26 -5.03 118.68 122.06 2w4i s LEU 173 Ca 0.09 0.18 -0.26 0.00 -0.22 0.00 0.00 54.13 53.92 2w4i s LEU 173 Cb -0.10 -3.27 -0.08 0.00 0.50 0.00 0.00 46.19 43.23 2w4i s LEU 173 CO -0.00 -1.11 1.23 -2.16 -1.32 0.00 0.00 176.35 172.98 2w4i s PRO 174 N 3.95 4.02 -0.01 0.98 0.04 -1.26 -4.88 135.00 137.83 2w4i s PRO 174 Ca 0.40 1.99 0.20 0.00 0.04 0.00 0.00 61.00 63.63 2w4i s PRO 174 Cb -0.09 -2.72 -0.23 0.00 0.04 0.00 0.00 34.50 31.49 2w4i s PRO 174 CO 0.28 -0.40 0.55 0.39 0.04 0.00 0.00 177.00 177.85 2w4i n GLU 175 N 0.12 0.65 -4.33 4.56 1.02 -0.35 -4.68 120.64 117.63 2w4i n GLU 175 Ca 0.04 -0.03 -0.20 0.00 -0.02 0.00 0.00 57.16 56.95 2w4i n GLU 175 Cb 0.45 -1.62 -0.16 0.00 -0.02 0.00 0.00 31.44 30.09 2w4i n GLU 175 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 2w4i s VAL 176 N -3.17 0.71 -0.13 2.62 1.01 -1.04 -0.97 120.40 119.42 2w4i s VAL 176 Ca -0.06 -0.30 -0.00 0.00 0.00 0.00 0.00 61.98 61.62 2w4i s VAL 176 Cb 0.11 -0.65 0.03 0.00 0.00 0.00 0.00 36.38 35.86 2w4i s VAL 176 CO 0.86 0.24 -0.10 -0.63 0.00 0.00 0.00 175.10 175.46 2w4i s ILE 177 N 0.36 1.29 -0.23 2.22 1.01 0.36 -0.84 121.20 125.38 2w4i s ILE 177 Ca -0.05 -0.48 -0.23 0.00 0.00 0.00 0.00 60.65 59.89 2w4i s ILE 177 Cb -0.10 -1.27 -0.01 0.00 0.01 0.00 0.00 42.46 41.09 2w4i s ILE 177 CO 0.01 0.39 0.74 -0.63 0.00 0.00 0.00 174.94 175.44 2w4i s ILE 178 N 1.60 4.92 -1.36 2.92 1.01 0.32 -0.82 121.20 129.78 2w4i s ILE 178 Ca 0.05 1.39 -0.15 0.00 0.00 0.00 0.00 60.65 61.93 2w4i s ILE 178 Cb -0.13 -4.04 0.07 0.00 0.01 0.00 0.00 42.46 38.38 2w4i s ILE 178 CO -0.09 0.00 1.94 0.18 0.00 0.00 0.00 174.94 176.97 2w4i n LEU 179 N 5.62 5.95 -1.79 2.97 4.77 -0.52 -1.56 117.00 132.45 2w4i n LEU 179 Ca 0.02 -4.12 -0.11 0.00 -0.03 0.00 0.00 56.01 51.77 2w4i n LEU 179 Cb 0.48 -1.68 0.00 0.00 -2.33 0.00 0.00 43.42 39.90 2w4i n LEU 179 CO 0.46 0.72 1.18 0.61 -1.33 0.00 0.00 177.39 179.03 2w4i n GLY 180 N 4.50 3.44 3.42 -0.72 0.00 -0.21 -4.32 105.19 111.31 2w4i n GLY 180 Ca 0.49 -0.74 -0.14 0.00 0.00 0.00 0.00 46.02 45.63 2w4i n GLY 180 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2w4i h THR 182 N 4.25 0.74 0.00 0.00 1.35 -1.84 -2.88 112.91 114.52 2w4i h THR 182 Ca -0.28 -0.04 -0.15 0.00 -0.55 0.00 0.00 66.41 65.39 2w4i h THR 182 Cb 1.17 0.60 -0.02 0.00 -1.73 0.00 0.00 68.15 68.17 2w4i h THR 182 CO 0.19 0.02 -0.81 0.45 -0.25 0.00 0.00 175.52 175.13 2w4i h HIS 183 N 0.12 0.00 0.00 4.73 3.86 -1.95 -3.39 115.15 118.52 2w4i h HIS 183 Ca 0.30 0.00 -0.06 0.00 -1.16 0.00 0.00 60.37 59.45 2w4i h HIS 183 Cb 1.03 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 29.49 2w4i h HIS 183 CO -0.00 0.70 -0.30 0.74 0.86 0.00 0.00 177.93 179.93 2w4i h PHE 184 N 0.00 0.00 -1.08 2.45 0.05 -1.85 -1.90 116.94 114.61 2w4i h PHE 184 Ca -0.03 0.00 0.30 0.00 3.82 0.00 0.00 57.97 62.06 2w4i h PHE 184 Cb 1.56 0.00 -0.06 0.00 2.00 0.00 0.00 35.95 39.45 2w4i h PHE 184 CO 0.00 0.30 0.75 -1.35 -0.18 0.00 0.00 178.31 177.83 2w4i h PRO 185 N 0.00 0.11 0.00 1.51 0.11 -1.77 -1.17 132.00 130.79 2w4i h PRO 185 Ca -0.00 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.10 2w4i h PRO 185 Cb 0.61 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 31.70 2w4i h PRO 185 CO 0.04 0.07 0.00 -0.07 -0.21 0.00 0.00 178.00 177.83 2w4i h LEU 186 N 0.11 0.00 -2.95 2.35 4.07 -1.65 -2.38 115.31 114.86 2w4i h LEU 186 Ca 0.54 0.00 -0.00 0.00 0.08 0.00 0.00 57.88 58.50 2w4i h LEU 186 Cb 1.92 0.00 -0.00 0.00 1.08 0.00 0.00 40.66 43.66 2w4i h LEU 186 CO -0.09 0.00 -0.04 2.30 -1.08 0.00 0.00 178.44 179.53 2w4i n ILE 187 N -2.33 1.81 -0.08 1.22 -5.35 -0.47 -4.84 119.36 109.32 2w4i n ILE 187 Ca 0.02 -2.20 -0.07 0.00 -0.27 0.00 0.00 62.75 60.23 2w4i n ILE 187 Cb 0.23 -0.20 -0.00 0.00 -1.74 0.00 0.00 39.64 37.93 2w4i n ILE 187 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2w4i h ALA 188 N 0.04 0.28 -0.40 -1.28 0.00 -1.09 -0.01 119.26 116.80 2w4i h ALA 188 Ca -0.00 0.07 -0.07 0.00 0.00 0.00 0.00 54.91 54.92 2w4i h ALA 188 Cb 1.02 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.90 2w4i h ALA 188 CO 0.00 -0.38 -0.02 1.96 0.00 0.00 0.00 179.25 180.81 2w4i h GLN 189 N 0.12 0.66 -0.67 0.00 4.20 -1.88 -0.43 115.11 117.11 2w4i h GLN 189 Ca 0.14 -0.17 -0.05 0.00 0.06 0.00 0.00 58.65 58.64 2w4i h GLN 189 Cb 0.17 -0.08 -0.03 0.00 0.30 0.00 0.00 27.48 27.84 2w4i h GLN 189 CO -0.21 0.69 0.23 0.87 -0.67 0.00 0.00 178.83 179.74 2w4i h LYS 190 N 0.62 1.03 -0.32 1.46 1.79 -1.75 0.17 116.57 119.57 2w4i h LYS 190 Ca 0.12 -0.21 -0.01 0.00 -2.18 0.00 0.00 60.65 58.37 2w4i h LYS 190 Cb 0.42 -0.16 -0.01 0.00 -1.58 0.00 0.00 32.23 30.90 2w4i h LYS 190 CO 0.02 0.88 0.16 0.82 -1.08 0.00 0.00 179.45 180.25 2w4i h ILE 191 N 0.97 1.15 -0.11 1.86 2.04 -0.71 0.74 117.51 123.45 2w4i h ILE 191 Ca 0.22 -0.44 0.03 0.00 1.00 0.00 0.00 64.86 65.67 2w4i h ILE 191 Cb 0.27 0.86 -0.04 0.00 -0.74 0.00 0.00 36.82 37.17 2w4i h ILE 191 CO -0.01 0.16 -0.10 -0.33 0.00 0.00 0.00 178.15 177.87 2w4i h GLU 192 N 0.38 -0.11 -0.73 2.37 5.08 -0.92 -2.38 114.58 118.28 2w4i h GLU 192 Ca 0.11 0.01 0.04 0.00 -1.00 0.00 0.00 59.36 58.52 2w4i h GLU 192 Cb 0.11 0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.35 2w4i h GLU 192 CO -0.01 -0.07 0.48 0.78 -1.00 0.00 0.00 179.01 179.18 2w4i h GLY 193 N -0.12 0.99 1.00 -3.84 0.00 -0.52 -0.54 103.07 100.05 2w4i h GLY 193 Ca 0.08 -0.33 -0.01 0.00 0.00 0.00 0.00 47.33 47.07 2w4i h GLY 193 CO -0.18 0.27 -0.09 -1.82 0.00 0.00 0.00 176.54 174.72 2w4i h