#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d3u n TRP 3 N 0.00 0.00 0.29 1.08 4.27 -1.26 -4.11 117.44 117.71 3d3u n TRP 3 Ca 0.00 0.00 0.18 0.00 -3.89 0.00 0.00 57.50 53.79 3d3u n TRP 3 Cb 0.00 -0.76 0.96 0.00 -1.36 0.00 0.00 31.31 30.15 3d3u n TRP 3 CO 0.00 0.00 0.00 -0.56 -2.29 0.00 0.00 177.69 174.84 3d3u h GLN 4 N 0.00 0.00 0.00 -2.67 -0.00 -2.00 0.43 115.11 110.87 3d3u h GLN 4 Ca -0.32 0.00 -0.16 0.00 -0.00 0.00 0.00 58.65 58.17 3d3u h GLN 4 Cb 1.70 0.00 -0.02 0.00 -0.00 0.00 0.00 27.48 29.15 3d3u h GLN 4 CO 0.02 0.00 -0.77 1.49 -0.00 0.00 0.00 178.83 179.57 3d3u h GLU 5 N 0.00 0.00 -0.34 0.06 4.57 -1.99 0.21 114.58 117.09 3d3u h GLU 5 Ca 0.03 0.00 -0.17 0.00 -1.18 0.00 0.00 59.36 58.04 3d3u h GLU 5 Cb 0.40 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 28.99 3d3u h GLU 5 CO -0.00 0.77 -0.46 1.25 -1.18 0.00 0.00 179.01 179.38 3d3u h LEU 6 N 0.00 1.00 -0.36 1.64 5.85 -0.68 -2.02 115.31 120.75 3d3u h LEU 6 Ca -0.01 -0.50 0.07 0.00 0.84 0.00 0.00 57.88 58.29 3d3u h LEU 6 Cb 1.38 -0.28 -0.07 0.00 0.37 0.00 0.00 40.66 42.06 3d3u h LEU 6 CO 0.10 1.30 -0.09 0.22 -0.34 0.00 0.00 178.44 179.63 3d3u h TYR 7 N 0.73 -0.20 -0.46 1.25 3.20 -0.05 -0.80 116.97 120.63 3d3u h TYR 7 Ca 0.04 0.03 -0.03 0.00 3.14 0.00 0.00 58.73 61.92 3d3u h TYR 7 Cb 1.07 0.14 -0.02 0.00 1.54 0.00 0.00 36.73 39.46 3d3u h TYR 7 CO 0.07 -0.16 0.19 0.00 -1.64 0.00 0.00 178.16 176.62 3d3u h ARG 8 N -0.01 0.69 0.00 1.82 2.47 -0.92 -2.85 114.38 115.59 3d3u h ARG 8 Ca 0.17 -0.12 0.00 0.00 -1.26 0.00 0.00 59.98 58.77 3d3u h ARG 8 Cb 0.27 -0.11 0.00 0.00 -1.65 0.00 0.00 29.97 28.47 3d3u h ARG 8 CO -0.37 0.62 0.00 0.94 0.56 0.00 0.00 179.97 181.72 3d3u n GLN 9 N -4.59 0.13 0.00 0.04 7.27 -0.35 -3.19 117.38 116.69 3d3u n GLN 9 Ca 0.01 0.17 0.00 0.00 0.07 0.00 0.00 57.00 57.25 3d3u n GLN 9 Cb 0.15 -1.50 0.00 0.00 2.41 0.00 0.00 30.24 31.30 3d3u n GLN 9 CO 0.00 0.00 0.00 0.54 0.07 0.00 0.00 177.06 177.67 3d3u n ARG 10 N -1.38 2.76 -2.32 3.69 1.74 -0.95 -5.02 116.66 115.18 3d3u n ARG 10 Ca 0.06 -0.23 -0.42 0.00 -0.77 0.00 0.00 57.85 56.50 3d3u n ARG 10 Cb 0.16 -0.71 -0.03 0.00 -1.02 0.00 0.00 32.46 30.86 3d3u n ARG 10 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3d3u s VAL 11 N -0.46 3.59 0.05 1.55 0.11 -1.10 -0.76 120.40 123.38 3d3u s VAL 11 Ca 0.00 1.23 0.00 0.00 -2.93 0.00 0.00 61.98 60.28 3d3u s VAL 11 Cb 0.00 -3.79 -0.00 0.00 -1.53 0.00 0.00 36.38 31.06 3d3u s VAL 11 CO 0.00 0.15 0.06 0.00 -3.33 0.00 0.00 175.10 171.98 3d3u s SER 13 N -1.35 5.94 0.21 0.00 1.04 -1.26 -4.39 113.70 113.89 3d3u s SER 13 Ca 0.05 0.58 -0.09 0.00 0.48 0.00 0.00 55.95 56.97 3d3u s SER 13 Cb 0.00 -1.82 0.30 0.00 0.10 0.00 0.00 66.02 64.60 3d3u s SER 13 CO 0.04 -0.72 1.72 0.00 0.98 0.00 0.00 173.24 175.26 3d3u h ALA 14 N 0.25 0.76 -0.57 5.32 0.00 -1.93 -1.36 119.26 121.73 3d3u h ALA 14 Ca -0.47 0.12 -0.11 0.00 0.00 0.00 0.00 54.91 54.45 3d3u h ALA 14 Cb 1.24 0.14 -0.02 0.00 0.00 0.00 0.00 17.79 19.14 3d3u h ALA 14 CO 0.60 -0.27 -0.08 -0.44 0.00 0.00 0.00 179.25 179.06 3d3u h ASP 15 N 0.31 1.05 -0.54 0.00 3.32 -1.93 0.24 116.42 118.88 3d3u h ASP 15 Ca 0.32 -0.34 -0.09 0.00 0.02 0.00 0.00 57.03 56.94 3d3u h ASP 15 Cb 0.46 -0.29 -0.02 0.00 0.22 0.00 0.00 39.33 39.70 3d3u h ASP 15 CO -0.37 1.14 -0.01 -0.33 -1.72 0.00 0.00 179.24 177.95 3d3u h GLU 16 N 0.94 0.99 -0.12 3.56 5.08 -1.87 0.10 114.58 123.26 3d3u h GLU 16 Ca 0.15 -0.30 -0.01 0.00 -1.00 0.00 0.00 59.36 58.19 3d3u h GLU 16 Cb 0.65 -0.09 -0.00 0.00 0.50 0.00 0.00 28.75 29.80 3d3u h GLU 16 CO 0.04 0.98 0.02 0.00 -1.00 0.00 0.00 179.01 179.05 3d3u h ALA 17 N 1.07 0.15 -0.36 3.43 0.00 -0.06 -0.89 119.26 122.60 3d3u h ALA 17 Ca 0.16 -0.15 0.06 0.00 0.00 0.00 0.00 54.91 54.99 3d3u h ALA 17 Cb 0.54 -0.04 -0.09 0.00 0.00 0.00 0.00 17.79 18.20 3d3u h ALA 17 CO 0.03 -0.20 -0.43 0.28 0.00 0.00 0.00 179.25 178.93 3d3u h VAL 18 N -0.03 0.12 -0.74 0.00 2.07 -0.46 0.80 116.25 118.01 3d3u h VAL 18 Ca 0.04 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.55 3d3u h VAL 18 Cb 0.28 0.12 -0.04 0.00 -1.52 0.00 0.00 31.29 30.13 3d3u h VAL 18 CO 0.00 0.00 0.44 0.58 0.02 0.00 0.00 177.57 178.62 3d3u h VAL 19 N -0.36 1.21 0.00 2.57 2.07 -0.69 -0.93 116.25 120.13 3d3u h VAL 19 Ca 0.12 -0.46 -0.17 0.00 0.82 0.00 0.00 66.70 67.01 3d3u h VAL 19 Cb 0.59 0.18 -0.02 0.00 -1.52 0.00 0.00 31.29 30.52 3d3u h VAL 19 CO -0.54 0.22 -0.82 0.44 0.02 0.00 0.00 177.57 176.89 3d3u h ASP 20 N 1.01 0.00 0.33 0.57 3.32 -0.96 -3.26 116.42 117.43 3d3u h ASP 20 Ca 0.26 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.31 3d3u h ASP 20 Cb -0.03 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.52 3d3u h ASP 20 CO -0.05 0.80 -0.74 -1.54 -1.72 0.00 0.00 179.24 175.98 3d3u n SER 21 N -3.29 0.68 -3.64 6.45 3.41 0.26 -4.59 113.62 112.89 3d3u n SER 21 Ca 0.00 -0.48 -0.33 0.00 -0.26 0.00 0.00 58.87 57.80 3d3u n SER 21 Cb 0.86 0.57 -0.04 0.00 -0.26 0.00 0.00 64.21 65.34 3d3u n SER 21 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3d3u n LEU 22 N -1.58 4.87 -4.75 1.04 4.77 -0.37 -4.96 117.00 116.02 3d3u n LEU 22 Ca 0.04 -5.36 -0.38 0.00 -0.03 0.00 0.00 56.01 50.28 3d3u n LEU 22 Cb 0.35 -0.91 0.04 0.00 -2.33 0.00 0.00 43.42 40.57 3d3u n LEU 22 CO 0.38 1.92 0.98 -0.54 -1.33 0.00 0.00 177.39 178.81 3d3u s LYS 23 N -2.65 3.18 0.30 3.23 -0.14 -1.26 -4.77 119.74 117.63 3d3u s LYS 23 Ca 0.37 2.22 -0.24 0.00 -1.36 0.00 0.00 55.97 56.95 3d3u s LYS 23 Cb 0.11 -2.27 -0.16 0.00 -1.68 0.00 0.00 37.83 33.83 3d3u s LYS 23 CO 0.03 -1.15 0.30 -2.30 -0.76 0.00 0.00 175.35 171.47 3d3u n PRO 24 N -0.98 0.00 -0.87 -1.68 -0.02 -1.26 -1.17 135.00 129.02 3d3u n PRO 24 Ca 0.10 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.58 3d3u n PRO 24 Cb 0.45 -0.99 0.00 0.00 -0.02 0.00 0.00 33.50 32.94 3d3u n PRO 24 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3d3u n GLY 25 N 2.14 0.07 3.79 -1.23 0.00 -1.21 -4.76 105.19 103.99 3d3u n GLY 25 Ca 0.14 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.82 3d3u n GLY 25 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3d3u s THR 26 N -1.18 3.58 -0.06 2.61 -4.23 -0.31 -4.84 115.64 111.20 3d3u s THR 26 Ca 0.00 1.01 -0.03 0.00 -1.18 0.00 0.00 61.69 61.50 3d3u s THR 26 Cb 0.00 -3.43 -0.04 0.00 1.34 0.00 0.00 72.50 70.38 3d3u s THR 26 CO 0.00 -0.18 0.07 -0.54 -0.54 0.00 0.00 174.62 173.43 3d3u s LYS 27 N -3.15 3.14 0.10 3.99 1.02 -1.26 -2.02 119.74 121.57 3d3u s LYS 27 Ca 0.68 -0.36 0.04 0.00 0.02 0.00 0.00 55.97 56.34 3d3u s LYS 27 Cb -0.20 -2.93 -0.04 0.00 -0.52 0.00 0.00 37.83 34.15 3d3u s LYS 27 CO 0.23 0.70 -0.10 0.14 -0.92 0.00 0.00 175.35 175.40 3d3u s VAL 28 N -1.05 0.96 -0.04 3.17 -7.23 0.44 -2.12 120.40 114.53 3d3u s VAL 28 Ca 0.18 -1.71 0.04 0.00 -1.81 0.00 0.00 61.98 58.67 3d3u s VAL 28 Cb -0.12 -1.44 -0.00 0.00 0.56 0.00 0.00 36.38 35.38 3d3u s VAL 28 CO 0.08 -0.60 -0.15 -0.69 -0.31 0.00 0.00 175.10 173.42 3d3u s VAL 29 N -2.62 1.29 -0.04 1.32 1.01 -0.80 -0.79 120.40 119.76 3d3u s VAL 29 Ca 0.07 -0.64 -0.02 0.00 0.00 0.00 0.00 61.98 61.40 3d3u s VAL 29 Cb -0.02 -1.12 -0.04 0.00 0.00 0.00 0.00 36.38 35.21 3d3u s VAL 29 CO -0.00 0.38 0.06 -0.36 0.00 0.00 0.00 175.10 175.17 3d3u s PHE 30 N 0.06 3.26 0.87 5.22 2.99 -0.46 -0.54 117.98 129.38 3d3u s PHE 30 Ca -0.03 0.23 -0.11 0.00 0.00 0.00 0.00 56.93 57.02 3d3u s PHE 30 Cb -0.11 -1.77 0.11 0.00 0.00 0.00 0.00 43.02 41.25 3d3u s PHE 30 CO 0.02 0.54 1.10 0.20 -0.00 0.00 0.00 175.22 177.07 3d3u s GLY 31 N -1.36 1.65 0.43 4.36 0.00 -0.48 -4.75 107.32 107.17 3d3u s GLY 31 Ca 0.18 0.17 0.04 0.00 0.00 0.00 0.00 44.72 45.11 3d3u s GLY 31 CO 0.09 0.61 0.03 -2.38 0.00 0.00 0.00 173.10 171.44 3d3u s HIS 32 N -2.84 2.12 0.00 1.90 -0.00 -1.26 -3.98 115.29 111.23 3d3u s HIS 32 Ca 0.63 -0.89 0.00 0.00 -0.00 0.00 0.00 55.06 54.80 3d3u s HIS 32 Cb -0.19 -1.56 0.00 0.00 -0.00 0.00 0.00 32.58 30.83 3d3u s HIS 32 CO 0.57 0.21 0.00 0.00 -0.00 0.00 0.00 174.74 175.52 3d3u n ALA 33 N -1.00 0.00 0.68 -1.38 0.00 0.23 -2.64 120.51 116.40 3d3u n ALA 33 Ca -0.09 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.46 3d3u n ALA 33 Cb 0.67 0.00 0.28 0.00 0.00 0.00 0.00 19.45 20.39 3d3u n ALA 33 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3d3u n ALA 34 N 8.35 2.46 -0.52 0.00 0.00 -1.26 -2.01 120.51 127.52 3d3u n ALA 34 Ca 0.00 -0.79 0.06 0.00 0.00 0.00 0.00 53.44 52.71 3d3u n ALA 34 Cb 0.00 -0.97 0.18 0.00 0.00 0.00 0.00 19.45 18.65 3d3u n ALA 34 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3d3u n ALA 35 N 0.94 2.47 -1.91 0.00 0.00 -1.08 -4.40 120.51 116.53 3d3u n ALA 35 Ca 0.18 -1.66 -0.41 0.00 0.00 0.00 0.00 53.44 51.54 3d3u n ALA 35 Cb 0.46 -0.50 -0.03 0.00 0.00 0.00 0.00 19.45 19.39 3d3u n ALA 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3d3u s ALA 36 N -1.80 3.63 -1.14 0.00 0.00 -1.22 -3.39 121.76 117.83 3d3u s ALA 36 Ca 0.29 1.29 -0.10 0.00 0.00 0.00 0.00 51.96 53.44 3d3u s ALA 36 Cb 0.20 -3.55 0.25 0.00 0.00 0.00 0.00 23.12 20.02 3d3u s ALA 36 CO 0.11 -0.71 1.20 -0.35 0.00 0.00 0.00 175.76 176.01 3d3u n PRO 37 N 2.64 3.51 0.10 0.00 -0.05 -1.26 -4.79 135.00 135.15 3d3u n PRO 37 Ca 0.08 -4.30 -0.01 0.00 -0.05 0.00 0.00 63.50 59.21 3d3u n PRO 37 Cb 0.40 -2.68 0.25 0.00 -0.05 0.00 0.00 33.50 31.43 3d3u n PRO 37 CO 0.00 0.00 0.00 -0.24 -0.05 0.00 0.00 175.50 175.21 3d3u h VAL 38 N 3.90 1.29 -0.56 0.52 3.04 -1.92 -1.24 116.25 121.27 3d3u h VAL 38 Ca 0.22 -1.40 0.03 0.00 -1.01 0.00 0.00 66.70 64.54 3d3u h VAL 38 Cb 0.87 1.61 -0.04 0.00 -2.01 0.00 0.00 31.29 31.72 3d3u h VAL 38 CO 1.08 0.42 0.32 0.03 -1.01 0.00 0.00 177.57 178.41 3d3u h ARG 39 N 0.20 0.61 -0.73 4.17 -0.00 -1.99 0.43 114.38 117.07 3d3u h ARG 39 Ca 0.02 -0.04 -0.03 0.00 -0.50 0.00 0.00 59.98 59.44 3d3u h ARG 39 Cb 0.74 -0.14 -0.03 0.00 0.00 0.00 0.00 29.97 30.54 3d3u h ARG 39 CO 0.06 0.40 0.35 0.35 0.00 0.00 0.00 179.97 181.13 3d3u h PHE 40 N 0.63 1.06 -0.62 3.04 3.04 -1.89 0.37 116.94 122.56 3d3u h PHE 40 Ca 0.23 -0.05 0.01 0.00 3.98 0.00 0.00 57.97 62.14 3d3u h PHE 40 Cb 0.07 -0.33 -0.03 0.00 2.56 0.00 0.00 35.95 38.22 3d3u h PHE 40 CO -0.07 0.78 0.41 1.03 -2.02 0.00 0.00 178.31 178.44 3d3u h SER 41 N 1.03 0.71 0.05 0.41 0.87 0.13 -0.86 113.55 115.89 3d3u h SER 41 Ca 0.25 -0.02 0.02 0.00 -1.23 0.00 0.00 61.79 60.82 3d3u h SER 41 Cb 0.12 -0.18 -0.03 0.00 -0.44 0.00 0.00 62.40 61.87 3d3u h SER 41 CO -0.03 0.51 -0.20 -0.61 -0.53 0.00 0.00 176.83 175.97 3d3u h GLN 42 N 0.84 -0.34 0.00 2.24 5.75 -0.01 -0.15 115.11 123.43 3d3u h GLN 42 Ca 0.23 0.02 -0.03 0.00 -0.15 0.00 0.00 58.65 58.72 3d3u h GLN 42 Cb -0.09 0.08 -0.00 0.00 1.07 0.00 0.00 27.48 28.53 3d3u h GLN 42 CO -0.05 -0.23 -0.16 0.00 -2.65 0.00 0.00 178.83 175.74 3d3u h ALA 43 N 0.49 1.64 -0.37 3.38 0.00 0.21 -1.33 119.26 