TYR 194 N 0.84 -0.23 -0.40 5.60 3.20 -0.54 0.10 116.97 125.53 2w4i h TYR 194 Ca 0.30 -0.01 -0.12 0.00 3.14 0.00 0.00 58.73 62.04 2w4i h TYR 194 Cb 0.13 0.08 -0.01 0.00 1.54 0.00 0.00 36.73 38.46 2w4i h TYR 194 CO -0.00 -0.14 -0.24 0.74 -1.64 0.00 0.00 178.16 176.87 2w4i h PHE 195 N -0.24 0.95 -0.63 -3.82 -1.00 -1.10 -0.51 116.94 110.59 2w4i h PHE 195 Ca -0.02 -0.23 -0.07 0.00 2.81 0.00 0.00 57.97 60.46 2w4i h PHE 195 Cb 0.19 -0.22 -0.03 0.00 3.61 0.00 0.00 35.95 39.50 2w4i h PHE 195 CO -0.07 0.99 0.13 0.52 -1.61 0.00 0.00 178.31 178.27 2w4i h MET 196 N 0.72 1.03 -0.00 1.51 2.86 -1.00 -2.08 114.93 117.96 2w4i h MET 196 Ca 0.09 -0.26 -0.02 0.00 -2.06 0.00 0.00 59.70 57.46 2w4i h MET 196 Cb 0.78 -0.13 0.00 0.00 0.06 0.00 0.00 31.60 32.31 2w4i h MET 196 CO 0.06 0.94 -0.06 0.78 1.06 0.00 0.00 176.91 179.69 2w4i h GLY 197 N 0.94 0.06 1.97 8.32 0.00 -0.69 -0.47 103.07 113.20 2w4i h GLY 197 Ca 0.19 -0.09 -0.10 0.00 0.00 0.00 0.00 47.33 47.33 2w4i h GLY 197 CO 0.01 0.08 -0.47 0.45 0.00 0.00 0.00 176.54 176.61 2w4i h HIS 198 N -0.66 0.04 -0.23 5.60 -0.00 -1.14 -3.19 115.15 115.58 2w4i h HIS 198 Ca -0.01 -0.01 0.00 0.00 -0.00 0.00 0.00 60.37 60.35 2w4i h HIS 198 Cb 0.79 -0.01 0.00 0.00 -0.00 0.00 0.00 27.41 28.19 2w4i h HIS 198 CO 0.18 0.50 0.00 1.19 -0.00 0.00 0.00 177.93 179.80 2w4i n PHE 199 N -3.98 0.31 -3.74 2.45 3.01 -0.78 -5.01 117.46 109.72 2w4i n PHE 199 Ca -0.02 -0.46 -0.32 0.00 1.01 0.00 0.00 57.45 57.67 2w4i n PHE 199 Cb 0.49 -0.03 0.03 0.00 -0.01 0.00 0.00 39.48 39.97 2w4i n PHE 199 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2w4i n ALA 200 N 0.25 -2.48 -2.78 4.37 0.00 -0.33 -4.97 120.51 114.58 2w4i n ALA 200 Ca 0.08 -0.27 -0.36 0.00 0.00 0.00 0.00 53.44 52.90 2w4i n ALA 200 Cb 0.36 -3.67 -0.07 0.00 0.00 0.00 0.00 19.45 16.08 2w4i n ALA 200 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2w4i s LEU 201 N -6.61 4.29 0.41 0.00 1.43 -0.37 -5.00 118.68 112.83 2w4i s LEU 201 Ca 0.41 0.37 0.20 0.00 -1.03 0.00 0.00 54.13 54.07 2w4i s LEU 201 Cb -0.15 -2.12 0.85 0.00 0.03 0.00 0.00 46.19 44.80 2w4i s LEU 201 CO 0.87 0.26 1.82 1.55 0.23 0.00 0.00 176.35 181.09 2w4i h PRO 202 N 5.97 0.00 -4.00 1.29 0.13 -1.93 -3.44 132.00 130.02 2w4i h PRO 202 Ca -0.47 0.00 -0.14 0.00 -0.87 0.00 0.00 66.00 64.53 2w4i h PRO 202 Cb 1.18 0.00 -0.18 0.00 0.13 0.00 0.00 31.00 32.14 2w4i h PRO 202 CO 0.69 0.32 -0.63 0.95 -0.23 0.00 0.00 178.00 179.09 2w4i s THR 203 N -3.83 0.15 0.74 1.56 -4.23 -1.26 -5.14 115.64 103.63 2w4i s THR 203 Ca -0.01 -1.27 -0.10 0.00 -1.18 0.00 0.00 61.69 59.13 2w4i s THR 203 Cb 0.12 -0.90 0.05 0.00 1.34 0.00 0.00 72.50 73.11 2w4i s THR 203 CO 0.67 -0.70 1.09 -2.16 -0.54 0.00 0.00 174.62 172.99 2w4i s PRO 204 N -2.68 2.37 0.73 3.99 0.04 -1.26 -4.90 135.00 133.29 2w4i s PRO 204 Ca -0.05 0.13 -0.16 0.00 0.04 0.00 0.00 61.00 60.97 2w4i s PRO 204 Cb -0.01 -2.05 0.02 0.00 0.04 0.00 0.00 34.50 32.51 2w4i s PRO 204 CO -0.05 -1.27 1.11 -2.30 0.04 0.00 0.00 177.00 174.52 2w4i n PRO 205 N -3.07 0.56 -2.33 0.56 -0.02 -1.26 -4.94 135.00 124.49 2w4i n PRO 205 Ca 0.07 0.25 -0.43 0.00 -2.02 0.00 0.00 63.50 61.38 2w4i n PRO 205 Cb 0.59 -2.35 -0.02 0.00 -0.02 0.00 0.00 33.50 31.70 2w4i n PRO 205 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 2w4i s LEU 206 N -4.09 4.24 -0.14 2.45 2.96 -0.14 -4.87 118.68 119.09 2w4i s LEU 206 Ca 0.75 1.86 -0.12 0.00 -0.22 0.00 0.00 54.13 56.41 2w4i s LEU 206 Cb -0.34 -3.54 -0.05 0.00 0.50 0.00 0.00 46.19 42.76 2w4i s LEU 206 CO 0.48 -0.76 0.24 -0.76 -1.32 0.00 0.00 176.35 174.23 2w4i s LEU 207 N 3.27 4.30 -0.27 -0.68 1.02 -1.26 -0.48 118.68 124.57 2w4i s LEU 207 Ca 0.59 0.50 -0.13 0.00 0.02 0.00 0.00 54.13 55.11 2w4i s LEU 207 Cb -0.25 -2.27 -0.04 0.00 0.02 0.00 0.00 46.19 43.64 2w4i s LEU 207 CO 0.20 0.21 0.26 -0.63 0.02 0.00 0.00 176.35 176.41 2w4i s ILE 208 N -0.08 5.26 -0.22 -0.59 -1.09 -0.00 -4.95 121.20 119.53 2w4i s ILE 208 Ca 0.15 0.33 -0.12 0.00 -2.23 0.00 0.00 60.65 58.79 2w4i s ILE 208 Cb -0.13 -3.60 -0.05 0.00 -1.58 0.00 0.00 42.46 37.11 2w4i s ILE 208 CO 0.04 0.22 0.21 -2.28 -1.23 0.00 0.00 174.94 171.90 2w4i s HIS 209 N 1.80 3.35 0.28 3.97 5.65 -1.26 -1.43 115.29 127.66 2w4i s HIS 209 Ca 0.10 0.34 -0.01 0.00 0.25 0.00 0.00 55.06 55.75 2w4i s HIS 209 Cb -0.16 -2.30 0.41 0.00 -1.18 0.00 0.00 32.58 29.35 2w4i s HIS 209 CO 0.10 0.11 1.82 0.77 -0.65 0.00 0.00 174.74 176.89 2w4i h SER 210 N 7.27 0.74 0.12 9.88 0.02 -1.92 -2.18 113.55 127.48 2w4i h SER 210 Ca -0.38 -0.14 -0.01 0.00 -0.84 0.00 0.00 61.79 60.42 2w4i h SER 210 Cb 1.16 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 63.51 2w4i h SER 210 CO 0.69 0.75 -0.06 1.23 -1.14 0.00 0.00 176.83 178.31 2w4i h GLY 211 N 0.95 -0.16 1.24 -3.77 0.00 -1.90 -1.20 103.07 98.23 2w4i h GLY 211 Ca 0.16 0.06 -0.04 0.00 0.00 0.00 0.00 47.33 47.52 2w4i h GLY 211 CO 0.00 -0.06 0.27 -0.55 0.00 0.00 0.00 176.54 176.20 2w4i h ASP 212 N -0.25 0.89 -0.51 0.19 3.32 -1.88 -1.39 116.42 116.78 2w4i h ASP 212 Ca -0.02 -0.12 -0.09 0.00 0.02 0.00 0.00 57.03 56.82 2w4i h ASP 212 Cb 0.20 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.50 2w4i h ASP 212 CO 0.03 0.79 -0.03 0.00 -1.72 0.00 0.00 179.24 178.31 2w4i h ALA 213 N 1.34 0.70 -0.15 3.45 0.00 -1.27 -2.10 119.26 121.22 2w4i h ALA 213 Ca 0.22 -0.30 -0.11 0.00 0.00 0.00 0.00 54.91 54.72 2w4i h ALA 213 Cb 0.18 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 2w4i h ALA 213 CO -0.02 0.54 -0.40 0.97 0.00 0.00 0.00 