123.28 3d3u h ALA 43 Ca 0.04 -0.14 -0.14 0.00 0.00 0.00 0.00 54.91 54.67 3d3u h ALA 43 Cb 0.41 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.16 3d3u h ALA 43 CO -0.15 0.20 -0.32 0.52 0.00 0.00 0.00 179.25 179.50 3d3u h MET 44 N 0.00 0.82 0.19 0.00 2.86 -0.22 -1.61 114.93 116.97 3d3u h MET 44 Ca -0.00 -0.39 -0.00 0.00 -2.06 0.00 0.00 59.70 57.25 3d3u h MET 44 Cb 0.30 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.93 3d3u h MET 44 CO 0.02 1.02 -0.30 -0.92 1.06 0.00 0.00 176.91 177.79 3d3u h TYR 45 N 0.69 -0.85 -1.00 -0.22 3.20 0.07 -1.92 116.97 116.95 3d3u h TYR 45 Ca 0.07 0.01 0.21 0.00 3.14 0.00 0.00 58.73 62.17 3d3u h TYR 45 Cb 0.87 0.34 -0.11 0.00 1.54 0.00 0.00 36.73 39.37 3d3u h TYR 45 CO 0.05 -0.37 0.59 0.00 -1.64 0.00 0.00 178.16 176.79 3d3u h ARG 46 N -0.52 0.67 -0.58 1.82 3.08 -1.42 -1.51 114.38 115.92 3d3u h ARG 46 Ca -0.02 -0.04 0.00 0.00 0.07 0.00 0.00 59.98 59.99 3d3u h ARG 46 Cb 0.48 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 30.37 3d3u h ARG 46 CO -0.10 0.44 0.00 1.04 -1.07 0.00 0.00 179.97 180.29 3d3u n GLN 47 N -4.82 2.53 -0.03 0.04 1.13 -0.61 -4.61 117.38 111.01 3d3u n GLN 47 Ca 0.24 -1.60 0.23 0.00 -1.94 0.00 0.00 57.00 53.94 3d3u n GLN 47 Cb 0.63 -1.61 0.72 0.00 0.11 0.00 0.00 30.24 30.08 3d3u n GLN 47 CO 0.00 0.00 0.00 0.07 -1.44 0.00 0.00 177.06 175.69 3d3u h ARG 48 N 2.29 0.00 0.00 -1.09 0.11 -0.44 -1.49 114.38 113.76 3d3u h ARG 48 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 3d3u h ARG 48 Cb 0.92 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.00 3d3u h ARG 48 CO 0.13 0.00 -0.00 0.93 0.10 0.00 0.00 179.97 181.13 3d3u h GLU 49 N 0.00 0.00 0.00 0.08 4.39 -1.85 -2.40 114.58 114.81 3d3u h GLU 49 Ca 0.29 0.00 -0.16 0.00 0.34 0.00 0.00 59.36 59.84 3d3u h GLU 49 Cb 1.29 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.91 3d3u h GLU 49 CO -0.00 0.00 -2.05 1.63 -1.16 0.00 0.00 179.01 177.42 3d3u n LYS 50 N -2.49 0.67 -2.56 2.33 5.02 -0.57 -4.97 118.16 115.60 3d3u n LYS 50 Ca 0.05 -0.08 -0.40 0.00 -2.02 0.00 0.00 58.31 55.87 3d3u n LYS 50 Cb 0.46 -1.56 -0.05 0.00 -0.02 0.00 0.00 35.03 33.86 3d3u n LYS 50 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3d3u s LEU 51 N -5.04 4.51 0.00 -0.35 2.01 -0.90 -4.95 118.68 113.96 3d3u s LEU 51 Ca -0.08 2.15 0.00 0.00 0.01 0.00 0.00 54.13 56.21 3d3u s LEU 51 Cb 0.10 -3.71 0.00 0.00 0.01 0.00 0.00 46.19 42.59 3d3u s LEU 51 CO 0.87 -0.12 0.00 -0.62 1.01 0.00 0.00 176.35 177.49 3d3u n GLU 52 N 1.06 0.00 -3.04 1.70 -0.58 -1.26 -4.56 120.64 113.95 3d3u n GLU 52 Ca -0.00 0.00 -0.41 0.00 -0.42 0.00 0.00 57.16 56.33 3d3u n GLU 52 Cb 0.46 0.00 -0.00 0.00 -0.57 0.00 0.00 31.44 31.33 3d3u n GLU 52 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 3d3u n ASN 53 N 0.00 6.11 -4.72 1.62 3.02 -1.26 -4.20 115.26 115.83 3d3u n ASN 53 Ca 0.00 -3.44 -0.37 0.00 -0.03 0.00 0.00 54.58 50.75 3d3u n ASN 53 Cb 0.00 -1.18 -0.07 0.00 -0.61 0.00 0.00 39.78 37.92 3d3u n ASN 53 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3d3u s ILE 54 N -2.84 5.26 -0.17 2.41 -1.09 -0.84 -3.34 121.20 120.59 3d3u s ILE 54 Ca 0.33 0.68 -0.08 0.00 -2.23 0.00 0.00 60.65 59.36 3d3u s ILE 54 Cb 0.07 -3.70 -0.04 0.00 -1.58 0.00 0.00 42.46 37.21 3d3u s ILE 54 CO 0.08 0.36 0.08 -0.89 -1.23 0.00 0.00 174.94 173.34 3d3u s THR 55 N 0.60 4.99 -0.07 2.92 2.01 -0.86 -1.36 115.64 123.89 3d3u s THR 55 Ca 0.20 0.03 0.03 0.00 0.31 0.00 0.00 61.69 62.26 3d3u s THR 55 Cb -0.14 -3.24 -0.02 0.00 0.01 0.00 0.00 72.50 69.11 3d3u s THR 55 CO 0.06 0.49 -0.15 0.54 -0.69 0.00 0.00 174.62 174.87 3d3u s VAL 56 N 0.08 2.95 -0.08 3.82 0.11 0.64 -0.42 120.40 127.51 3d3u s VAL 56 Ca 0.07 -0.75 0.01 0.00 -2.93 0.00 0.00 61.98 58.37 3d3u s VAL 56 Cb -0.12 -2.17 -0.03 0.00 -1.53 0.00 0.00 36.38 32.54 3d3u s VAL 56 CO 0.00 0.58 -0.07 0.12 -3.33 0.00 0.00 175.10 172.39 3d3u s PHE 57 N -0.46 2.93 0.02 1.54 2.19 0.03 -0.60 117.98 123.63 3d3u s PHE 57 Ca 0.06 -0.04 -0.04 0.00 0.33 0.00 0.00 56.93 57.23 3d3u s PHE 57 Cb -0.12 -1.73 0.01 0.00 -1.31 0.00 0.00 43.02 39.87 3d3u s PHE 57 CO 0.02 0.27 0.18 -2.39 1.83 0.00 0.00 175.22 175.13 3d3u n HIS 58 N 2.40 -0.55 0.00 10.12 1.44 -1.26 -1.36 115.22 126.00 3d3u n HIS 58 Ca -0.18 -0.18 0.00 0.00 -2.01 0.00 0.00 57.72 55.35 3d3u n HIS 58 Cb 0.53 0.09 0.00 0.00 0.12 0.00 0.00 29.99 30.73 3d3u n HIS 58 CO 0.00 0.00 0.00 -1.33 -2.81 0.00 0.00 176.34 172.20 3d3u n MET 59 N -0.13 0.00 -2.28 -1.40 2.81 -1.26 -4.94 117.12 109.91 3d3u n MET 59 Ca -0.00 0.00 -0.42 0.00 -1.81 0.00 0.00 57.70 55.47 3d3u n MET 59 Cb 0.10 0.00 -0.03 0.00 -0.71 0.00 0.00 33.22 32.58 3d3u n MET 59 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 3d3u s LEU 60 N 0.00 4.30 -0.12 4.03 2.01 -1.26 -4.96 118.68 122.69 3d3u s LEU 60 Ca 0.00 2.03 0.02 0.00 0.01 0.00 0.00 54.13 56.19 3d3u s LEU 60 Cb 0.00 -3.56 -0.00 0.00 0.01 0.00 0.00 46.19 42.64 3d3u s LEU 60 CO 0.00 -0.69 -0.20 -0.72 1.01 0.00 0.00 176.35 175.75 3d3u s TYR 61 N 2.41 2.66 -0.52 0.29 1.13 -1.26 0.73 117.35 122.79 3d3u s TYR 61 Ca 0.62 -1.03 -0.16 0.00 -1.41 0.00 0.00 57.07 55.08 3d3u s TYR 61 Cb -0.29 -1.78 0.10 0.00 -1.10 0.00 0.00 41.96 38.89 3d3u s TYR 61 CO 0.25 -0.43 0.50 -0.06 -2.51 0.00 0.00 175.55 173.30 3d3u s PHE 62 N 0.49 3.21 0.00 -3.49 2.99 -0.85 -4.81 117.98 115.52 3d3u s PHE 62 Ca -0.13 -1.08 0.00 0.00 0.00 0.00 0.00 56.93 55.72 3d3u s PHE 62 Cb -0.17 -3.59 0.00 0.00 0.00 0.00 0.00 43.02 39.26 3d3u s PHE 62 CO 0.05 -0.98 0.00 0.41 -0.00 0.00 0.00 175.22 174.71 3d3u n GLY 63 N 5.23 1.78 1.69 4.36 0.00 -1.26 -4.84 105.19 112.15 3d3u n GLY 63 Ca -0.12 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.77 3d3u n GLY 63 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3d3u n ASP 64 N 0.05 -0.43 0.00 1.61 10.43 -1.26 -4.78 116.55 122.17 3d3u n ASP 64 Ca 0.00 -0.29 0.00 0.00 2.57 0.00 0.00 54.79 57.07 3d3u n ASP 64 Cb 0.00 0.00 0.00 0.00 1.84 0.00 0.00 41.12 42.96 3d3u n ASP 64 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 3d3u n ALA 65 N 1.90 0.00 -1.04 2.24 0.00 -1.26 -4.68 120.51 117.68 3d3u n ALA 65 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.43 3d3u n ALA 65 Cb 0.11 0.00 -0.01 0.00 0.00 0.00 0.00 19.45 19.55 3d3u n ALA 65 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 3d3u n PRO 66 N -0.46 0.01 0.00 0.00 -0.04 -1.26 -4.00 135.00 129.24 3d3u n PRO 66 Ca 0.00 -0.11 0.00 0.00 -0.04 0.00 0.00 63.50 63.35 3d3u n PRO 66 Cb 0.00 -1.19 0.00 0.00 -0.04 0.00 0.00 33.50 32.27 3d3u n PRO 66 CO 0.00 0.00 0.00 0.72 -0.04 0.00 0.00 175.50 176.18 3d3u n HIS 67 N 5.47 0.00 0.37 0.54 8.25 -1.26 -4.59 115.22 124.01 3d3u n HIS 67 Ca 0.03 0.00 0.08 0.00 -0.26 0.00 0.00 57.72 57.57 3d3u n HIS 67 Cb 0.50 0.00 0.22 0.00 1.12 0.00 0.00 29.99 31.83 3d3u n HIS 67 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 3d3u n LEU 68 N -0.96 2.75 -4.71 2.41 7.94 -1.26 -4.69 117.00 118.48 3d3u n LEU 68 Ca 0.00 -1.38 -0.42 0.00 -1.11 0.00 0.00 56.01 53.10 3d3u n LEU 68 Cb 0.00 -0.35 -0.03 0.00 0.53 0.00 0.00 43.42 43.57 3d3u n LEU 68 CO 0.00 0.67 1.24 0.00 -1.11 0.00 0.00 177.39 178.19 3d3u s ALA 69 N -1.36 3.73 0.48 1.96 0.00 -1.26 -4.83 121.76 120.48 3d3u s ALA 69 Ca 0.34 1.29 0.30 0.00 0.00 0.00 0.00 51.96 53.89 3d3u s ALA 69 Cb 0.18 -3.64 1.39 0.00 0.00 0.00 0.00 23.12 21.05 3d3u s ALA 69 CO 0.23 -0.86 1.74 -1.35 0.00 0.00 0.00 175.76 175.51 3d3u h PRO 70 N 7.29 0.15 0.00 0.00 0.11 -2.01 -1.74 132.00 135.80 3d3u h PRO 70 Ca -0.42 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.68 3d3u h PRO 70 Cb 1.20 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.28 3d3u h PRO 70 CO 0.91 0.10 0.00 -0.85 -0.21 0.00 0.00 178.00 177.95 3d3u n GLU 71 N -4.41 0.19 0.22 1.05 0.00 -1.26 -0.97 120.64 115.46 3d3u n GLU 71 Ca 0.29 0.38 0.15 0.00 0.00 0.00 0.00 57.16 57.98 3d3u n GLU 71 Cb 1.21 -1.83 0.72 0.00 0.00 0.00 0.00 31.44 31.54 3d3u n GLU 71 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.13 177.65 3d3u h MET 72 N 0.00 0.00 -6.18 3.44 2.86 -1.59 -3.44 114.93 110.02 3d3u h MET 72 Ca 0.00 0.00 -0.72 0.00 -2.06 0.00 0.00 59.70 56.92 3d3u h MET 72 Cb 0.40 0.00 0.03 0.00 0.06 0.00 0.00 31.60 32.09 3d3u h MET 72 CO 0.00 0.00 0.78 -2.13 1.06 0.00 0.00 176.91 176.62 3d3u n ARG 73 N -2.63 1.17 -0.35 1.72 0.63 -0.15 0.22 116.66 117.28 3d3u n ARG 73 Ca -0.00 0.43 0.00 0.00 -0.92 0.00 0.00 57.85 57.36 3d3u n ARG 73 Cb 0.16 -2.10 0.00 0.00 0.45 0.00 0.00 32.46 30.97 3d3u n ARG 73 CO 0.00 0.00 0.00 -1.13 -2.51 0.00 0.00 177.63 173.99 3d3u n SER 74 N 4.58 0.00 -0.13 6.15 3.41 -1.26 -4.84 113.62 121.54 3d3u n SER 74 Ca 0.24 0.00 -0.25 0.00 -0.26 0.00 0.00 58.87 58.60 3d3u n SER 74 Cb 0.15 -0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 64.01 3d3u n SER 74 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 3d3u n HIS 75 N -2.00 0.06 -3.71 7.33 8.25 0.59 -4.62 115.22 121.12 3d3u n HIS 75 Ca 0.00 0.03 -0.12 0.00 -0.26 0.00 0.00 57.72 57.37 3d3u n HIS 75 Cb 0.00 -0.90 -0.13 0.00 1.12 0.00 0.00 29.99 30.08 3d3u n HIS 75 CO 0.00 0.00 0.00 0.54 0.64 0.00 0.00 176.34 177.52 3d3u s VAL 76 N -2.58 -0.11 0.05 1.59 0.11 -0.30 -1.98 120.40 117.18 3d3u s VAL 76 Ca -0.36 0.16 0.05 0.00 -2.93 0.00 0.00 61.98 58.89 3d3u s VAL 76 Cb 0.12 -0.44 -0.04 0.00 -1.53 0.00 0.00 36.38 34.49 3d3u s VAL 76 CO 0.48 0.07 -0.06 -1.00 -3.33 0.00 0.00 175.10 171.26 3d3u s HIS 77 N 1.51 2.88 0.36 1.54 0.09 -0.46 -4.63 115.29 116.58 3d3u s HIS 77 Ca -0.08 -0.06 -0.23 0.00 -0.00 0.00 0.00 55.06 54.70 3d3u s HIS 77 Cb -0.10 -1.55 -0.10 0.00 -0.00 0.00 0.00 32.58 30.83 3d3u s HIS 77 CO -0.10 0.42 0.92 -1.25 -0.00 0.00 0.00 174.74 174.73 3d3u s PRO 78 N -1.85 4.37 0.19 8.40 0.04 -1.26 -0.26 135.00 144.64 3d3u s PRO 78 Ca 0.20 1.17 0.09 0.00 0.04 0.00 0.00 61.00 62.50 3d3u s PRO 78 Cb -0.11 -2.51 -0.04 0.00 0.04 0.00 0.00 34.50 31.87 3d3u s PRO 78 CO 0.12 0.15 -0.17 0.95 0.04 0.00 0.00 177.00 178.09 3d3u s THR 79 N -1.88 1.86 0.07 1.26 -4.23 0.23 -4.84 115.64 108.10 3d3u s THR 79 Ca 0.55 -2.09 0.01 0.00 -1.18 0.00 0.00 61.69 58.98 3d3u s THR 79 Cb -0.14 -1.98 -0.01 0.00 1.34 0.00 0.00 72.50 71.72 3d3u s THR 79 CO 0.18 -0.44 0.06 0.00 -0.54 0.00 0.00 174.62 173.88 3d3u n LEU 80 N -0.08 0.00 0.00 4.79 -0.00 -1.26 -4.24 117.00 116.20 3d3u n LEU 80 Ca -0.10 -0.62 0.00 0.00 -0.00 0.00 0.00 56.01 55.29 3d3u n LEU 80 Cb 0.59 0.35 0.00 0.00 -0.00 0.00 0.00 43.42 44.35 3d3u n LEU 80 CO 0.32 -0.11 -0.04 0.00 -0.00 0.00 0.00 177.39 177.56 3d3u s HIS 102 N -0.28 2.27 0.15 0.00 3.76 -1.26 -2.88 115.29 117.05 3d3u s HIS 102 Ca 0.00 -0.34 0.02 0.00 -0.15 0.00 0.00 55.06 54.59 3d3u s HIS 102 Cb 0.00 -4.40 0.39 0.00 1.11 0.00 0.00 32.58 29.68 3d3u s HIS 102 CO 0.00 -1.73 0.74 0.34 -0.85 0.00 0.00 174.74 173.24 3d3u n PHE 103 N 11.21 0.33 