179.25 180.33 2w4i h ILE 214 N 0.79 1.31 -0.50 0.00 2.10 -0.96 -1.36 117.51 118.89 2w4i h ILE 214 Ca 0.14 -1.53 0.02 0.00 1.08 0.00 0.00 64.86 64.57 2w4i h ILE 214 Cb 0.56 1.64 -0.03 0.00 -1.09 0.00 0.00 36.82 37.90 2w4i h ILE 214 CO 0.03 0.47 0.31 0.58 -1.08 0.00 0.00 178.15 178.46 2w4i h VAL 215 N 0.29 1.07 -0.55 2.19 2.07 -1.05 -0.18 116.25 120.08 2w4i h VAL 215 Ca 0.03 -0.21 -0.10 0.00 0.82 0.00 0.00 66.70 67.23 2w4i h VAL 215 Cb 0.84 0.40 -0.02 0.00 -1.52 0.00 0.00 31.29 30.99 2w4i h VAL 215 CO 0.07 0.11 -0.05 -0.33 0.02 0.00 0.00 177.57 177.39 2w4i h GLU 216 N 0.62 1.00 -0.13 1.57 5.08 -0.98 -1.24 114.58 120.50 2w4i h GLU 216 Ca 0.20 -0.33 -0.01 0.00 -1.00 0.00 0.00 59.36 58.21 2w4i h GLU 216 Cb -0.01 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.16 2w4i h GLU 216 CO -0.08 1.01 0.03 -0.92 -1.00 0.00 0.00 179.01 178.05 2w4i h TYR 217 N 0.90 0.22 -0.90 4.33 3.20 -0.98 -2.47 116.97 121.26 2w4i h TYR 217 Ca 0.15 -0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.98 2w4i h TYR 217 Cb 0.60 -0.06 -0.04 0.00 1.54 0.00 0.00 36.73 38.77 2w4i h TYR 217 CO 0.04 0.37 0.48 -0.07 -1.64 0.00 0.00 178.16 177.35 2w4i h LEU 218 N 0.00 1.13 -0.59 2.82 3.38 -0.86 0.13 115.31 121.32 2w4i h LEU 218 Ca 0.04 -0.11 0.02 0.00 0.09 0.00 0.00 57.88 57.93 2w4i h LEU 218 Cb 0.27 -0.29 -0.04 0.00 0.09 0.00 0.00 40.66 40.69 2w4i h LEU 218 CO 0.00 0.91 0.37 1.56 0.09 0.00 0.00 178.44 181.37 2w4i h GLN 219 N 1.26 0.72 0.04 1.13 4.20 -1.13 -1.62 115.11 119.70 2w4i h GLN 219 Ca 0.32 -0.04 -0.00 0.00 0.06 0.00 0.00 58.65 58.98 2w4i h GLN 219 Cb 0.04 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 27.66 2w4i h GLN 219 CO -0.05 0.47 -0.02 -0.56 -0.67 0.00 0.00 178.83 178.01 2w4i h GLN 220 N 0.74 -0.05 -0.79 1.46 3.07 -1.11 -2.66 115.11 115.77 2w4i h GLN 220 Ca 0.23 0.00 0.02 0.00 0.09 0.00 0.00 58.65 58.99 2w4i h GLN 220 Cb -0.01 0.01 -0.04 0.00 0.08 0.00 0.00 27.48 27.52 2w4i h GLN 220 CO -0.09 0.63 0.52 -0.22 0.09 0.00 0.00 178.83 179.77 2w4i h LYS 221 N -0.87 1.01 -0.22 0.06 1.63 -0.76 -2.92 116.57 114.51 2w4i h LYS 221 Ca -0.00 -0.06 -0.01 0.00 -0.85 0.00 0.00 60.65 59.72 2w4i h LYS 221 Cb 0.70 -0.23 -0.01 0.00 -0.60 0.00 0.00 32.23 32.09 2w4i h LYS 221 CO 0.01 0.67 -0.00 0.66 -3.45 0.00 0.00 179.45 177.33 2w4i n TYR 222 N -4.56 0.78 -3.74 1.91 4.02 -0.61 -4.98 117.16 109.99 2w4i n TYR 222 Ca 0.08 -0.94 -0.29 0.00 -0.01 0.00 0.00 57.90 56.74 2w4i n TYR 222 Cb 0.04 -0.30 -0.02 0.00 -0.02 0.00 0.00 39.34 39.05 2w4i n TYR 222 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2w4i n ALA 223 N -0.72 -1.15 -2.07 -0.72 0.00 -1.07 -4.90 120.51 109.88 2w4i n ALA 223 Ca 0.21 0.04 -0.41 0.00 0.00 0.00 0.00 53.44 53.28 2w4i n ALA 223 Cb 0.86 -3.02 -0.05 0.00 0.00 0.00 0.00 19.45 17.24 2w4i n ALA 223 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2w4i s LEU 224 N -6.79 4.56 0.06 0.00 1.43 -1.03 -5.03 118.68 111.88 2w4i s LEU 224 Ca 0.55 1.85 -0.18 0.00 -1.03 0.00 0.00 54.13 55.33 2w4i s LEU 224 Cb -0.30 -3.59 -0.06 0.00 0.03 0.00 0.00 46.19 42.26 2w4i s LEU 224 CO 0.68 0.02 0.53 -0.75 0.23 0.00 0.00 176.35 177.06 2w4i s LYS 225 N -0.45 4.10 0.00 1.70 2.47 -1.26 -4.68 119.74 121.62 2w4i s LYS 225 Ca 0.45 0.63 0.13 0.00 -1.56 0.00 0.00 55.97 55.62 2w4i s LYS 225 Cb -0.24 -3.20 0.78 0.00 -1.46 0.00 0.00 37.83 33.71 2w4i s LYS 225 CO 0.31 0.64 1.23 -1.71 0.16 0.00 0.00 175.35 175.97 2w4i n ASN 226 N 1.64 0.00 -2.57 1.43 5.15 -1.26 -2.65 115.26 117.00 2w4i n ASN 226 Ca -0.11 -0.71 -0.00 0.00 -0.60 0.00 0.00 54.58 53.16 2w4i n ASN 226 Cb 0.51 0.00 0.06 0.00 -0.53 0.00 0.00 39.78 39.82 2w4i n ASN 226 CO 0.00 0.00 0.00 0.59 1.40 0.00 0.00 177.26 179.25 2w4i n ASN 227 N -0.87 0.72 0.21 1.20 5.03 -1.25 -4.26 115.26 116.04 2w4i n ASN 227 Ca 0.10 -2.06 0.08 0.00 0.87 0.00 0.00 54.58 53.57 2w4i n ASN 227 Cb 0.05 -0.17 0.40 0.00 -1.02 0.00 0.00 39.78 39.04 2w4i n ASN 227 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2w4i h ALA 228 N 1.96 1.02 -3.24 5.41 0.00 -1.28 -3.42 119.26 119.72 2w4i h ALA 228 Ca -0.24 -0.27 -0.64 0.00 0.00 0.00 0.00 54.91 53.77 2w4i h ALA 228 Cb 1.35 -0.05 -0.34 0.00 0.00 0.00 0.00 17.79 18.76 2w4i h ALA 228 CO 0.07 0.37 -0.86 0.00 0.00 0.00 0.00 179.25 178.83 2w4i h THR 230 N 5.88 1.30 -1.66 0.00 2.02 -1.90 -3.44 112.91 115.11 2w4i h THR 230 Ca -0.31 -1.36 -0.03 0.00 0.77 0.00 0.00 66.41 65.48 2w4i h THR 230 Cb 1.19 1.51 -0.25 0.00 -1.74 0.00 0.00 68.15 68.86 2w4i h THR 230 CO 0.52 0.44 -0.35 0.12 0.37 0.00 0.00 175.52 176.62 2w4i s PHE 231 N -4.48 -1.17 0.48 3.16 5.36 -1.26 -5.14 117.98 114.93 2w4i s PHE 231 Ca -0.13 1.42 -0.20 0.00 -0.96 0.00 0.00 56.93 57.07 2w4i s PHE 231 Cb 0.09 0.35 -0.09 0.00 -0.34 0.00 0.00 43.02 43.03 2w4i s PHE 231 CO 0.82 -0.74 1.00 -1.25 -1.46 0.00 0.00 175.22 173.58 2w4i s PRO 232 N 2.71 3.95 -0.10 10.12 0.04 -1.26 -5.02 135.00 145.44 2w4i s PRO 232 Ca 0.12 1.19 -0.20 0.00 0.04 0.00 0.00 61.00 62.15 2w4i s PRO 232 Cb -0.14 -2.13 -0.04 0.00 0.04 0.00 0.00 34.50 32.23 2w4i s PRO 232 CO -0.18 -0.28 0.57 0.21 0.04 0.00 0.00 177.00 177.36 2w4i s LYS 233 N -3.40 4.37 -0.07 4.56 2.47 -0.48 -5.01 119.74 122.19 2w4i s LYS 233 Ca 0.64 0.62 0.03 0.00 -1.56 0.00 0.00 55.97 55.70 2w4i s LYS 233 Cb -0.12 -3.45 0.01 0.00 -1.46 0.00 0.00 37.83 32.81 2w4i s LYS 233 CO 0.20 0.11 -0.17 0.08 0.16 0.00 0.00 175.35 175.73 2w4i s VAL 234 N 0.74 1.47 -0.17 4.02 1.01 -1.26 -1.24 120.40 124.97 2w4i s VAL 234 Ca 0.31 -0.68 -0.08 0.00 0.00 