0.09 1.40 -0.00 -1.26 -1.35 117.46 127.89 3d3u n PHE 103 Ca 0.40 0.57 0.05 0.00 -0.00 0.00 0.00 57.45 58.47 3d3u n PHE 103 Cb 0.48 -0.87 0.29 0.00 -0.00 0.00 0.00 39.48 39.38 3d3u n PHE 103 CO 0.00 0.00 0.00 -2.39 -0.00 0.00 0.00 176.76 174.37 3d3u n HIS 104 N -4.48 0.36 1.06 -5.13 1.44 -1.26 -2.38 115.22 104.83 3d3u n HIS 104 Ca 0.12 0.19 0.12 0.00 -2.01 0.00 0.00 57.72 56.13 3d3u n HIS 104 Cb 0.39 -0.73 0.14 0.00 0.12 0.00 0.00 29.99 29.92 3d3u n HIS 104 CO 0.00 0.00 0.00 0.39 -2.81 0.00 0.00 176.34 173.92 3d3u n GLU 105 N -1.86 0.41 0.21 -1.40 1.02 -0.45 -4.06 120.64 114.50 3d3u n GLU 105 Ca -0.01 -0.29 -0.17 0.00 -0.02 0.00 0.00 57.16 56.68 3d3u n GLU 105 Cb 0.11 -1.49 -0.09 0.00 -0.02 0.00 0.00 31.44 29.95 3d3u n GLU 105 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 3d3u h VAL 106 N 0.71 0.09 -1.00 2.62 2.07 -1.65 -2.25 116.25 116.84 3d3u h VAL 106 Ca 0.00 0.00 0.21 0.00 0.82 0.00 0.00 66.70 67.73 3d3u h VAL 106 Cb 0.55 0.09 -0.19 0.00 -1.52 0.00 0.00 31.29 30.21 3d3u h VAL 106 CO 0.00 0.00 -0.22 -2.65 0.02 0.00 0.00 177.57 174.72 3d3u n PRO 107 N -5.51 -0.09 0.14 1.57 -0.02 -1.26 0.12 135.00 129.96 3d3u n PRO 107 Ca -0.10 1.55 0.18 0.00 -2.02 0.00 0.00 63.50 63.11 3d3u n PRO 107 Cb 0.42 -2.33 0.68 0.00 -0.02 0.00 0.00 33.50 32.25 3d3u n PRO 107 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 3d3u h GLU 108 N 0.00 0.00 -0.73 -0.52 4.57 -1.65 -1.97 114.58 114.28 3d3u h GLU 108 Ca 0.49 0.00 0.01 0.00 -1.18 0.00 0.00 59.36 58.68 3d3u h GLU 108 Cb 0.79 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 29.34 3d3u h GLU 108 CO -1.02 0.00 0.48 -0.07 -1.18 0.00 0.00 179.01 177.22 3d3u h LEU 109 N 0.00 0.84 -0.06 1.64 4.07 0.10 -2.85 115.31 119.06 3d3u h LEU 109 Ca 0.16 -0.03 -0.03 0.00 0.08 0.00 0.00 57.88 58.06 3d3u h LEU 109 Cb 1.25 -0.21 -0.00 0.00 1.08 0.00 0.00 40.66 42.78 3d3u h LEU 109 CO -0.00 0.62 -0.09 -0.26 -1.08 0.00 0.00 178.44 177.63 3d3u h PHE 110 N 0.99 0.20 0.00 1.13 0.04 -1.46 -0.42 116.94 117.42 3d3u h PHE 110 Ca 0.27 -0.07 0.00 0.00 2.80 0.00 0.00 57.97 60.97 3d3u h PHE 110 Cb -0.11 -0.04 0.00 0.00 2.20 0.00 0.00 35.95 38.01 3d3u h PHE 110 CO -0.02 0.67 0.00 0.54 -0.60 0.00 0.00 178.31 178.90 3d3u n ARG 111 N -4.68 0.87 0.00 1.51 1.74 -1.01 -1.59 116.66 113.50 3d3u n ARG 111 Ca -0.08 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.00 3d3u n ARG 111 Cb 0.34 -1.32 0.00 0.00 -1.02 0.00 0.00 32.46 30.45 3d3u n ARG 111 CO 0.00 0.00 0.00 0.94 -1.52 0.00 0.00 177.63 177.05 3d3u n GLN 112 N 0.21 0.00 -0.94 5.56 7.27 -1.09 -4.94 117.38 123.45 3d3u n GLN 112 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.07 3d3u n GLN 112 Cb 0.28 -0.00 0.00 0.00 2.41 0.00 0.00 30.24 32.93 3d3u n GLN 112 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 3d3u n GLY 113 N 0.00 0.73 0.32 1.69 0.00 -0.62 -4.89 105.19 102.42 3d3u n GLY 113 Ca 0.00 0.00 0.20 0.00 0.00 0.00 0.00 46.02 46.22 3d3u n GLY 113 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 3d3u h PHE 114 N 0.00 0.59 -3.48 1.61 -1.00 -1.37 -3.22 116.94 110.08 3d3u h PHE 114 Ca 0.00 0.05 -0.65 0.00 2.81 0.00 0.00 57.97 60.18 3d3u h PHE 114 Cb 0.04 -0.10 -0.41 0.00 3.61 0.00 0.00 35.95 39.09 3d3u h PHE 114 CO 0.03 -0.27 -0.67 0.12 -1.61 0.00 0.00 178.31 175.90 3d3u s PHE 115 N -5.77 3.32 -0.54 -0.55 2.19 -0.43 -5.02 117.98 111.17 3d3u s PHE 115 Ca -0.11 -3.04 -0.24 0.00 0.33 0.00 0.00 56.93 53.87 3d3u s PHE 115 Cb 0.29 -2.79 -0.22 0.00 -1.31 0.00 0.00 43.02 38.99 3d3u s PHE 115 CO 0.78 -0.83 1.82 -0.35 1.83 0.00 0.00 175.22 178.48 3d3u n PRO 116 N 3.62 1.06 -1.68 10.12 -0.04 -1.22 -4.46 135.00 142.40 3d3u n PRO 116 Ca 0.05 -1.58 -0.45 0.00 -0.04 0.00 0.00 63.50 61.48 3d3u n PRO 116 Cb 0.36 -2.78 -0.03 0.00 -0.04 0.00 0.00 33.50 31.02 3d3u n PRO 116 CO 0.00 0.00 0.00 1.47 -0.04 0.00 0.00 175.50 176.93 3d3u n LEU 117 N 7.82 3.31 -0.12 1.53 -0.00 -1.26 -4.79 117.00 123.49 3d3u n LEU 117 Ca 0.48 1.11 -0.22 0.00 -0.00 0.00 0.00 56.01 57.38 3d3u n LEU 117 Cb 0.40 -1.46 -0.11 0.00 -0.00 0.00 0.00 43.42 42.25 3d3u n LEU 117 CO 1.07 -0.28 -1.30 0.47 -0.00 0.00 0.00 177.39 177.36 3d3u n ASP 118 N 2.83 1.98 -4.09 1.45 8.00 -0.90 -4.59 116.55 121.22 3d3u n ASP 118 Ca 0.14 0.08 -0.25 0.00 0.71 0.00 0.00 54.79 55.47 3d3u n ASP 118 Cb 0.31 -0.61 -0.16 0.00 -0.02 0.00 0.00 41.12 40.64 3d3u n ASP 118 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3d3u s VAL 119 N -2.51 1.25 -0.26 2.53 0.11 -1.18 -2.64 120.40 117.70 3d3u s VAL 119 Ca -0.35 -0.60 -0.08 0.00 -2.93 0.00 0.00 61.98 58.02 3d3u s VAL 119 Cb 0.11 -1.09 -0.03 0.00 -1.53 0.00 0.00 36.38 33.83 3d3u s VAL 119 CO 0.58 0.37 0.09 0.00 -3.33 0.00 0.00 175.10 172.81 3d3u s ALA 120 N 0.21 3.21 -0.37 1.54 0.00 -0.47 -1.91 121.76 123.97 3d3u s ALA 120 Ca -0.06 -1.14 -0.10 0.00 0.00 0.00 0.00 51.96 50.66 3d3u s ALA 120 Cb -0.12 -2.14 0.03 0.00 0.00 0.00 0.00 23.12 20.89 3d3u s ALA 120 CO 0.02 -0.51 0.19 0.08 0.00 0.00 0.00 175.76 175.54 3d3u s VAL 121 N 1.63 4.50 0.29 0.00 1.01 0.30 -0.88 120.40 127.25 3d3u s VAL 121 Ca 0.06 -0.85 0.07 0.00 0.00 0.00 0.00 61.98 61.27 3d3u s VAL 121 Cb -0.15 -3.50 -0.06 0.00 0.00 0.00 0.00 36.38 32.67 3d3u s VAL 121 CO 0.05 -0.20 -0.07 0.68 0.00 0.00 0.00 175.10 175.55 3d3u s VAL 122 N 1.54 1.78 -0.48 2.92 -7.23 -0.59 -1.38 120.40 116.96 3d3u s VAL 122 Ca 0.02 -2.15 -0.01 0.00 -1.81 0.00 0.00 61.98 58.02 3d3u s VAL 122 Cb -0.19 -2.45 0.13 0.00 0.56 0.00 0.00 36.38 34.42 3d3u s VAL 122 CO 0.06 -0.30 0.27 -1.58 -0.31 0.00 0.00 175.10 173.24 3d3u s GLN 123 N -3.70 2.13 0.10 4.82 0.74 -1.22 -0.72 119.66 121.81 3d3u s GLN 123 Ca 0.30 -2.14 0.01 0.00 0.05 0.00 0.00 55.36 53.57 3d3u s GLN 123 Cb 0.03 -3.57 0.02 0.00 1.10 0.00 0.00 33.01 30.59 3d3u s GLN 123 CO 0.12 -1.10 0.14 1.33 -0.55 0.00 0.00 175.29 175.23 3d3u n VAL 124 N 4.05 0.00 -3.14 1.34 0.24 -0.78 -4.83 118.33 115.20 3d3u n VAL 124 Ca 0.02 -0.28 -0.19 0.00 -2.04 0.00 0.00 64.34 61.86 3d3u n VAL 124 Cb 0.39 -1.08 0.03 0.00 -1.47 0.00 0.00 33.84 31.71 3d3u n VAL 124 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 3d3u s SER 125 N -1.58 5.30 0.23 -1.34 1.04 -0.62 -0.53 113.70 116.19 3d3u s SER 125 Ca 0.10 -0.69 -0.30 0.00 0.48 0.00 0.00 55.95 55.54 3d3u s SER 125 Cb -0.01 -0.19 -0.10 0.00 0.10 0.00 0.00 66.02 65.83 3d3u s SER 125 CO 0.06 -1.01 1.43 0.42 0.98 0.00 0.00 173.24 175.12 3d3u s THR 126 N -2.52 2.77 0.92 2.02 -4.23 -1.19 -4.35 115.64 109.05 3d3u s THR 126 Ca 0.56 0.63 -0.12 0.00 -1.18 0.00 0.00 61.69 61.58 3d3u s THR 126 Cb -0.07 -3.40 0.14 0.00 1.34 0.00 0.00 72.50 70.51 3d3u s THR 126 CO 0.34 0.09 1.09 -2.16 -0.54 0.00 0.00 174.62 173.45 3d3u s PRO 127 N -0.17 1.10 0.00 3.99 0.04 -1.26 -4.72 135.00 133.98 3d3u s PRO 127 Ca 0.60 0.85 0.00 0.00 0.04 0.00 0.00 61.00 62.49 3d3u s PRO 127 Cb -0.41 -1.79 0.00 0.00 0.04 0.00 0.00 34.50 32.34 3d3u s PRO 127 CO 0.41 -2.36 0.00 0.27 0.04 0.00 0.00 177.00 175.36 3d3u n ASN 128 N -3.97 1.17 0.30 6.66 0.23 -0.49 -4.84 115.26 114.32 3d3u n ASN 128 Ca 0.07 -0.76 0.20 0.00 -0.53 0.00 0.00 54.58 53.56 3d3u n ASN 128 Cb 0.55 0.00 0.95 0.00 -2.08 0.00 0.00 39.78 39.20 3d3u n ASN 128 CO 0.00 0.00 0.00 -0.08 -0.93 0.00 0.00 177.26 176.25 3d3u h GLU 129 N 0.00 0.00 -0.65 -3.83 4.81 -1.97 -0.72 114.58 112.23 3d3u h GLU 129 Ca 0.00 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 3d3u h GLU 129 Cb 0.00 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.38 3d3u h GLU 129 CO 0.00 0.00 0.00 0.39 -0.73 0.00 0.00 179.01 178.67 3d3u n GLU 130 N -3.03 3.14 -1.41 1.92 4.71 -1.26 -4.96 120.64 119.76 3d3u n GLU 130 Ca -0.01 -2.69 -0.02 0.00 -0.01 0.00 0.00 57.16 54.43 3d3u n GLU 130 Cb 0.18 -1.67 -0.01 0.00 -1.01 0.00 0.00 31.44 28.93 3d3u n GLU 130 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 3d3u n GLY 131 N 1.26 0.46 3.47 0.62 0.00 -0.28 -4.94 105.19 105.78 3d3u n GLY 131 Ca 0.23 -0.92 -0.36 0.00 0.00 0.00 0.00 46.02 44.98 3d3u n GLY 131 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3d3u s TYR 132 N -2.09 3.09 0.38 1.61 1.51 -1.26 -0.92 117.35 119.67 3d3u s TYR 132 Ca 0.00 -0.38 0.06 0.00 -1.01 0.00 0.00 57.07 55.74 3d3u s TYR 132 Cb 0.00 -2.18 -0.00 0.00 -0.11 0.00 0.00 41.96 39.67 3d3u s TYR 132 CO 0.00 -0.27 0.54 0.00 -1.11 0.00 0.00 175.55 174.71 3d3u s SER 134 N -4.24 3.54 0.00 0.00 0.15 -1.26 0.17 113.70 112.06 3d3u s SER 134 Ca 0.49 -0.55 0.17 0.00 0.70 0.00 0.00 55.95 56.75 3d3u s SER 134 Cb -0.10 -0.43 0.73 0.00 -1.71 0.00 0.00 66.02 64.51 3d3u s SER 134 CO 0.33 0.23 1.52 0.49 1.20 0.00 0.00 173.24 177.01 3d3u n PHE 135 N 1.38 0.00 0.00 3.44 3.01 0.42 -1.59 117.46 124.11 3d3u n PHE 135 Ca -0.17 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.29 3d3u n PHE 135 Cb 0.52 -0.46 0.00 0.00 -0.01 0.00 0.00 39.48 39.53 3d3u n PHE 135 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3d3u n GLY 136 N 0.20 3.81 0.29 1.37 0.00 -1.25 -3.29 105.19 106.32 3d3u n GLY 136 Ca 0.05 0.04 0.04 0.00 0.00 0.00 0.00 46.02 46.15 3d3u n GLY 136 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3d3u n VAL 137 N 0.00 0.20 -3.43 1.61 0.24 -1.26 -4.65 118.33 111.04 3d3u n VAL 137 Ca 0.00 -0.21 -0.17 0.00 -2.04 0.00 0.00 64.34 61.92 3d3u n VAL 137 Cb 0.00 0.09 -0.11 0.00 -1.47 0.00 0.00 33.84 32.36 3d3u n VAL 137 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 3d3u s SER 138 N -1.08 1.46 -0.19 -1.34 0.01 -1.21 -1.97 113.70 109.38 3d3u s SER 138 Ca 0.13 -0.46 -0.15 0.00 1.31 0.00 0.00 55.95 56.78 3d3u s SER 138 Cb 0.07 0.51 -0.08 0.00 0.21 0.00 0.00 66.02 66.73 3d3u s SER 138 CO 0.10 -0.36 -0.32 0.00 0.41 0.00 0.00 173.24 173.07 3d3u n ASP 140 N -4.28 0.00 -0.00 0.00 5.68 -0.97 -0.71 116.55 116.27 3d3u n ASP 140 Ca -0.27 0.00 0.07 0.00 -0.50 0.00 0.00 54.79 54.09 3d3u n ASP 140 Cb 0.62 0.00 -0.08 0.00 -1.14 0.00 0.00 41.12 40.52 3d3u n ASP 140 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3d3u n TYR 141 N 0.00 0.00 0.16 2.11 0.18 -1.26 -2.08 117.16 116.27 3d3u n TYR 141 Ca 0.00 0.00 0.01 0.00 1.88 0.00 0.00 57.90 59.79 3d3u n TYR 141 Cb 0.00 -0.03 0.27 0.00 -0.38 0.00 0.00 39.34 39.20 3d3u n TYR 141 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 3d3u h THR 142 N 0.00 1.35 0.10 -3.48 1.03 -1.55 -1.69 112.91 108.68 3d3u h THR 142 Ca 0.00 -1.69 -0.28 0.00 -0.01 0.00 0.00 66.41 64.43 3d3u h THR 142 Cb 0.36 1.91 -0.01 0.00 -1.07 0.00 0.00 68.15 69.34 3d3u h THR 142 CO 0.00 0.48 -1.36 0.50 -0.01 0.00 0.00 175.52 175.14 3d3u h LYS 143 N 0.00 0.22 -0.93 0.00 3.64 -1.13 -2.55 116.57 115.81 3d3u h LYS 143 Ca -0.00 -0.37 0.02 0.00 -1.27 0.00 0.00 60.65 59.02 3d3u h LYS 143 Cb 0.87 0.14 -0.05 0.00 -0.41 0.00 0.00 32.23 32.78 3d3u h LYS 143 CO 0.06 1.11 0.62 0.00 -2.27 0.00 0.00 179.45 178.98 3d3u h ALA 144 N 0.61 1.35 0.33 5.00 0.00 -1.79 -0.15 119.26 124.62 3d3u h ALA 144 Ca -0.17 -0.06 -0.02 0.00 0.00 0.00 0.00 54.91 54.66 3d3u h ALA 144 Cb 1.97 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 19.39 3d3u h ALA 144 CO 0.17 0.59 -0.16 0.00 0.00 0.00 0.00 179.25 179.86 3d3u h ALA 145 N 1.43 -0.44 -0.83 0.00 0.00 -1.29 -2.31 119.26 115.82 3d3u h ALA 145 Ca 0.35 -0.12 0.18 0.00 0.00 0.00 0.00 54.91 55.32 3d3u h ALA 145 Cb -0.11 0.17 -0.11 0.00 0.00 0.00 0.00 17.79 17.74 3d3u h ALA 145 CO -0.08 -0.72 0.34 0.00 0.00 0.00 0.00 179.25 178.79 3d3u h ALA 146 N 0.15 1.23 0.00 0.00 0.00 -1.05 0.30 119.26 119.90 3d3u h ALA 146 Ca -0.04 0.14 -0.00 0.00 0.00 0.00 0.00 54.91 55.00 3d3u h ALA 146 Cb 0.38 0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.28 3d3u h ALA 146 CO 0.07 -0.25 -0.01 0.93 0.00 0.00 0.00 179.25 179.99 3d3u h GLU 147 N 0.44 0.00 -0.01 0.00 5.08 -0.72 -3.22 114.58 116.15 3d3u h GLU 147 Ca 0.48 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.84 3d3u h GLU 147 Cb 0.81 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.06 3d3u h GLU 147 CO -0.46 0.01 -0.06 0.00 -1.00 0.00 0.00 179.01 177.50 3d3u s ALA 149 N -1.07 3.62 -0.78 0.00 0.00 -0.85 -4.84 121.76 117.83 3d3u s ALA 149 Ca 0.12 -0.78 0.11 0.00 0.00 0.00 0.00 51.96 51.41 3d3u s ALA 149 Cb 0.09 -2.34 0.51 0.00 0.00 0.00 0.00 23.12 21.38 3d3u s ALA 149 CO 0.18 -0.13 1.34 -0.35 0.00 0.00 0.00 175.76 176.80 3d3u n PRO 150 N 4.13 0.05 -3.88 0.00 -0.04 -1.21 -4.59 135.00 129.46 3d3u n PRO 150 Ca -0.14 0.45 -0.18 0.00 -0.04 0.00 0.00 63.50 63.59 3d3u n PRO 150 Cb 0.52 -1.63 -0.17 0.00 -0.04 0.00 0.00 33.50 32.18 3d3u n PRO 150 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 3d3u s VAL 151 N -3.14 0.17 -0.16 0.52 1.01 -1.08 -5.02 120.40 112.69 3d3u s VAL 151 Ca 0.02 0.13 0.01 0.00 0.00 0.00 0.00 61.98 62.14 3d3u s VAL 151 Cb 0.05 -0.29 0.03 0.00 0.00 0.00 0.00 36.38 36.16 3d3u s VAL 151 CO 0.16 0.16 -0.14 -0.69 0.00 0.00 0.00 175.10 174.59 3d3u s VAL 152 N 1.28 1.67 -0.36 2.92 1.01 -1.26 -1.37 120.40 124.28 3d3u s VAL 152 Ca -0.06 -0.75 -0.12 0.00 0.00 0.00 0.00 61.98 61.05 3d3u s VAL 152 Cb -0.13 -1.58 0.01 0.00 0.00 0.00 0.00 36.38 34.68 3d3u s VAL 152 CO -0.02 0.42 0.22 -0.69 0.00 0.00 0.00 175.10 175.03 3d3u s VAL 153 N 1.44 4.86 -0.14 2.92 1.01 -0.06 -1.78 120.40 128.65 3d3u s VAL 153 Ca 0.04 -0.61 -0.02 0.00 0.00 0.00 0.00 61.98 61.39 3d3u s VAL 153 Cb -0.13 -3.62 -0.02 0.00 0.00 0.00 0.00 36.38 32.60 3d3u s VAL 153 CO -0.11 -0.15 -0.09 0.00 0.00 0.00 0.00 175.10 174.75 3d3u s ALA 154 N 1.62 2.77 -0.23 5.51 0.00 -0.83 -1.54 121.76 129.06 3d3u s ALA 154 Ca 0.04 -0.86 -0.22 0.00 0.00 0.00 0.00 51.96 50.91 3d3u s ALA 154 Cb -0.18 -1.35 -0.02 0.00 0.00 0.00 0.00 23.12 21.57 3d3u s ALA 154 CO 0.08 0.23 0.72 -1.21 0.00 0.00 0.00 175.76 175.58 3d3u s GLU 155 N 0.36 4.18 -0.50 0.00 2.02 0.10 -2.11 118.70 122.74 3d3u s GLU 155 Ca -0.08 0.75 -0.25 0.00 0.02 0.00 0.00 54.97 55.41 3d3u s GLU 155 Cb -0.15 -3.62 0.03 0.00 0.10 0.00 0.00 34.13 30.49 3d3u s GLU 155 CO 0.05 -0.40 0.92 0.08 0.02 0.00 0.00 175.26 175.93 3d3u s VAL 156 N 2.44 4.44 -0.26 2.63 1.01 -0.64 -1.87 120.40 128.16 3d3u s VAL 156 Ca 0.31 0.51 -0.07 0.00 0.00 0.00 0.00 61.98 62.73 3d3u s VAL 156 Cb -0.16 -4.48 -0.02 0.00 0.00 0.00 0.00 36.38 31.73 3d3u s VAL 156 CO 0.09 -0.96 0.06 0.21 0.00 0.00 0.00 175.10 174.50 3d3u s ASN 157 N 2.52 5.03 0.60 3.32 3.84 0.31 -0.02 114.94 130.53 3d3u s ASN 157 Ca 0.34 -0.35 0.33 0.00 0.21 0.00 0.00 52.86 53.39 3d3u s ASN 157 Cb -0.11 -1.89 1.91 0.00 -0.55 0.00 0.00 41.25 40.61 3d3u s ASN 157 CO 0.23 -0.07 2.25 0.11 -2.79 0.00 0.00 177.10 176.83 3d3u h LYS 158 N 8.22 0.00 0.00 0.43 1.57 -1.55 -2.05 116.57 123.19 3d3u h LYS 158 Ca -0.37 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.37 3d3u h LYS 158 Cb 1.16 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.46 3d3u h LYS 158 CO 0.59 0.02 -1.07 0.37 -0.57 0.00 0.00 179.45 178.79 3d3u h GLN 159 N 0.00 0.00 -6.40 3.15 5.75 -1.82 -3.46 115.11 112.33 3d3u h GLN 159 Ca -0.00 0.00 -0.54 0.00 -0.15 0.00 0.00 58.65 57.96 3d3u h GLN 159 Cb 0.07 0.00 0.02 0.00 1.07 0.00 0.00 27.48 28.63 3d3u h GLN 159 CO 0.00 0.07 1.04 1.41 -2.65 0.00 0.00 178.83 178.71 3d3u s MET 160 N -3.25 4.19 0.81 1.69 1.75 -0.78 -4.79 119.30 118.92 3d3u s MET 160 Ca -0.01 2.33 -0.12 0.00 -1.25 0.00 0.00 55.69 56.64 3d3u s MET 160 Cb 0.09 -3.73 0.08 0.00 2.84 0.00 0.00 34.83 34.12 3d3u s MET 160 CO 0.79 -0.78 1.15 -1.25 -0.65 0.00 0.00 175.02 174.29 3d3u s PRO 161 N 3.09 1.74 -0.24 4.11 0.04 -1.26 -4.48 135.00 138.00 3d3u s PRO 161 Ca 0.75 1.53 -0.06 0.00 0.04 0.00 0.00 61.00 63.27 3d3u s PRO 161 Cb -0.39 -1.81 -0.02 0.00 0.04 0.00 0.00 34.50 32.32 3d3u s PRO 161 CO 0.33 -2.09 0.03 0.12 0.04 0.00 0.00 177.00 175.42 3d3u s PHE 162 N -2.46 3.04 0.04 0.56 2.19 -1.26 -3.92 117.98 116.16 3d3u s PHE 162 Ca 0.68 -0.60 0.03 0.00 0.33 0.00 0.00 56.93 57.37 3d3u s PHE 162 Cb -0.24 -2.19 -0.02 0.00 -1.31 0.00 0.00 43.02 39.26 3d3u s PHE 162 CO 0.52 -0.42 -0.09 0.42 1.83 0.00 0.00 175.22 177.48 3d3u s ILE 163 N 1.56 0.68 0.00 3.12 1.01 -1.26 0.66 121.20 126.97 3d3u s ILE 163 Ca 0.06 -0.92 0.00 0.00 0.00 0.00 0.00 60.65 59.79 3d3u s ILE 163 Cb -0.15 -0.68 0.00 0.00 0.01 0.00 0.00 42.46 41.64 3d3u s ILE 163 CO 0.01 -0.20 0.00 0.61 0.00 0.00 0.00 174.94 175.36 3d3u n GLY 164 N 1.81 3.15 7.00 6.18 0.00 -1.26 -4.57 105.19 117.51 3d3u n GLY 164 Ca -0.20 -1.86 0.00 0.00 0.00 0.00 0.00 46.02 43.96 3d3u n GLY 164 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d3u n GLY 165 N 5.00 -0.87 2.42 -0.02 0.00 -1.26 -0.38 105.19 110.08 3d3u n GLY 165 Ca 0.00 -1.18 -0.38 0.00 0.00 0.00 0.00 46.02 44.46 3d3u n GLY 165 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3d3u n GLU 166 N 0.00 4.14 -0.72 1.61 1.02 -0.70 -4.44 120.64 121.55 3d3u n GLU 166 Ca 0.00 -2.99 0.06 0.00 -0.02 0.00 0.00 57.16 54.21 3d3u n GLU 166 Cb 0.00 -2.62 0.16 0.00 -0.02 0.00 0.00 31.44 28.97 3d3u n GLU 166 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 3d3u n ASN 167 N 2.14 1.59 -4.58 1.62 5.15 -1.26 -4.65 115.26 115.27 3d3u n ASN 167 Ca 0.65 -3.44 -0.24 0.00 -0.60 0.00 0.00 54.58 50.95 3d3u n ASN 167 Cb 0.29 -0.47 -0.08 0.00 -0.53 0.00 0.00 39.78 38.98 3d3u n ASN 167 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 3d3u s LEU 168 N -2.53 2.99 -0.13 1.20 1.02 -1.26 -0.44 118.68 119.53 3d3u s LEU 168 Ca 0.36 -0.74 -0.06 0.00 0.02 0.00 0.00 54.13 53.71 3d3u s LEU 168 Cb 0.36 -1.54 0.05 0.00 0.02 0.00 0.00 46.19 45.08 3d3u s LEU 168 CO -0.08 0.03 0.30 -0.51 0.02 0.00 0.00 176.35 176.11 3d3u s ILE 169 N -2.26 -0.06 0.52 -0.59 -1.16 0.46 -4.88 121.20 113.23 3d3u s ILE 169 Ca 0.30 0.14 -0.18 0.00 -0.51 0.00 0.00 60.65 60.39 3d3u s ILE 169 Cb -0.06 -0.45 -0.07 0.00 0.61 0.00 0.00 42.46 42.48 3d3u s ILE 169 CO 0.18 0.06 1.02 -2.28 -2.81 0.00 0.00 174.94 171.10 3d3u s HIS 170 N 1.36 3.13 0.41 3.50 5.65 -1.26 -0.86 115.29 127.22 3d3u s HIS 170 Ca -0.09 1.54 0.10 0.00 0.25 0.00 0.00 55.06 56.86 3d3u s HIS 170 Cb -0.10 -2.97 0.93 0.00 -1.18 0.00 0.00 32.58 29.26 3d3u s HIS 170 CO -0.10 -0.73 2.00 0.97 -0.65 0.00 0.00 174.74 176.24 3d3u h ILE 171 N 1.15 0.98 0.00 0.89 6.09 -1.39 -1.40 117.51 123.83 3d3u h ILE 171 Ca -0.48 -0.18 0.00 0.00 -1.37 0.00 0.00 64.86 62.83 3d3u h ILE 171 Cb 1.21 0.42 0.00 0.00 0.47 0.00 0.00 36.82 38.92 3d3u h ILE 171 CO 0.59 0.09 0.00 -1.54 -3.07 0.00 0.00 178.15 174.23 3d3u n SER 172 N -4.47 0.37 -0.59 2.19 3.41 -1.26 -2.42 113.62 110.85 3d3u n SER 172 Ca 0.08 0.60 0.13 0.00 -0.26 0.00 0.00 58.87 59.42 3d3u n SER 172 Cb 0.25 -0.68 0.42 0.00 -0.26 0.00 0.00 64.21 63.94 3d3u n SER 172 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3d3u n LYS 173 N -1.92 1.81 -3.45 4.33 4.76 -0.53 -4.82 118.16 118.33 3d3u n LYS 173 Ca 0.02 -1.19 -0.38 0.00 -2.87 0.00 0.00 58.31 53.90 3d3u n LYS 173 Cb 0.19 -1.48 -0.08 0.00 -1.84 0.00 0.00 35.03 31.82 3d3u n LYS 173 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 3d3u s LEU 174 N -2.01 4.16 -0.10 -0.35 1.02 -1.02 -4.49 118.68 115.89 3d3u s LEU 174 Ca 0.35 0.45 -0.19 0.00 0.02 0.00 0.00 54.13 54.76 3d3u s LEU 174 Cb 0.21 -2.43 -0.28 0.00 0.02 0.00 0.00 46.19 43.72 3d3u s LEU 174 CO 0.33 -0.03 0.64 0.74 0.02 0.00 0.00 176.35 178.05 3d3u h THR 175 N 4.98 1.22 -3.76 5.49 2.02 -1.67 -3.47 112.91 117.73 3d3u h THR 175 Ca -0.37 -2.41 -0.43 0.00 0.77 0.00 0.00 66.41 63.96 3d3u h THR 175 Cb 1.16 2.87 -0.31 0.00 -1.74 0.00 0.00 68.15 70.13 3d3u h THR 175 CO 0.71 0.67 -0.79 -1.00 0.37 0.00 0.00 175.52 175.48 3d3u s HIS 176 N -2.43 0.97 -0.08 3.16 3.76 -1.21 -4.84 115.29 114.62 3d3u s HIS 176 Ca -0.19 -0.25 0.05 0.00 -0.15 0.00 0.00 55.06 54.52 3d3u s HIS 176 Cb 0.03 -0.70 -0.01 0.00 1.11 0.00 0.00 32.58 33.01 3d3u s HIS 176 CO 0.76 -0.12 -0.24 0.42 -0.85 0.00 0.00 174.74 174.71 3d3u s ILE 177 N 0.28 2.03 -0.58 0.60 1.01 0.06 -1.98 121.20 122.62 3d3u s ILE 177 Ca -0.05 -1.03 0.02 0.00 0.00 0.00 0.00 60.65 59.60 3d3u s ILE 177 Cb -0.09 -1.73 0.15 0.00 0.01 0.00 0.00 42.46 40.79 3d3u s ILE 177 CO 0.01 0.56 0.35 -0.63 0.00 0.00 0.00 174.94 175.23 3d3u s ILE 178 N 0.09 3.01 0.06 2.92 1.01 -0.90 -1.38 121.20 126.01 3d3u s ILE 178 Ca -0.11 -3.32 -0.30 0.00 0.00 0.00 0.00 60.65 56.92 3d3u s ILE 178 Cb -0.16 -3.03 -0.09 0.00 0.01 0.00 0.00 42.46 39.20 3d3u s ILE 178 CO 0.06 -0.85 1.83 -1.83 0.00 0.00 0.00 174.94 174.15 3d3u s GLU 179 N -0.36 4.16 0.32 2.79 -1.05 -1.26 -1.61 118.70 121.68 3d3u s GLU 179 Ca 0.18 2.50 0.05 0.00 -0.15 0.00 0.00 54.97 57.55 3d3u s GLU 179 Cb -0.22 -3.87 -0.03 0.00 -0.44 0.00 0.00 34.13 29.57 3d3u s GLU 179 CO -0.03 -0.87 0.21 0.14 0.95 0.00 0.00 175.26 175.67 3d3u s VAL 180 N 3.58 0.16 -0.11 1.83 -7.23 0.97 -4.88 120.40 114.72 3d3u s VAL 180 Ca 0.82 -2.00 -0.04 0.00 -1.81 0.00 0.00 61.98 58.95 3d3u s VAL 180 Cb -0.42 -2.47 0.06 0.00 0.56 0.00 0.00 36.38 34.11 3d3u s VAL 180 CO 0.37 0.00 0.21 -0.62 -0.31 0.00 0.00 175.10 174.75 3d3u s ASP 181 N -3.39 0.59 0.00 4.85 -1.08 -1.26 -1.42 116.67 114.96 3d3u s ASP 181 Ca 0.37 0.43 0.00 0.00 -0.52 0.00 0.00 52.55 52.83 3d3u s ASP 181 Cb 0.03 0.49 0.00 0.00 -1.46 0.00 0.00 42.92 41.98 3d3u s ASP 181 CO 0.22 -0.25 0.00 -0.62 0.52 0.00 0.00 175.17 175.04 3d3u n GLU 182 N 5.34 0.00 -2.22 4.34 1.02 -1.26 -5.03 120.64 122.83 3d3u n GLU 182 Ca -0.05 0.00 -0.40 0.00 -0.02 0.00 0.00 57.16 56.68 3d3u n GLU 182 Cb 0.50 0.00 -0.03 0.00 -0.02 0.00 0.00 31.44 31.89 3d3u n GLU 182 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 3d3u s PRO 183 N -0.02 4.37 -0.20 3.49 0.04 -1.26 -4.56 135.00 136.87 3d3u s PRO 183 Ca 0.00 2.07 -0.29 0.00 0.04 0.00 0.00 61.00 62.82 3d3u s PRO 183 Cb 0.00 -3.04 -0.02 0.00 0.04 0.00 0.00 34.50 31.48 3d3u s PRO 183 CO 0.00 -0.12 1.43 0.42 0.04 0.00 0.00 177.00 178.77 3d3u s ILE 184 N -1.18 3.97 0.13 0.56 -1.09 -1.26 -4.86 121.20 117.46 3d3u s ILE 184 Ca 0.49 1.14 -0.17 0.00 -2.23 0.00 0.00 60.65 59.88 3d3u s ILE 184 Cb -0.37 -3.87 -0.10 0.00 -1.58 0.00 0.00 42.46 36.54 3d3u s ILE 184 CO 0.48 -0.25 0.29 0.00 -1.23 0.00 0.00 174.94 174.23 3d3u n ALA 185 N 7.46 -2.14 -2.41 9.38 0.00 -1.26 -4.91 120.51 126.63 3d3u n ALA 185 Ca 0.16 0.25 -0.30 0.00 0.00 0.00 0.00 53.44 53.55 3d3u n ALA 185 Cb 0.45 -0.96 -0.13 0.00 0.00 0.00 0.00 19.45 18.80 3d3u n ALA 185 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 3d3u s GLU 186 N -0.60 1.91 -0.19 0.00 -1.05 -1.26 -4.70 118.70 112.80 3d3u s GLU 186 Ca 0.38 -1.07 -0.00 0.00 -0.15 0.00 0.00 54.97 54.13 3d3u s GLU 186 Cb -0.55 -2.08 0.05 0.00 -0.44 0.00 0.00 34.13 31.11 3d3u s GLU 186 CO 0.34 0.52 -0.04 0.14 0.95 0.00 0.00 175.26 177.17 3d3u s VAL 187 N -0.89 1.20 0.07 1.83 -7.23 -0.14 -4.90 120.40 110.34 3d3u s VAL 187 Ca 0.13 -0.84 -0.22 0.00 -1.81 0.00 0.00 61.98 59.24 3d3u s VAL 187 Cb -0.10 -1.45 -0.06 0.00 0.56 0.00 0.00 36.38 35.32 3d3u s VAL 187 CO 0.04 0.01 0.65 -1.48 -0.31 0.00 0.00 175.10 174.01 3d3u s LEU 188 N 1.57 4.50 0.00 1.32 2.34 -1.26 -4.04 118.68 123.11 3d3u s LEU 188 Ca -0.02 1.35 0.00 0.00 0.06 0.00 0.00 54.13 55.52 3d3u s LEU 188 Cb -0.17 -3.04 0.00 0.00 -0.56 0.00 0.00 46.19 42.42 3d3u s LEU 188 CO -0.07 0.18 0.00 -0.81 -1.06 0.00 0.00 176.35 174.59 3d3u n PRO 189 N 2.11 1.37 0.00 1.48 -0.04 -1.26 -5.06 135.00 133.60 3d3u n PRO 189 Ca -0.07 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.39 3d3u n PRO 189 Cb 0.50 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.96 3d3u n PRO 189 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3d3u n GLY 192 N 5.00 0.33 0.00 0.55 0.00 -1.26 -5.01 105.19 104.80 3d3u n GLY 192 Ca 0.00 -0.45 0.00 0.00 0.00 0.00 0.00 46.02 45.57 3d3u n GLY 192 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3d3u n SER 193 N 0.00 0.00 0.00 1.61 3.41 -1.26 -4.74 113.62 112.64 3d3u n SER 193 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.61 3d3u n SER 193 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 3d3u n SER 193 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 3d3u n ASP 194 N 0.00 0.00 -0.29 4.04 3.85 -1.26 -1.36 116.55 121.53 3d3u n ASP 194 Ca 0.00 0.00 -0.06 0.00 -0.71 0.00 0.00 54.79 54.02 3d3u n ASP 194 Cb 0.00 0.00 -0.01 0.00 -1.35 0.00 0.00 41.12 39.76 3d3u n ASP 194 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.20 176.12 3d3u h LEU 195 N 0.00 -1.49 -0.79 -2.12 4.07 -2.01 -1.57 115.31 111.41 3d3u h LEU 195 Ca 0.00 0.27 0.14 0.00 0.08 0.00 0.00 57.88 58.37 3d3u h LEU 195 Cb 0.00 0.72 -0.09 0.00 1.08 0.00 0.00 40.66 42.37 3d3u h LEU 195 CO 0.00 -0.30 0.36 -0.33 -1.08 0.00 0.00 178.44 177.09 3d3u h GLU 196 N -0.11 0.52 -0.28 1.13 5.08 -1.91 0.45 114.58 119.45 3d3u h GLU 196 Ca 0.24 -0.03 0.04 0.00 -1.00 0.00 0.00 59.36 58.62 3d3u h GLU 196 Cb 0.56 -0.12 -0.04 0.00 0.50 0.00 0.00 28.75 29.65 3d3u h GLU 196 CO -0.82 0.34 0.04 -0.07 -1.00 0.00 0.00 179.01 177.50 3d3u h LEU 197 N 0.53 -0.03 -1.35 1.33 4.07 -0.17 -0.25 115.31 119.45 3d3u h LEU 197 Ca 0.43 0.05 0.04 0.00 0.08 0.00 0.00 57.88 58.48 3d3u h LEU 197 Cb 0.62 0.08 -0.04 0.00 1.08 0.00 0.00 40.66 42.40 3d3u h LEU 197 CO -0.38 0.02 0.47 0.03 -1.08 0.00 0.00 178.44 177.50 3d3u h ARG 198 N 0.13 0.81 0.69 1.13 3.08 -0.82 0.71 114.38 120.12 3d3u h ARG 198 Ca 0.13 -0.05 -0.03 0.00 0.07 0.00 0.00 59.98 60.11 3d3u h ARG 198 Cb 0.15 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.01 3d3u h ARG 198 CO -0.19 0.54 -0.49 0.82 -1.07 0.00 0.00 179.97 179.57 3d3u h ILE 199 N 0.84 0.03 -0.85 2.04 2.04 -0.55 -0.25 117.51 120.80 3d3u h ILE 199 Ca 0.29 0.00 0.20 0.00 1.00 0.00 0.00 64.86 66.36 3d3u h ILE 199 Cb 0.11 0.03 -0.16 0.00 -0.74 0.00 0.00 36.82 36.06 3d3u h ILE 199 CO -0.09 0.00 -0.09 0.61 0.00 0.00 0.00 178.15 178.58 3d3u n GLY 200 N -1.60 -1.28 0.20 5.37 0.00 -0.28 -1.10 105.19 106.50 3d3u n GLY 200 Ca -0.14 0.87 -0.11 0.00 0.00 0.00 0.00 46.02 46.64 3d3u n GLY 200 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 3d3u h GLN 201 N 0.00 0.63 0.00 1.61 5.75 0.75 -2.54 115.11 121.31 3d3u h GLN 201 Ca 0.46 -0.23 -0.01 0.00 -0.15 0.00 0.00 58.65 58.72 3d3u h GLN 201 Cb 0.84 -0.04 -0.00 0.00 1.07 0.00 0.00 27.48 29.35 3d3u h GLN 201 CO -0.83 0.80 -0.03 -0.91 -2.65 0.00 0.00 178.83 175.20 3d3u h ASN 202 N 0.41 0.00 -0.43 -0.69 4.21 0.38 -3.00 115.58 116.46 3d3u h ASN 202 Ca 0.09 0.00 -0.14 0.00 1.21 0.00 0.00 56.30 57.46 3d3u h ASN 202 Cb 0.55 0.00 -0.01 0.00 -1.12 0.00 0.00 38.32 37.74 3d3u h ASN 202 CO 0.03 0.03 -0.26 0.00 -1.29 0.00 0.00 177.43 175.94 3d3u h ALA 204 N 0.82 1.75 0.00 0.00 0.00 -1.39 0.32 119.26 120.76 3d3u h ALA 204 Ca 0.09 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.99 3d3u h ALA 204 Cb 0.85 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.65 3d3u h ALA 204 CO 0.07 -0.33 0.00 -1.13 0.00 0.00 0.00 179.25 177.87 3d3u n SER 205 N -3.66 0.00 -0.00 0.00 3.41 -1.15 -2.43 113.62 109.80 3d3u n SER 205 Ca 0.02 -0.48 0.06 0.00 -0.26 0.00 0.00 58.87 58.21 3d3u n SER 205 Cb 0.35 -0.06 -0.08 0.00 -0.26 0.00 0.00 64.21 64.17 3d3u n SER 205 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3d3u n LEU 206 N -1.06 0.37 -4.68 1.04 4.77 0.11 -4.99 117.00 112.57 3d3u n LEU 206 Ca 0.13 -0.33 -0.35 0.00 -0.03 0.00 0.00 56.01 55.43 3d3u n LEU 206 Cb 0.08 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.08 3d3u n LEU 206 CO 0.12 0.09 -0.27 -0.63 -1.33 0.00 0.00 177.39 175.37 3d3u s ILE 207 N -2.37 4.62 0.00 -0.08 1.01 -1.02 -5.07 121.20 118.30 3d3u s ILE 207 Ca 0.01 -0.11 0.01 0.00 0.00 0.00 0.00 60.65 60.56 3d3u s ILE 207 Cb 0.09 -3.02 -0.04 0.00 0.01 0.00 0.00 42.46 39.50 3d3u s ILE 207 CO 0.50 0.55 0.04 -0.54 0.00 0.00 0.00 174.94 175.48 3d3u s LYS 208 N -0.33 2.92 0.11 2.79 1.02 -1.26 -4.93 119.74 120.06 3d3u s LYS 208 Ca 0.08 -0.56 -0.35 0.00 0.02 0.00 0.00 55.97 55.16 3d3u s LYS 208 Cb -0.12 -2.76 -0.17 0.00 -0.52 0.00 0.00 37.83 34.26 3d3u s LYS 208 CO 0.02 0.63 1.22 -0.25 -0.92 0.00 0.00 175.35 176.05 3d3u n ASP 209 N 1.22 1.25 0.00 2.83 9.92 -1.26 -2.86 116.55 127.65 3d3u n ASP 209 Ca -0.13 1.13 0.00 0.00 -0.53 0.00 0.00 54.79 55.26 3d3u n ASP 209 Cb 0.53 -1.16 0.00 0.00 -0.64 0.00 0.00 41.12 39.85 3d3u n ASP 209 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 3d3u n GLY 210 N 2.20 1.00 3.85 0.44 0.00 -1.03 -4.99 105.19 106.65 3d3u n GLY 210 Ca 0.17 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.82 3d3u n GLY 210 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 3d3u s ASP 211 N -2.08 6.44 -0.43 1.61 -0.00 -1.13 -4.69 116.67 116.39 3d3u s ASP 211 Ca 0.00 0.53 -0.14 0.00 -0.00 0.00 0.00 52.55 52.93 3d3u s ASP 211 Cb 0.00 -2.11 0.05 0.00 -0.00 0.00 0.00 42.92 40.86 3d3u s ASP 211 CO 0.00 0.36 0.33 0.42 -0.00 0.00 0.00 175.17 176.28 3d3u s THR 212 N -0.82 5.12 0.54 -1.27 -4.23 -0.50 -1.96 115.64 112.52 3d3u s THR 212 Ca 0.16 -0.90 -0.16 0.00 -1.18 0.00 0.00 61.69 59.60 3d3u s THR 212 Cb -0.13 -3.96 -0.07 0.00 1.34 0.00 0.00 72.50 69.68 3d3u s THR 212 CO 0.05 -0.43 1.01 -0.76 -0.54 0.00 0.00 174.62 173.94 3d3u s LEU 213 N 1.64 3.59 -0.17 4.79 1.43 -0.55 -2.70 118.68 126.71 3d3u s LEU 213 Ca 0.04 1.65 0.00 0.00 -1.03 0.00 0.00 54.13 54.79 3d3u s LEU 213 Cb -0.22 -4.52 0.04 0.00 0.03 0.00 0.00 46.19 41.52 3d3u s LEU 213 CO 0.08 -0.76 -0.09 -1.58 0.23 0.00 0.00 176.35 174.23 3d3u s GLN 214 N -4.05 1.80 0.21 1.70 -0.44 -0.46 -1.92 119.66 116.50 3d3u s GLN 214 Ca 0.60 -0.59 0.05 0.00 -2.50 0.00 0.00 55.36 52.92 3d3u s GLN 214 Cb -0.12 -2.10 -0.05 0.00 -1.64 0.00 0.00 33.01 29.10 3d3u s GLN 214 CO 0.33 -0.37 -0.07 -0.48 0.50 0.00 0.00 175.29 175.19 3d3u s LEU 215 N 1.54 2.42 0.00 3.68 2.34 -1.26 0.18 118.68 127.58 3d3u s LEU 215 Ca 0.01 -1.11 0.00 0.00 0.06 0.00 0.00 54.13 53.09 3d3u s LEU 215 Cb -0.15 -0.45 0.00 0.00 -0.56 0.00 0.00 46.19 45.03 3d3u s LEU 215 CO -0.09 -0.35 0.00 0.61 -1.06 0.00 0.00 176.35 175.46 3d3u n GLY 216 N -0.38 -0.14 2.96 -3.48 0.00 -1.21 -4.58 105.19 98.35 3d3u n GLY 216 Ca -0.07 -1.39 -0.22 0.00 0.00 0.00 0.00 46.02 44.34 3d3u n GLY 216 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3d3u s ILE 217 N 0.00 0.80 0.00 -0.61 -0.00 -1.26 -4.78 121.20 115.35 3d3u s ILE 217 Ca 0.00 -0.30 0.00 0.00 -0.00 0.00 0.00 60.65 60.35 3d3u s ILE 217 Cb 0.00 -0.76 0.00 0.00 -0.00 0.00 0.00 42.46 41.70 3d3u s ILE 217 CO 0.00 0.27 0.00 0.61 -0.00 0.00 0.00 174.94 175.82 3d3u n GLY 218 N 3.81 4.21 0.04 6.27 0.00 -1.26 -4.87 105.19 113.38 3d3u n GLY 218 Ca -0.23 -1.48 -0.01 0.00 0.00 0.00 0.00 46.02 44.29 3d3u n GLY 218 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d3u n GLY 219 N -1.94 -0.49 0.48 -0.02 0.00 -1.26 -1.66 105.19 100.31 3d3u n GLY 219 Ca 0.00 0.17 -0.17 0.00 0.00 0.00 0.00 46.02 46.01 3d3u n GLY 219 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3d3u h ILE 220 N 0.00 0.04 -0.70 -0.61 5.03 -1.91 0.45 117.51 119.80 3d3u h ILE 220 Ca 0.02 0.00 0.15 0.00 -0.12 0.00 0.00 64.86 64.91 3d3u h ILE 220 Cb 0.04 0.04 -0.12 0.00 -3.03 0.00 0.00 36.82 33.75 3d3u h ILE 220 CO -0.10 0.00 -0.02 -0.65 -0.68 0.00 0.00 178.15 176.70 3d3u h PRO 221 N -0.89 0.09 0.00 2.37 0.11 -1.72 0.38 132.00 132.34 3d3u h PRO 221 Ca -0.04 -0.01 -0.06 0.00 0.11 0.00 0.00 66.00 66.01 3d3u h PRO 221 Cb 0.82 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 31.90 3d3u h PRO 221 CO -0.14 0.06 -0.30 0.22 -0.21 0.00 0.00 178.00 177.63 3d3u h ASP 222 N 0.09 0.00 -0.38 -2.05 3.58 -0.96 -1.15 116.42 115.55 3d3u h ASP 222 Ca 0.37 0.00 -0.14 0.00 0.42 0.00 0.00 57.03 57.68 3d3u h ASP 222 Cb 0.63 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 41.67 3d3u h ASP 222 CO -0.62 0.30 -0.30 0.00 -2.88 0.00 0.00 179.24 175.73 3d3u h ALA 223 N 1.70 0.55 -0.23 -0.78 0.00 0.24 -2.30 119.26 118.45 3d3u h ALA 223 Ca -0.00 -0.42 -0.04 0.00 0.00 0.00 0.00 54.91 54.45 3d3u h ALA 223 Cb 0.74 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.40 3d3u h ALA 223 CO 0.04 0.59 -0.02 0.28 0.00 0.00 0.00 179.25 180.15 3d3u h VAL 224 N 0.69 1.26 -0.29 0.00 2.07 0.61 0.55 116.25 121.14 3d3u h VAL 224 Ca 0.07 -0.94 -0.08 0.00 0.82 0.00 0.00 66.70 66.58 3d3u h VAL 224 Cb 0.89 1.42 -0.02 0.00 -1.52 0.00 0.00 31.29 32.07 3d3u h VAL 224 CO 0.08 0.29 -0.14 -0.07 0.02 0.00 0.00 177.57 177.75 3d3u h LEU 225 N 0.17 0.49 -0.25 2.57 4.07 -1.30 -2.12 115.31 118.95 3d3u h LEU 225 Ca 0.06 -0.13 0.04 0.00 0.08 0.00 0.00 57.88 57.93 3d3u h LEU 225 Cb 0.44 -0.13 -0.04 0.00 1.08 0.00 0.00 40.66 42.01 3d3u h LEU 225 CO 0.01 0.66 -0.01 0.03 -1.08 0.00 0.00 178.44 178.06 3d3u h ARG 226 N 0.46 0.07 0.00 1.13 2.47 -0.69 -1.94 114.38 115.88 3d3u h ARG 226 Ca 0.08 -0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.80 3d3u h ARG 226 Cb 0.52 -0.02 0.00 0.00 -1.65 0.00 0.00 29.97 28.83 3d3u h ARG 226 CO 0.03 0.04 0.00 0.00 0.56 0.00 0.00 179.97 180.61 3d3u n ALA 227 N -2.39 1.03 -0.52 0.04 0.00 0.09 -2.82 120.51 115.93 3d3u n ALA 227 Ca -0.01 0.14 0.08 0.00 0.00 0.00 0.00 53.44 53.65 3d3u n ALA 227 Cb 0.13 -1.22 0.27 0.00 0.00 0.00 0.00 19.45 18.63 3d3u n ALA 227 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3d3u n LEU 228 N -2.03 3.91 0.28 0.00 4.77 -0.73 -4.48 117.00 118.72 3d3u n LEU 228 Ca -0.01 -2.37 0.19 0.00 -0.03 0.00 0.00 56.01 53.79 3d3u n LEU 228 Cb 0.02 -0.45 0.86 0.00 -2.33 0.00 0.00 43.42 41.53 3d3u n LEU 228 CO 0.07 0.78 1.04 -0.33 -1.33 0.00 0.00 177.39 177.62 3d3u h GLU 229 N 2.97 0.00 -0.66 3.23 5.08 -1.60 -0.38 114.58 123.21 3d3u h GLU 229 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 3d3u h GLU 229 Cb 1.17 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.42 3d3u h GLU 229 CO 0.13 0.00 0.00 0.41 -1.00 0.00 0.00 179.01 178.55 3d3u n GLY 230 N -0.47 1.75 3.96 -3.84 0.00 -1.26 -4.95 105.19 100.38 3d3u n GLY 230 Ca -0.01 -0.43 -0.20 0.00 0.00 0.00 0.00 46.02 45.39 3d3u n GLY 230 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3d3u s HIS 231 N -1.75 3.16 0.16 1.61 3.76 -0.15 -5.05 115.29 117.03 3d3u s HIS 231 Ca 0.26 -0.18 0.07 0.00 -0.15 0.00 0.00 55.06 55.06 3d3u s HIS 231 Cb 0.18 -1.84 -0.04 0.00 1.11 0.00 0.00 32.58 31.98 3d3u s HIS 231 CO 0.10 0.14 -0.15 0.15 -0.85 0.00 0.00 174.74 174.13 3d3u s LYS 232 N -4.09 1.21 -1.63 1.40 -0.14 -1.26 -4.78 119.74 110.45 3d3u s LYS 232 Ca 0.41 -1.42 -0.18 0.00 -1.36 0.00 0.00 55.97 53.42 3d3u s LYS 232 Cb -0.09 -1.11 0.17 0.00 -1.68 0.00 0.00 37.83 35.12 3d3u s LYS 232 CO 0.30 0.21 0.67 -0.25 -0.76 0.00 0.00 175.35 175.52 3d3u n ASP 233 N 0.12 -2.88 -4.88 2.83 8.00 -1.24 -2.48 116.55 116.02 3d3u n ASP 233 Ca -0.12 -0.94 -0.30 0.00 0.71 0.00 0.00 54.79 54.14 3d3u n ASP 233 Cb 0.58 -2.40 0.04 0.00 -0.02 0.00 0.00 41.12 39.32 3d3u n ASP 233 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3d3u s LEU 234 N -7.08 2.99 0.32 0.64 1.43 -0.63 -3.72 118.68 112.64 3d3u s LEU 234 Ca 0.70 1.18 0.03 0.00 -1.03 0.00 0.00 54.13 55.02 3d3u s LEU 234 Cb -0.39 -4.03 -0.06 0.00 0.03 0.00 0.00 46.19 41.73 3d3u s LEU 234 CO 0.87 -1.22 0.07 -0.83 0.23 0.00 0.00 176.35 175.46 3d3u s GLY 235 N -4.32 2.07 -0.01 -3.19 0.00 -0.83 0.42 107.32 101.46 3d3u s GLY 235 Ca 0.57 -1.99 0.04 0.00 0.00 0.00 0.00 44.72 43.34 3d3u s GLY 235 CO 0.52 -1.80 -0.13 -0.42 0.00 0.00 0.00 173.10 171.27 3d3u s ILE 236 N -3.34 1.06 -0.48 0.90 -1.09 -1.26 -1.48 121.20 115.51 3d3u s ILE 236 Ca 0.36 -0.58 0.06 0.00 -2.23 0.00 0.00 60.65 58.26 3d3u s ILE 236 Cb 0.08 -0.89 0.18 0.00 -1.58 0.00 0.00 42.46 40.26 3d3u s ILE 236 CO 0.15 0.30 0.59 1.57 -1.23 0.00 0.00 174.94 176.32 3d3u n HIS 237 N 2.76 -2.77 -4.19 3.97 -0.00 -0.81 -2.80 115.22 111.38 3d3u n HIS 237 Ca -0.14 -2.08 -0.23 0.00 0.46 0.00 0.00 57.72 55.73 3d3u n HIS 237 Cb 0.55 1.04 -0.07 0.00 -0.12 0.00 0.00 29.99 31.39 3d3u n HIS 237 CO 0.00 0.00 0.00 0.95 0.46 0.00 0.00 176.34 177.75 3d3u s THR 238 N 0.57 3.21 -0.02 3.57 -4.23 -0.92 -4.45 115.64 113.37 3d3u s THR 238 Ca 0.31 -1.78 0.29 0.00 -1.18 0.00 0.00 61.69 59.33 3d3u s THR 238 Cb 0.02 -2.94 0.34 0.00 1.34 0.00 0.00 72.50 71.25 3d3u s THR 238 CO -0.11 -0.26 1.85 1.05 -0.54 0.00 0.00 174.62 176.61 3d3u h GLU 239 N 1.68 0.00 -3.28 3.99 4.11 -1.88 -3.33 114.58 115.87 3d3u h GLU 239 Ca -0.44 0.00 -0.03 0.00 0.07 0.00 0.00 59.36 58.96 3d3u h GLU 239 Cb 1.25 0.00 -0.12 0.00 0.50 0.00 0.00 28.75 30.38 3d3u h GLU 239 CO 0.62 0.06 0.02 0.00 0.07 0.00 0.00 179.01 179.79 3d3u s MET 240 N -3.54 1.24 0.18 1.06 0.23 -1.26 -2.64 119.30 114.57 3d3u s MET 240 Ca 0.02 -0.73 -0.15 0.00 -1.03 0.00 0.00 55.69 53.81 3d3u s MET 240 Cb 0.08 0.51 0.02 0.00 -1.53 0.00 0.00 34.83 33.91 3d3u s MET 240 CO 0.60 -0.52 0.43 -0.59 -2.03 0.00 0.00 175.02 172.92 3d3u s PHE 241 N -3.82 0.02 0.00 3.16 -0.71 -1.00 -4.83 117.98 110.80 3d3u s PHE 241 Ca 0.05 -0.37 0.00 0.00 -1.04 0.00 0.00 56.93 55.57 3d3u s PHE 241 Cb 0.00 0.24 0.00 0.00 -1.21 0.00 0.00 43.02 42.05 3d3u s PHE 241 CO -0.08 -0.83 0.00 2.41 -1.34 0.00 0.00 175.22 175.38 3d3u n THR 242 N -0.28 0.00 0.26 -4.49 -1.04 -1.26 -2.79 114.28 104.67 3d3u n THR 242 Ca -0.10 0.00 0.17 0.00 -2.04 0.00 0.00 64.05 62.08 3d3u n THR 242 Cb 0.63 0.00 0.80 0.00 -1.82 0.00 0.00 70.33 69.94 3d3u n THR 242 CO 0.00 0.00 0.00 0.44 -0.64 0.00 0.00 175.07 174.87 3d3u h ASP 243 N 0.00 0.00 -0.46 8.00 3.45 -1.95 -2.31 116.42 123.15 3d3u h ASP 243 Ca 0.00 0.00 -0.07 0.00 0.43 0.00 0.00 57.03 57.39 3d3u h ASP 243 Cb 0.00 0.00 -0.02 0.00 -0.56 0.00 0.00 39.33 38.75 3d3u h ASP 243 CO 0.00 0.00 0.03 1.23 -1.57 0.00 0.00 179.24 178.93 3d3u h GLY 244 N 0.00 0.86 1.05 2.75 0.00 -1.97 -2.61 103.07 103.15 3d3u h GLY 244 Ca 0.06 -0.62 0.04 0.00 0.00 0.00 0.00 47.33 46.81 3d3u h GLY 244 CO -0.00 0.57 0.54 -2.08 0.00 0.00 0.00 176.54 175.57 3d3u h VAL 245 N 0.66 1.12 -0.48 4.60 2.07 -1.82 -2.32 116.25 120.08 3d3u h VAL 245 Ca 0.13 -0.35 -0.01 0.00 0.82 0.00 0.00 66.70 67.30 3d3u h VAL 245 Cb 0.46 0.03 -0.02 0.00 -1.52 0.00 0.00 31.29 30.24 3d3u h VAL 245 CO 0.02 0.18 0.28 -0.03 0.02 0.00 0.00 177.57 178.04 3d3u h MET 246 N 1.01 0.67 -0.58 1.57 -1.53 -1.56 -0.27 114.93 114.23 3d3u h MET 246 Ca 0.33 -0.07 0.02 0.00 -3.44 0.00 0.00 59.70 56.54 3d3u h MET 246 Cb 0.06 -0.13 -0.03 0.00 -0.55 0.00 0.00 31.60 30.94 3d3u h MET 246 CO -0.10 0.51 0.37 -0.09 0.14 0.00 0.00 176.91 177.73 3d3u h ARG 247 N 0.64 0.71 0.00 0.39 2.43 -1.22 0.65 114.38 117.98 3d3u h ARG 247 Ca 0.17 -0.04 -0.24 0.00 -0.81 0.00 0.00 59.98 59.06 3d3u h ARG 247 Cb 0.02 -0.16 -0.04 0.00 -0.42 0.00 0.00 29.97 29.37 3d3u h ARG 247 CO -0.03 0.47 -1.29 0.52 -1.51 0.00 0.00 179.97 178.13 3d3u h MET 248 N 0.73 0.00 0.08 0.20 2.86 -1.19 0.72 114.93 118.33 3d3u h MET 248 Ca 0.23 0.00 -0.00 0.00 -2.06 0.00 0.00 59.70 57.86 3d3u h MET 248 Cb -0.02 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.64 3d3u h MET 248 CO -0.08 0.76 -0.04 0.82 1.06 0.00 0.00 176.91 179.43 3d3u h ILE 249 N 0.00 0.96 -0.73 -1.22 2.04 -0.57 -2.23 117.51 115.76 3d3u h ILE 249 Ca -0.13 -0.13 0.15 0.00 1.00 0.00 0.00 64.86 65.76 3d3u h ILE 249 Cb 1.86 1.04 -0.14 0.00 -0.74 0.00 0.00 36.82 38.84 3d3u h ILE 249 CO 0.11 0.03 -0.15 -0.09 0.00 0.00 0.00 178.15 178.05 3d3u h ARG 250 N -0.17 0.02 0.00 2.37 9.65 0.41 -0.71 114.38 125.96 3d3u h ARG 250 Ca -0.01 -0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.87 3d3u h ARG 250 Cb 0.14 -0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.71 3d3u h ARG 250 CO 0.02 0.01 0.00 1.63 2.80 0.00 0.00 179.97 184.43 3d3u n LYS 251 N -5.46 0.37 0.00 0.20 5.02 0.24 -4.87 118.16 113.67 3d3u n LYS 251 Ca 0.10 0.07 0.00 0.00 -2.02 0.00 0.00 58.31 56.46 3d3u n LYS 251 Cb 0.39 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.90 3d3u n LYS 251 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3d3u n GLY 252 N 0.49 1.50 0.12 0.72 0.00 -0.27 -4.96 105.19 102.80 3d3u n GLY 252 Ca 0.11 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.00 3d3u n GLY 252 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3d3u h ILE 253 N 0.00 1.35 -3.42 -0.61 1.08 -1.62 -3.42 117.51 110.87 3d3u h ILE 253 Ca 0.00 -1.24 -0.60 0.00 -0.39 0.00 0.00 64.86 62.62 3d3u h ILE 253 Cb 0.00 1.90 -0.10 0.00 -3.07 0.00 0.00 36.82 35.55 3d3u h ILE 253 CO 0.00 0.36 0.41 -0.63 -0.69 0.00 0.00 178.15 177.60 3d3u s ILE 254 N -4.35 4.79 0.00 -0.67 1.01 -0.93 -1.60 121.20 119.46 3d3u s ILE 254 Ca -0.14 1.23 0.00 0.00 0.00 0.00 0.00 60.65 61.73 3d3u s ILE 254 Cb 0.05 -4.15 0.00 0.00 0.01 0.00 0.00 42.46 38.37 3d3u s ILE 254 CO 0.74 -0.24 0.00 -0.46 0.00 0.00 0.00 174.94 174.97 3d3u n ASN 255 N 6.21 0.00 -4.13 3.58 2.04 0.21 -4.47 115.26 118.70 3d3u n ASN 255 Ca 0.04 -0.22 -0.29 0.00 -0.44 0.00 0.00 54.58 53.67 3d3u n ASN 255 Cb 0.48 0.00 -0.08 0.00 -2.53 0.00 0.00 39.78 37.65 3d3u n ASN 255 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 3d3u n GLY 256 N 0.00 -0.14 0.18 4.83 0.00 0.17 -4.04 105.19 106.19 3d3u n GLY 256 Ca 0.00 0.17 0.07 0.00 0.00 0.00 0.00 46.02 46.26 3d3u n GLY 256 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3d3u h LYS 257 N -1.54 0.00 0.00 1.61 1.57 -1.79 0.47 116.57 116.89 3d3u h LYS 257 Ca -0.60 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.16 3d3u h LYS 257 Cb 1.26 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 33.57 3d3u h LYS 257 CO 0.63 0.30 -1.97 1.63 -0.57 0.00 0.00 179.45 179.47 3d3u n LYS 258 N -3.22 0.66 -0.77 3.15 5.02 -1.26 -4.81 118.16 116.93 3d3u n LYS 258 Ca 0.02 -0.17 -0.30 0.00 -2.02 0.00 0.00 58.31 55.84 3d3u n LYS 258 Cb 0.61 -1.54 -0.04 0.00 -0.02 0.00 0.00 35.03 34.04 3d3u n LYS 258 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3d3u n LYS 259 N -2.31 0.00 -0.28 1.97 5.02 -1.23 -4.82 118.16 116.51 3d3u n LYS 259 Ca -0.06 0.00 0.11 0.00 -2.02 0.00 0.00 58.31 56.35 3d3u n LYS 259 Cb 0.60 -0.74 0.28 0.00 -0.02 0.00 0.00 35.03 35.15 3d3u n LYS 259 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 3d3u n THR 260 N 1.06 0.73 -3.72 -0.18 -2.24 -1.26 -4.51 114.28 104.17 3d3u n THR 260 Ca 0.11 -0.83 -0.17 0.00 -2.27 0.00 0.00 64.05 60.90 3d3u n THR 260 Cb 0.02 0.64 -0.17 0.00 -2.10 0.00 0.00 70.33 68.73 3d3u n THR 260 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 3d3u s LEU 261 N -1.21 0.56 -1.15 3.22 2.96 -1.26 -4.85 118.68 116.95 3d3u s LEU 261 Ca 0.43 0.12 -0.17 0.00 -0.22 0.00 0.00 54.13 54.28 3d3u s LEU 261 Cb 0.23 -0.01 -0.02 0.00 0.50 0.00 0.00 46.19 46.90 3d3u s LEU 261 CO 0.31 -0.19 0.79 1.41 -1.32 0.00 0.00 176.35 177.35 3d3u n HIS 262 N 4.72 -1.96 -1.83 5.38 8.25 -1.26 -4.89 115.22 123.63 3d3u n HIS 262 Ca -0.16 0.53 -0.41 0.00 -0.26 0.00 0.00 57.72 57.42 3d3u n HIS 262 Cb 0.50 -3.59 -0.00 0.00 1.12 0.00 0.00 29.99 28.02 3d3u n HIS 262 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 3d3u s PRO 263 N -5.82 4.13 -0.93 -0.41 0.04 -1.26 -2.45 135.00 128.30 3d3u s PRO 263 Ca 0.42 2.54 0.00 0.00 0.04 0.00 0.00 61.00 64.01 3d3u s PRO 263 Cb -0.14 -2.98 0.00 0.00 0.04 0.00 0.00 34.50 31.42 3d3u s PRO 263 CO 0.85 -0.52 0.00 0.39 0.04 0.00 0.00 177.00 177.76 3d3u n GLU 264 N 0.68 -0.68 -3.82 4.56 1.02 0.17 -5.02 120.64 117.55 3d3u n GLU 264 Ca 0.02 0.71 -0.09 0.00 -0.02 0.00 0.00 57.16 57.78 3d3u n GLU 264 Cb 0.39 -4.64 -0.07 0.00 -0.02 0.00 0.00 31.44 27.10 3d3u n GLU 264 CO 0.00 0.00 0.00 -1.59 1.18 0.00 0.00 177.13 176.72 3d3u s LYS 265 N -3.30 0.87 -0.25 3.49 -2.85 -1.03 -4.86 119.74 111.80 3d3u s LYS 265 Ca 0.00 -0.88 -0.09 0.00 -1.00 0.00 0.00 55.97 54.00 3d3u s LYS 265 Cb 0.00 0.36 -0.04 0.00 -2.06 0.00 0.00 