0.00 0.00 61.98 61.52 2w4i s VAL 234 Cb -0.16 -1.30 -0.04 0.00 0.00 0.00 0.00 36.38 34.87 2w4i s VAL 234 CO 0.13 0.43 0.12 -1.61 0.00 0.00 0.00 175.10 174.17 2w4i s GLU 235 N 0.47 3.86 -0.19 2.72 2.02 -0.28 -4.99 118.70 122.32 2w4i s GLU 235 Ca -0.14 -0.21 -0.08 0.00 0.02 0.00 0.00 54.97 54.55 2w4i s GLU 235 Cb -0.16 -3.29 -0.04 0.00 0.10 0.00 0.00 34.13 30.74 2w4i s GLU 235 CO 0.05 0.48 0.08 -0.06 0.02 0.00 0.00 175.26 175.83 2w4i s PHE 236 N -0.16 3.29 0.04 1.61 0.08 -1.26 -0.79 117.98 120.79 2w4i s PHE 236 Ca 0.10 0.13 0.03 0.00 0.12 0.00 0.00 56.93 57.31 2w4i s PHE 236 Cb -0.12 -2.10 -0.02 0.00 -0.57 0.00 0.00 43.02 40.21 2w4i s PHE 236 CO 0.00 0.18 -0.10 -1.01 -0.10 0.00 0.00 175.22 174.20 2w4i s HIS 237 N 0.38 0.88 0.05 0.36 3.76 0.15 -4.98 115.29 115.89 2w4i s HIS 237 Ca 0.04 -0.40 -0.11 0.00 -0.15 0.00 0.00 55.06 54.44 2w4i s HIS 237 Cb -0.12 -0.52 0.01 0.00 1.11 0.00 0.00 32.58 33.06 2w4i s HIS 237 CO -0.00 -0.02 0.23 0.00 -0.85 0.00 0.00 174.74 174.10 2w4i s ALA 238 N -1.06 -0.45 -0.15 -1.40 0.00 -1.26 -1.32 121.76 116.11 2w4i s ALA 238 Ca -0.04 -0.25 0.16 0.00 0.00 0.00 0.00 51.96 51.84 2w4i s ALA 238 Cb -0.08 0.34 -0.01 0.00 0.00 0.00 0.00 23.12 23.36 2w4i s ALA 238 CO 0.01 -0.41 1.20 0.66 0.00 0.00 0.00 175.76 177.22 2w4i h SER 239 N 3.24 0.00 -1.91 0.00 4.64 -1.78 -3.44 113.55 114.30 2w4i h SER 239 Ca -0.32 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.00 2w4i h SER 239 Cb 1.20 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.29 2w4i h SER 239 CO 0.49 0.49 0.00 0.61 -0.87 0.00 0.00 176.83 177.55 2w4i n GLY 240 N 1.28 0.31 3.65 -0.77 0.00 -1.26 -4.51 105.19 103.89 2w4i n GLY 240 Ca -0.02 -1.84 -0.42 0.00 0.00 0.00 0.00 46.02 43.73 2w4i n GLY 240 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2w4i s ASP 241 N -1.00 6.38 0.38 1.61 -1.08 -1.26 -4.88 116.67 116.82 2w4i s ASP 241 Ca 0.00 2.44 0.21 0.00 -0.52 0.00 0.00 52.55 54.68 2w4i s ASP 241 Cb 0.00 -2.53 0.56 0.00 -1.46 0.00 0.00 42.92 39.49 2w4i s ASP 241 CO 0.00 -1.14 1.67 1.62 0.52 0.00 0.00 175.17 177.84 2w4i h VAL 242 N 5.82 0.62 -0.23 1.11 3.04 -1.94 -2.21 116.25 122.45 2w4i h VAL 242 Ca -0.46 -1.50 -0.04 0.00 -1.01 0.00 0.00 66.70 63.69 2w4i h VAL 242 Cb 1.22 2.02 -0.01 0.00 -2.01 0.00 0.00 31.29 32.51 2w4i h VAL 242 CO 0.95 0.30 -0.02 0.40 -1.01 0.00 0.00 177.57 178.19 2w4i h ILE 243 N 0.00 1.26 -0.70 3.17 1.08 -1.98 -0.39 117.51 119.96 2w4i h ILE 243 Ca -0.00 -0.94 0.10 0.00 -0.39 0.00 0.00 64.86 63.63 2w4i h ILE 243 Cb 1.00 1.42 -0.08 0.00 -3.07 0.00 0.00 36.82 36.09 2w4i h ILE 243 CO 0.04 0.29 0.32 -0.50 -0.69 0.00 0.00 178.15 177.61 2w4i h TRP 244 N 0.17 0.57 0.52 1.37 4.06 -1.91 -0.47 115.95 120.26 2w4i h TRP 244 Ca 0.06 0.03 -0.03 0.00 2.06 0.00 0.00 58.89 61.02 2w4i h TRP 244 Cb 0.44 -0.15 0.01 0.00 -1.00 0.00 0.00 29.16 28.45 2w4i h TRP 244 CO 0.04 0.18 -0.25 1.25 -3.56 0.00 0.00 178.44 176.10 2w4i h LEU 245 N 0.54 -0.59 -1.35 -4.49 5.85 -1.29 -3.13 115.31 110.85 2w4i h LEU 245 Ca 0.35 -0.06 -0.01 0.00 0.84 0.00 0.00 57.88 59.01 2w4i h LEU 245 Cb 0.42 0.15 -0.03 0.00 0.37 0.00 0.00 40.66 41.57 2w4i h LEU 245 CO -0.30 -0.24 0.33 -0.08 -0.34 0.00 0.00 178.44 177.82 2w4i h GLU 246 N -0.99 0.77 -0.74 1.25 4.81 -1.00 -1.29 114.58 117.40 2w4i h GLU 246 Ca -0.07 -0.07 0.15 0.00 -0.13 0.00 0.00 59.36 59.24 2w4i h GLU 246 Cb 0.62 -0.16 -0.05 0.00 0.63 0.00 0.00 28.75 29.79 2w4i h GLU 246 CO 0.12 0.55 0.50 0.00 -0.73 0.00 0.00 179.01 179.45 2w4i h ARG 247 N 0.79 0.36 0.00 1.92 3.08 -1.12 -1.63 114.38 117.78 2w4i h ARG 247 Ca 0.21 -0.02 -0.08 0.00 0.07 0.00 0.00 59.98 60.16 2w4i h ARG 247 Cb -0.01 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 29.94 2w4i h ARG 247 CO -0.04 0.24 -0.37 1.96 -1.07 0.00 0.00 179.97 180.69 2w4i h GLN 248 N 0.37 0.00 -0.85 0.04 1.08 -1.18 -3.25 115.11 111.33 2w4i h GLN 248 Ca 0.36 0.00 0.06 0.00 -1.45 0.00 0.00 58.65 57.62 2w4i h GLN 248 Cb 0.89 0.00 -0.05 0.00 -0.05 0.00 0.00 27.48 28.27 2w4i h GLN 248 CO -0.11 0.37 0.55 0.00 -0.95 0.00 0.00 178.83 178.69 2w4i h ALA 249 N 1.63 1.56 -0.50 3.87 0.00 -1.20 -2.09 119.26 122.54 2w4i h ALA 249 Ca -0.00 -0.03 0.10 0.00 0.00 0.00 0.00 54.91 54.98 2w4i h ALA 249 Cb 1.08 -0.25 -0.09 0.00 0.00 0.00 0.00 17.79 18.53 2w4i h ALA 249 CO 0.05 0.32 -0.06 0.87 0.00 0.00 0.00 179.25 180.43 2w4i h LYS 250 N 0.96 0.05 -0.05 0.00 1.57 -1.64 0.10 116.57 117.56 2w4i h LYS 250 Ca 0.36 -0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 59.04 2w4i h LYS 250 Cb 0.19 -0.01 0.01 0.00 0.08 0.00 0.00 32.23 32.49 2w4i h LYS 250 CO -0.13 0.04 -0.36 1.49 -0.57 0.00 0.00 179.45 179.92 2w4i h GLU 251 N 0.05 0.34 -0.12 3.15 4.57 -1.61 -2.96 114.58 118.01 2w4i h GLU 251 Ca 0.25 -0.29 -0.09 0.00 -1.18 0.00 0.00 59.36 58.05 2w4i h GLU 251 Cb 0.38 0.07 -0.01 0.00 -0.16 0.00 0.00 28.75 29.03 2w4i h GLU 251 CO -0.47 0.95 -0.34 -1.49 -1.18 0.00 0.00 179.01 176.48 2w4i h TRP 252 N -0.17 0.27 -0.01 0.92 4.06 -1.19 -3.11 115.95 116.72 2w4i h TRP 252 Ca -0.03 -0.06 0.00 0.00 2.06 0.00 0.00 58.89 60.86 2w4i h TRP 252 Cb 1.03 -0.06 0.00 0.00 -1.00 0.00 0.00 29.16 29.12 2w4i h TRP 252 CO 0.14 0.55 -0.11 1.28 -3.56 0.00 0.00 178.44 176.74 2w4i n LEU 253 N -4.09 1.32 0.00 -4.49 4.77 0.34 -4.79 117.00 110.06 2w4i n LEU 253 Ca -0.01 -0.41 0.00 0.00 -0.03 0.00 0.00 56.01 55.56 2w4i n LEU 253 Cb 0.42 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.46 2w4i n LEU 253 CO 0.41 0.23 0.13 0.29 -1.33 0.00 0.00 177.39 177.12