37.83 36.09 3d3u s LYS 265 CO 0.00 -0.29 0.11 0.14 0.10 0.00 0.00 175.35 175.41 3d3u s VAL 266 N -3.73 4.67 -0.18 1.79 -7.23 0.13 -4.48 120.40 111.37 3d3u s VAL 266 Ca 0.04 -0.05 -0.06 0.00 -1.81 0.00 0.00 61.98 60.10 3d3u s VAL 266 Cb 0.04 -3.19 -0.03 0.00 0.56 0.00 0.00 36.38 33.75 3d3u s VAL 266 CO -0.10 0.32 0.02 0.68 -0.31 0.00 0.00 175.10 175.70 3d3u s VAL 267 N 1.58 4.37 0.00 1.32 -7.23 -1.12 -2.60 120.40 116.72 3d3u s VAL 267 Ca 0.06 -0.18 0.00 0.00 -1.81 0.00 0.00 61.98 60.05 3d3u s VAL 267 Cb -0.15 -2.96 0.00 0.00 0.56 0.00 0.00 36.38 33.83 3d3u s VAL 267 CO 0.06 0.46 0.00 0.35 -0.31 0.00 0.00 175.10 175.66 3d3u n THR 268 N 3.65 0.00 0.00 5.32 -2.24 -1.13 -2.17 114.28 117.72 3d3u n THR 268 Ca -0.17 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.61 3d3u n THR 268 Cb 0.52 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.75 3d3u n THR 268 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26 3d3u n SER 269 N -0.32 3.56 -3.75 3.42 2.88 -1.22 0.45 113.62 118.65 3d3u n SER 269 Ca 0.00 0.00 -0.04 0.00 -1.33 0.00 0.00 58.87 57.50 3d3u n SER 269 Cb 0.00 0.67 -0.01 0.00 -0.75 0.00 0.00 64.21 64.12 3d3u n SER 269 CO 0.00 0.00 0.00 -1.48 -1.23 0.00 0.00 175.04 172.33 3d3u s LEU 270 N -2.26 -0.21 -0.12 2.46 2.34 -1.08 -1.94 118.68 117.88 3d3u s LEU 270 Ca 0.00 -0.40 -0.08 0.00 0.06 0.00 0.00 54.13 53.70 3d3u s LEU 270 Cb 0.00 2.24 0.04 0.00 -0.56 0.00 0.00 46.19 47.91 3d3u s LEU 270 CO 0.00 -0.95 0.30 -0.63 -1.06 0.00 0.00 176.35 174.01 3d3u s ILE 271 N -3.38 -0.02 0.16 1.48 1.01 -0.83 -2.37 121.20 117.25 3d3u s ILE 271 Ca 0.11 0.07 -0.15 0.00 0.00 0.00 0.00 60.65 60.68 3d3u s ILE 271 Cb -0.02 -0.44 0.02 0.00 0.01 0.00 0.00 42.46 42.03 3d3u s ILE 271 CO 0.02 0.03 0.42 0.72 0.00 0.00 0.00 174.94 176.12 3d3u s PHE 272 N 0.76 -0.06 -0.23 3.97 -0.71 -1.12 -4.74 117.98 115.86 3d3u s PHE 272 Ca -0.05 -0.29 0.00 0.00 -1.04 0.00 0.00 56.93 55.56 3d3u s PHE 272 Cb -0.06 0.24 0.00 0.00 -1.21 0.00 0.00 43.02 41.99 3d3u s PHE 272 CO -0.05 -0.78 0.00 0.41 -1.34 0.00 0.00 175.22 173.46 3d3u n GLY 273 N -0.26 -0.53 3.94 1.99 0.00 -1.26 -4.31 105.19 104.77 3d3u n GLY 273 Ca -0.12 -0.41 -0.25 0.00 0.00 0.00 0.00 46.02 45.23 3d3u n GLY 273 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3d3u s SER 274 N -4.00 4.79 0.36 1.61 1.04 -1.26 -0.97 113.70 115.28 3d3u s SER 274 Ca 0.00 0.36 0.06 0.00 0.48 0.00 0.00 55.95 56.86 3d3u s SER 274 Cb 0.00 -1.01 0.76 0.00 0.10 0.00 0.00 66.02 65.87 3d3u s SER 274 CO 0.00 -1.60 1.95 0.50 0.98 0.00 0.00 173.24 175.08 3d3u h LYS 275 N -0.56 0.72 -0.50 4.02 3.64 -1.95 -0.14 116.57 121.81 3d3u h LYS 275 Ca -0.44 -0.04 0.06 0.00 -1.27 0.00 0.00 60.65 58.96 3d3u h LYS 275 Cb 1.31 -0.16 -0.05 0.00 -0.41 0.00 0.00 32.23 32.91 3d3u h LYS 275 CO 0.58 0.47 0.19 1.49 -2.27 0.00 0.00 179.45 179.91 3d3u h GLU 276 N 0.74 0.37 -0.17 1.90 4.81 -1.98 0.17 114.58 120.41 3d3u h GLU 276 Ca 0.32 -0.02 0.05 0.00 -0.13 0.00 0.00 59.36 59.58 3d3u h GLU 276 Cb 0.31 -0.08 -0.07 0.00 0.63 0.00 0.00 28.75 29.54 3d3u h GLU 276 CO -0.11 0.24 -0.40 1.25 -0.73 0.00 0.00 179.01 179.26 3d3u h LEU 277 N 0.38 -1.26 0.15 1.64 6.46 -1.41 0.35 115.31 121.62 3d3u h LEU 277 Ca 0.23 0.17 0.00 0.00 -0.12 0.00 0.00 57.88 58.17 3d3u h LEU 277 Cb 0.23 0.53 -0.01 0.00 -0.73 0.00 0.00 40.66 40.67 3d3u h LEU 277 CO -0.22 -0.41 -0.13 1.88 -0.62 0.00 0.00 178.44 178.94 3d3u h TYR 278 N -0.45 -0.35 -0.22 1.25 0.05 -0.48 0.13 116.97 116.91 3d3u h TYR 278 Ca 0.09 0.00 0.06 0.00 0.05 0.00 0.00 58.73 58.93 3d3u h TYR 278 Cb 0.61 0.13 -0.01 0.00 1.01 0.00 0.00 36.73 38.47 3d3u h TYR 278 CO -0.49 -0.21 0.16 -0.44 -1.05 0.00 0.00 178.16 176.13 3d3u h ASP 279 N -0.30 0.01 -0.14 3.88 3.32 -0.53 -1.88 116.42 120.78 3d3u h ASP 279 Ca -0.00 0.00 -0.12 0.00 0.02 0.00 0.00 57.03 56.93 3d3u h ASP 279 Cb 0.28 -0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.83 3d3u h ASP 279 CO -0.03 0.01 -0.36 0.15 -1.72 0.00 0.00 179.24 177.29 3d3u h PHE 280 N 0.01 0.64 0.00 4.55 3.57 0.12 -3.29 116.94 122.54 3d3u h PHE 280 Ca 0.10 -0.25 0.00 0.00 3.53 0.00 0.00 57.97 61.36 3d3u h PHE 280 Cb 0.40 -0.11 0.00 0.00 2.79 0.00 0.00 35.95 39.03 3d3u h PHE 280 CO -0.00 0.98 0.00 -0.39 -2.23 0.00 0.00 178.31 176.67 3d3u h VAL 281 N 0.11 0.00 -2.47 1.41 -1.51 -0.48 -3.43 116.25 109.88 3d3u h VAL 281 Ca -0.01 -0.52 -0.53 0.00 -1.23 0.00 0.00 66.70 64.41 3d3u h VAL 281 Cb 0.98 1.45 0.03 0.00 -2.13 0.00 0.00 31.29 31.61 3d3u h VAL 281 CO 0.08 0.00 1.16 0.21 -1.23 0.00 0.00 177.57 177.79 3d3u s ASN 282 N -4.98 6.45 -1.13 4.19 2.47 -0.74 -2.85 114.94 118.35 3d3u s ASN 282 Ca 0.07 2.69 -0.02 0.00 0.42 0.00 0.00 52.86 56.01 3d3u s ASN 282 Cb 0.09 -2.55 -0.03 0.00 -1.45 0.00 0.00 41.25 37.32 3d3u s ASN 282 CO 0.55 -1.02 0.96 0.59 -3.72 0.00 0.00 177.10 174.46 3d3u n ASN 283 N 6.58 -3.71 -3.93 -4.21 3.02 0.21 -4.89 115.26 108.32 3d3u n ASN 283 Ca 0.19 -0.65 -0.29 0.00 -0.03 0.00 0.00 54.58 53.80 3d3u n ASN 283 Cb 0.40 -5.11 -0.16 0.00 -0.61 0.00 0.00 39.78 34.29 3d3u n ASN 283 CO 0.00 0.00 0.00 0.21 -2.62 0.00 0.00 177.26 174.85 3d3u s ASN 284 N -3.99 2.79 0.45 6.41 3.84 -1.13 -4.99 114.94 118.31 3d3u s ASN 284 Ca 0.17 -0.61 0.22 0.00 0.21 0.00 0.00 52.86 52.85 3d3u s ASN 284 Cb -0.02 -1.00 1.21 0.00 -0.55 0.00 0.00 41.25 40.88 3d3u s ASN 284 CO 0.73 -0.14 1.84 -0.65 -2.79 0.00 0.00 177.10 176.08 3d3u h PRO 285 N 8.09 0.28 -0.09 0.43 0.11 -1.92 -2.28 132.00 136.62 3d3u h PRO 285 Ca -0.28 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.81 3d3u h PRO 285 Cb 1.12 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.16 3d3u h PRO 285 CO 0.44 0.19 0.00 1.55 -0.21 0.00 0.00 178.00 179.96 3d3u n VAL 286 N -4.46 0.11 -4.95 3.15 3.14 -1.26 -4.71 118.33 109.35 3d3u n VAL 286 Ca 0.21 -0.29 -0.32 0.00 -2.96 0.00 0.00 64.34 60.97 3d3u n VAL 286 Cb 0.83 0.41 -0.14 0.00 -1.06 0.00 0.00 33.84 33.88 3d3u n VAL 286 CO 0.00 0.00 0.00 -0.63 -6.46 0.00 0.00 176.83 169.74 3d3u s ILE 287 N -1.89 2.82 -0.08 1.55 1.01 -0.86 -0.70 121.20 123.06 3d3u s ILE 287 Ca 0.35 -0.79 -0.06 0.00 0.00 0.00 0.00 60.65 60.15 3d3u s ILE 287 Cb 0.19 -2.11 0.02 0.00 0.01 0.00 0.00 42.46 40.57 3d3u s ILE 287 CO 0.30 0.57 0.20 -1.61 0.00 0.00 0.00 174.94 174.39 3d3u s GLU 288 N -0.27 0.22 0.08 2.79 2.02 -1.07 -4.00 118.70 118.47 3d3u s GLU 288 Ca 0.01 0.31 0.02 0.00 0.02 0.00 0.00 54.97 55.33 3d3u s GLU 288 Cb -0.13 0.07 -0.04 0.00 0.10 0.00 0.00 34.13 34.13 3d3u s GLU 288 CO 0.03 -0.05 0.11 0.00 0.02 0.00 0.00 175.26 175.36 3d3u s TYR 290 N -1.42 0.33 0.93 0.00 2.02 0.17 -1.72 117.35 117.66 3d3u s TYR 290 Ca 0.30 -0.80 -0.12 0.00 -0.37 0.00 0.00 57.07 56.09 3d3u s TYR 290 Cb -0.12 -0.22 0.15 0.00 -0.40 0.00 0.00 41.96 41.36 3d3u s TYR 290 CO 0.23 -0.45 1.09 -1.25 -1.57 0.00 0.00 175.55 173.61 3d3u s PRO 291 N -3.74 0.99 0.31 -1.71 0.04 -1.26 -3.81 135.00 125.82 3d3u s PRO 291 Ca 0.05 0.70 0.16 0.00 0.04 0.00 0.00 61.00 61.95 3d3u s PRO 291 Cb 0.06 -1.79 0.27 0.00 0.04 0.00 0.00 34.50 33.08 3d3u s PRO 291 CO -0.10 -2.39 1.54 -0.39 0.04 0.00 0.00 177.00 175.70 3d3u h VAL 292 N -1.66 0.86 0.00 -0.36 -1.51 -1.73 -1.20 116.25 110.66 3d3u h VAL 292 Ca -0.51 -2.00 0.00 0.00 -1.23 0.00 0.00 66.70 62.96 3d3u h VAL 292 Cb 1.30 2.27 0.00 0.00 -2.13 0.00 0.00 31.29 32.73 3d3u h VAL 292 CO 0.56 0.45 0.00 -0.90 -1.23 0.00 0.00 177.57 176.45 3d3u n ASP 293 N -3.31 0.71 0.15 4.19 5.68 -1.26 -2.11 116.55 120.61 3d3u n ASP 293 Ca 0.01 -1.07 0.00 0.00 -0.50 0.00 0.00 54.79 53.23 3d3u n ASP 293 Cb 0.66 -0.27 0.00 0.00 -1.14 0.00 0.00 41.12 40.38 3d3u n ASP 293 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3d3u n TYR 294 N 0.32 -2.82 -0.05 2.11 4.19 -1.14 -4.73 117.16 115.04 3d3u n TYR 294 Ca 0.00 0.61 0.03 0.00 3.31 0.00 0.00 57.90 61.85 3d3u n TYR 294 Cb 0.16 1.09 0.37 0.00 0.49 0.00 0.00 39.34 41.44 3d3u n TYR 294 CO 0.00 0.00 0.00 0.97 0.91 0.00 0.00 176.86 178.74 3d3u h ILE 295 N 0.00 1.13 -0.24 2.97 6.09 -1.15 -0.03 117.51 126.28 3d3u h ILE 295 Ca 0.00 -0.28 0.00 0.00 -1.37 0.00 0.00 64.86 63.21 3d3u h ILE 295 Cb 0.00 0.44 0.00 0.00 0.47 0.00 0.00 36.82 37.73 3d3u h ILE 295 CO 0.00 0.14 0.00 0.59 -3.07 0.00 0.00 178.15 175.81 3d3u n ASN 296 N -4.45 2.67 -4.64 2.19 4.13 -0.90 -4.34 115.26 109.92 3d3u n ASN 296 Ca 0.04 -1.87 -0.43 0.00 1.68 0.00 0.00 54.58 54.00 3d3u n ASN 296 Cb 0.07 -0.15 -0.02 0.00 -1.54 0.00 0.00 39.78 38.13 3d3u n ASN 296 CO 0.00 0.00 0.00 0.21 0.28 0.00 0.00 177.26 177.75 3d3u s ASN 297 N -1.61 6.83 0.52 6.41 3.84 -0.02 -4.70 114.94 126.20 3d3u s ASN 297 Ca 0.35 1.38 0.27 0.00 0.21 0.00 0.00 52.86 55.07 3d3u s ASN 297 Cb 0.20 -2.54 1.39 0.00 -0.55 0.00 0.00 41.25 39.76 3d3u s ASN 297 CO 0.30 -0.91 1.92 -0.65 -2.79 0.00 0.00 177.10 174.97 3d3u h PRO 298 N 8.64 0.06 -0.18 0.43 0.11 -1.87 0.36 132.00 139.55 3d3u h PRO 298 Ca -0.25 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.84 3d3u h PRO 298 Cb 1.09 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.18 3d3u h PRO 298 CO 1.01 0.04 0.07 0.22 -0.21 0.00 0.00 178.00 179.13 3d3u h ASP 299 N 0.06 0.25 0.01 -2.05 3.58 -1.92 0.59 116.42 116.93 3d3u h ASP 299 Ca 0.37 -0.17 -0.00 0.00 0.42 0.00 0.00 57.03 57.65 3d3u h ASP 299 Cb 1.37 -0.06 0.00 0.00 1.72 0.00 0.00 39.33 42.36 3d3u h ASP 299 CO -0.03 0.35 -0.00 0.58 -2.88 0.00 0.00 179.24 177.25 3d3u h VAL 300 N 0.13 1.39 -0.95 2.25 2.07 -0.68 -3.03 116.25 117.43 3d3u h VAL 300 Ca 0.06 -1.22 0.23 0.00 0.82 0.00 0.00 66.70 66.59 3d3u h VAL 300 Cb 0.18 2.22 -0.18 0.00 -1.52 0.00 0.00 31.29 31.98 3d3u h VAL 300 CO -0.00 0.31 -0.10 0.40 0.02 0.00 0.00 177.57 178.20 3d3u h ILE 301 N -0.53 0.06 -0.90 4.57 2.04 -0.82 -0.82 117.51 121.11 3d3u h ILE 301 Ca -0.00 -0.00 0.12 0.00 1.00 0.00 0.00 64.86 65.97 3d3u h ILE 301 Cb 0.52 0.04 -0.07 0.00 -0.74 0.00 0.00 36.82 36.58 3d3u h ILE 301 CO 0.00 0.00 0.58 1.23 0.00 0.00 0.00 178.15 179.96 3d3u h GLY 302 N 0.01 1.28 2.00 5.37 0.00 0.31 -1.36 103.07 110.68 3d3u h GLY 302 Ca 0.52 -0.34 0.00 0.00 0.00 0.00 0.00 47.33 47.51 3d3u h GLY 302 CO -0.93 0.15 0.00 0.50 0.00 0.00 0.00 176.54 176.26 3d3u h LYS 303 N 0.80 0.00 -6.09 4.80 1.79 -1.07 -3.26 116.57 113.55 3d3u h LYS 303 Ca 0.43 0.00 -0.59 0.00 -2.18 0.00 0.00 60.65 58.32 3d3u h LYS 303 Cb 0.55 0.00 -0.08 0.00 -1.58 0.00 0.00 32.23 31.12 3d3u h LYS 303 CO -0.20 0.00 0.64 -0.80 -1.08 0.00 0.00 179.45 178.01 3d3u s ASN 304 N -4.96 6.76 0.58 0.86 0.01 -0.51 -4.55 114.94 113.13 3d3u s ASN 304 Ca -0.04 0.76 -0.17 0.00 -0.71 0.00 0.00 52.86 52.71 3d3u s ASN 304 Cb 0.11 -2.48 -0.04 0.00 0.41 0.00 0.00 41.25 39.25 3d3u s ASN 304 CO 0.38 -0.81 1.08 -1.81 -1.51 0.00 0.00 177.10 174.43 3d3u s ASP 305 N 1.74 5.72 -1.30 -1.22 -0.00 -1.26 -3.32 116.67 117.04 3d3u s ASP 305 Ca 0.39 1.93 -0.04 0.00 -0.00 0.00 0.00 52.55 54.84 3d3u s ASP 305 Cb -0.13 -2.55 0.01 0.00 -0.00 0.00 0.00 42.92 40.26 3d3u s ASP 305 CO 0.16 -1.21 0.99 0.54 -0.00 0.00 0.00 175.17 175.65 3d3u n ARG 306 N -1.81 -6.54 -3.05 8.23 1.74 -0.35 -3.81 116.66 111.07 3d3u n ARG 306 Ca 0.10 0.77 -0.40 0.00 -0.77 0.00 0.00 57.85 57.54 3d3u n ARG 306 Cb 0.52 -5.70 -0.05 0.00 -1.02 0.00 0.00 32.46 26.21 3d3u n ARG 306 CO 0.00 0.00 0.00 1.41 -1.52 0.00 0.00 177.63 177.52 3d3u s MET 307 N -5.87 4.23 -0.26 5.56 1.75 -1.21 -1.41 119.30 122.09 3d3u s MET 307 Ca 0.23 0.74 0.02 0.00 -1.25 0.00 0.00 55.69 55.43 3d3u s MET 307 Cb -0.10 -3.58 0.06 0.00 2.84 0.00 0.00 34.83 34.04 3d3u s MET 307 CO 0.76 -0.27 -0.10 0.54 -0.65 0.00 0.00 175.02 175.29 3d3u s VAL 308 N 2.01 2.27 -0.08 10.11 0.11 -1.10 -2.25 120.40 131.47 3d3u s VAL 308 Ca 0.31 -1.58 -0.14 0.00 -2.93 0.00 0.00 61.98 57.65 3d3u s VAL 308 Cb -0.16 -2.32 -0.05 0.00 -1.53 0.00 0.00 36.38 32.32 3d3u s VAL 308 CO 0.11 -0.02 0.34 -0.94 -3.33 0.00 0.00 175.10 171.26 3d3u s SER 309 N 1.13 6.61 -0.22 3.54 1.04 -1.16 -1.35 113.70 123.28 3d3u s SER 309 Ca -0.08 0.72 0.02 0.00 0.48 0.00 0.00 55.95 57.09 3d3u s SER 309 Cb -0.20 -2.21 0.05 0.00 0.10 0.00 0.00 66.02 63.76 3d3u s SER 309 CO -0.05 0.22 -0.12 -0.63 0.98 0.00 0.00 173.24 173.65 3d3u s ILE 310 N -0.36 1.88 0.34 -1.02 1.01 0.47 -1.49 121.20 122.04 3d3u s ILE 310 Ca 0.20 -1.23 0.07 0.00 0.00 0.00 0.00 60.65 59.70 3d3u s ILE 310 Cb -0.15 -1.94 -0.07 0.00 0.01 0.00 0.00 42.46 40.32 3d3u s ILE 310 CO 0.08 0.15 -0.04 0.20 0.00 0.00 0.00 174.94 175.33 3d3u s ASN 311 N 1.28 3.35 -0.18 3.58 0.01 -0.74 -3.35 114.94 118.89 3d3u s ASN 311 Ca -0.03 -1.26 -0.05 0.00 -0.71 0.00 0.00 52.86 50.81 3d3u s ASN 311 Cb -0.17 -0.28 0.07 0.00 0.41 0.00 0.00 41.25 41.28 3d3u s ASN 311 CO -0.08 -0.35 0.14 -0.55 -1.51 0.00 0.00 177.10 174.75 3d3u s SER 312 N -3.58 2.00 0.61 -1.22 0.15 -1.26 -1.26 113.70 109.14 3d3u s SER 312 Ca 0.33 -0.48 -0.04 0.00 0.70 0.00 0.00 55.95 56.46 3d3u s SER 312 Cb 0.05 -0.02 0.03 0.00 -1.71 0.00 0.00 66.02 64.38 3d3u s SER 312 CO 0.16 -0.34 0.89 0.00 1.20 0.00 0.00 173.24 175.14 3d3u n LEU 314 N -2.59 0.00 -3.49 0.00 7.99 -1.26 -4.82 117.00 112.83 3d3u n LEU 314 Ca 0.06 0.00 -0.11 0.00 -0.01 0.00 0.00 56.01 55.95 3d3u n LEU 314 Cb 0.59 0.01 -0.03 0.00 -0.11 0.00 0.00 43.42 43.88 3d3u n LEU 314 CO 0.50 0.01 0.59 -0.70 -1.51 0.00 0.00 177.39 176.28 3d3u s GLU 315 N -3.37 0.94 0.15 3.23 2.12 -1.26 -4.82 118.70 115.68 3d3u s GLU 315 Ca -0.07 -0.21 -0.10 0.00 0.36 0.00 0.00 54.97 54.94 3d3u s GLU 315 Cb 0.13 0.44 -0.00 0.00 0.26 0.00 0.00 34.13 34.95 3d3u s GLU 315 CO 0.83 -0.39 0.29 1.41 -0.54 0.00 0.00 175.26 176.87 3d3u s MET 316 N -2.77 1.09 0.43 4.30 -2.45 0.13 -4.35 119.30 115.68 3d3u s MET 316 Ca 0.01 -1.06 0.06 0.00 -1.25 0.00 0.00 55.69 53.45 3d3u s MET 316 Cb -0.01 0.39 -0.06 0.00 1.25 0.00 0.00 34.83 36.40 3d3u s MET 316 CO -0.06 -0.40 0.06 0.16 1.05 0.00 0.00 175.02 175.83 3d3u s ASP 317 N -2.92 4.08 0.00 1.11 -4.77 -0.60 0.07 116.67 113.64 3d3u s ASP 317 Ca 0.12 -1.35 0.00 0.00 -3.30 0.00 0.00 52.55 48.03 3d3u s ASP 317 Cb 0.03 -0.23 0.00 0.00 -1.09 0.00 0.00 42.92 41.64 3d3u s ASP 317 CO -0.04 -0.57 0.01 0.18 0.70 0.00 0.00 175.17 175.45 3d3u n LEU 318 N -1.11 0.00 0.00 2.11 4.77 0.75 -2.47 117.00 121.04 3d3u n LEU 318 Ca -0.06 -0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.92 3d3u n LEU 318 Cb 0.66 -0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.75 3d3u n LEU 318 CO 0.46 0.00 -0.16 0.80 -1.33 0.00 0.00 177.39 177.16 3d3u n MET 319 N -0.41 3.18 0.00 3.23 1.56 -1.26 -2.84 117.12 120.58 3d3u n MET 319 Ca 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 57.70 57.43 3d3u n MET 319 Cb 0.00 -0.66 0.00 0.00 2.15 0.00 0.00 33.22 34.71 3d3u n MET 319 CO 0.00 0.00 0.00 0.41 -0.73 0.00 0.00 175.97 175.65 3d3u n GLY 320 N 0.98 1.84 2.92 -5.12 0.00 -1.03 -4.66 105.19 100.12 3d3u n GLY 320 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.78 3d3u n GLY 320 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3d3u s GLN 321 N -0.14 1.32 0.00 1.61 -0.21 -1.26 -3.67 119.66 117.30 3d3u s GLN 321 Ca 0.00 -0.22 0.00 0.00 0.02 0.00 0.00 55.36 55.16 3d3u s GLN 321 Cb 0.00 -1.31 0.00 0.00 1.00 0.00 0.00 33.01 32.70 3d3u s GLN 321 CO 0.00 -0.15 0.00 0.00 -2.12 0.00 0.00 175.29 173.02 3d3u n ALA 322 N 4.48 0.00 0.00 6.09 0.00 -1.26 -1.56 120.51 128.25 3d3u n ALA 322 Ca -0.17 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.27 3d3u n ALA 322 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.96 3d3u n ALA 322 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3d3u n GLY 337 N 5.00 0.00 0.36 0.00 0.00 -1.14 -4.93 105.19 104.48 3d3u n GLY 337 Ca 0.00 0.00 0.32 0.00 0.00 0.00 0.00 46.02 46.34 3d3u n GLY 337 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3d3u h GLN 338 N 0.00 0.09 0.01 1.61 4.20 -2.01 -2.14 115.11 116.87 3d3u h GLN 338 Ca 0.00 -0.01 -0.31 0.00 0.06 0.00 0.00 58.65 58.39 3d3u h GLN 338 Cb 0.00 -0.02 -0.05 0.00 0.30 0.00 0.00 27.48 27.71 3d3u h GLN 338 CO 0.00 0.06 -1.83 1.55 -0.67 0.00 0.00 178.83 177.94 3d3u n VAL 339 N -5.06 1.60 -0.08 -0.54 3.14 -1.26 -3.32 118.33 112.81 3d3u n VAL 339 Ca 0.37 -0.78 -0.06 0.00 -2.96 0.00 0.00 64.34 60.90 3d3u n VAL 339 Cb 1.26 -1.06 -0.00 0.00 -1.06 0.00 0.00 33.84 32.98 3d3u n VAL 339 CO 0.00 0.00 0.00 0.44 -6.46 0.00 0.00 176.83 170.81 3d3u h ASP 340 N 0.01 -0.39 0.24 6.55 3.45 -1.71 -2.33 116.42 122.23 3d3u h ASP 340 Ca -0.33 0.11 -0.12 0.00 0.43 0.00 0.00 57.03 57.12 3d3u h ASP 340 Cb 2.04 0.23 -0.01 0.00 -0.56 0.00 0.00 39.33 41.03 3d3u h ASP 340 CO 0.07 -0.14 -0.45 -0.26 -1.57 0.00 0.00 179.24 176.89 3d3u h PHE 341 N -0.05 0.31 -0.31 4.55 0.04 -1.57 -1.07 116.94 118.84 3d3u h PHE 341 Ca 0.16 -0.09 0.07 0.00 2.80 0.00 0.00 57.97 60.90 3d3u h PHE 341 Cb 0.29 -0.07 -0.08 0.00 2.20 0.00 0.00 35.95 38.29 3d3u h PHE 341 CO -0.32 0.66 -0.36 -0.07 -0.60 0.00 0.00 178.31 177.62 3d3u h LEU 342 N 0.21 -1.17 -0.19 1.54 4.07 -1.45 0.33 115.31 118.65 3d3u h LEU 342 Ca 0.01 0.19 -0.01 0.00 0.08 0.00 0.00 57.88 58.15 3d3u h LEU 342 Cb 0.88 0.52 -0.01 0.00 1.08 0.00 0.00 40.66 43.13 3d3u h LEU 342 CO 0.07 -0.35 0.07 0.03 -1.08 0.00 0.00 178.44 177.18 3d3u h ARG 343 N -0.33 0.29 -0.03 1.13 3.08 -1.29 -2.55 114.38 114.69 3d3u h ARG 343 Ca 0.14 -0.06 -0.21 0.00 0.07 0.00 0.00 59.98 59.93 3d3u h ARG 343 Cb 0.56 -0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.56 3d3u h ARG 343 CO -0.49 0.37 -0.85 0.78 -1.07 0.00 0.00 179.97 178.71 3d3u h GLY 344 N 0.16 0.43 2.00 0.04 0.00 -1.15 -1.95 103.07 102.59 3d3u h GLY 344 Ca 0.06 -0.69 -0.00 0.00 0.00 0.00 0.00 47.33 46.70 3d3u h GLY 344 CO -0.00 0.61 -0.02 0.00 0.00 0.00 0.00 176.54 177.13 3d3u h ALA 345 N 0.84 1.87 -0.00 3.60 0.00 -0.24 -2.60 119.26 122.73 3d3u h ALA 345 Ca -0.06 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.84 3d3u h ALA 345 Cb 1.46 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.25 3d3u h ALA 345 CO 0.14 0.02 -0.06 1.63 0.00 0.00 0.00 179.25 180.99 3d3u n LYS 346 N -4.37 0.83 -0.02 0.00 4.76 -0.75 -3.25 118.16 115.36 3d3u n LYS 346 Ca -0.03 -0.22 0.07 0.00 -2.87 0.00 0.00 58.31 55.26 3d3u n LYS 346 Cb 0.11 -1.50 -0.15 0.00 -1.84 0.00 0.00 35.03 31.65 3d3u n LYS 346 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 3d3u n ARG 347 N -0.89 0.63 -2.69 1.97 3.00 -0.98 -4.98 116.66 112.72 3d3u n ARG 347 Ca 0.17 -0.15 -0.38 0.00 -0.01 0.00 0.00 57.85 57.48 3d3u n ARG 347 Cb 0.24 -1.45 -0.06 0.00 0.00 0.00 0.00 32.46 31.20 3d3u n ARG 347 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.63 176.09 3d3u s SER 348 N -4.29 7.28 -0.08 0.55 1.04 -1.20 -4.88 113.70 112.12 3d3u s SER 348 Ca -0.07 1.96 -0.29 0.00 0.48 0.00 0.00 55.95 58.03 3d3u s SER 348 Cb 0.11 -2.59 -0.06 0.00 0.10 0.00 0.00 66.02 63.58 3d3u s SER 348 CO 0.78 -0.11 1.82 -1.59 0.98 0.00 0.00 173.24 175.12 3d3u s LYS 349 N -1.87 3.94 -0.30 4.02 -2.85 -1.26 -2.09 119.74 119.33 3d3u s LYS 349 Ca 0.49 2.19 -0.00 0.00 -1.00 0.00 0.00 55.97 57.64 3d3u s LYS 349 Cb -0.23 -4.11 0.00 0.00 -2.06 0.00 0.00 37.83 31.44 3d3u s LYS 349 CO 0.29 -1.15 0.04 0.41 0.10 0.00 0.00 175.35 175.04 3d3u n GLY 350 N 4.60 0.32 3.95 0.59 0.00 -1.26 -1.21 105.19 112.17 3d3u n GLY 350 Ca 0.20 -0.69 -0.21 0.00 0.00 0.00 0.00 46.02 45.33 3d3u n GLY 350 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3d3u s GLY 351 N -2.88 1.36 0.31 -0.02 0.00 -0.89 -3.85 107.32 101.35 3d3u s GLY 351 Ca 0.02 -1.33 -0.04 0.00 0.00 0.00 0.00 44.72 43.37 3d3u s GLY 351 CO 0.03 -1.33 0.43 -0.26 0.00 0.00 0.00 173.10 171.97 3d3u s ILE 352 N -2.06 0.00 -0.02 0.90 -4.36 -0.95 -4.86 121.20 109.85 3d3u s ILE 352 Ca 0.37 -1.62 0.00 0.00 -0.26 0.00 0.00 60.65 59.14 3d3u s ILE 352 Cb -0.09 -2.53 0.02 0.00 1.25 0.00 0.00 42.46 41.12 3d3u s ILE 352 CO 0.29 0.00 0.02 -0.94 0.24 0.00 0.00 174.94 174.55 3d3u s SER 353 N -3.19 0.06 -0.11 4.36 1.04 -1.26 -3.01 113.70 111.58 3d3u s SER 353 Ca 0.30 0.03 -0.00 0.00 0.48 0.00 0.00 55.95 56.76 3d3u s SER 353 Cb 0.00 -0.05 -0.02 0.00 0.10 0.00 0.00 66.02 66.05 3d3u s SER 353 CO 0.17 -0.10 -0.10 -0.63 0.98 0.00 0.00 173.24 173.56 3d3u s ILE 354 N 0.82 3.35 -0.35 -1.02 1.01 -0.56 -2.16 121.20 122.29 3d3u s ILE 354 Ca -0.07 -0.57 -0.11 0.00 0.00 0.00 0.00 60.65 59.90 3d3u s ILE 354 Cb -0.10 -2.40 0.01 0.00 0.01 0.00 0.00 42.46 39.98 3d3u s ILE 354 CO -0.02 0.54 0.20 -0.32 0.00 0.00 0.00 174.94 175.33 3d3u s MET 355 N -0.02 3.12 -0.09 2.79 1.75 -0.82 -1.78 119.30 124.24 3d3u s MET 355 Ca -0.02 -0.88 0.01 0.00 -1.25 0.00 0.00 55.69 53.55 3d3u s MET 355 Cb -0.14 -3.69 -0.02 0.00 2.84 0.00 0.00 34.83 33.82 3d3u s MET 355 CO 0.04 -0.56 -0.11 0.00 -0.65 0.00 0.00 175.02 173.73 3d3u s ALA 356 N 1.61 2.75 0.18 4.11 0.00 -0.39 -1.83 121.76 128.18 3d3u s ALA 356 Ca 0.04 -0.92 -0.23 0.00 0.00 0.00 0.00 51.96 50.85 3d3u s ALA 356 Cb -0.18 -1.15 0.05 0.00 0.00 0.00 0.00 23.12 21.84 3d3u s ALA 356 CO 0.07 0.43 0.75 -0.59 0.00 0.00 0.00 175.76 176.42 3d3u s PHE 357 N -0.31 -0.31 0.21 0.00 -0.12 -0.91 -4.23 117.98 112.31 3d3u s PHE 357 Ca 0.03 0.00 -0.30 0.00 -0.05 0.00 0.00 56.93 56.62 3d3u s PHE 357 Cb -0.13 0.63 -0.08 0.00 -0.63 0.00 0.00 43.02 42.81 3d3u s PHE 357 CO 0.03 -0.95 1.07 -2.14 -0.05 0.00 0.00 175.22 173.18 3d3u s PRO 358 N -3.64 4.65 0.04 1.99 0.02 -1.26 -4.27 135.00 132.52 3d3u s PRO 358 Ca 0.07 1.70 0.08 0.00 0.02 0.00 0.00 61.00 62.87 3d3u s PRO 358 Cb -0.03 -3.26 0.37 0.00 0.02 0.00 0.00 34.50 31.61 3d3u s PRO 358 CO -0.02 0.19 1.26 -1.13 -0.33 0.00 0.00 177.00 176.97 3d3u n SER 359 N 1.91 0.08 -3.09 2.53 3.41 -1.26 -4.65 113.62 112.55 3d3u n SER 359 Ca 0.01 0.53 -0.18 0.00 -0.26 0.00 0.00 58.87 58.96 3d3u n SER 359 Cb 0.46 -0.54 -0.07 0.00 -0.26 0.00 0.00 64.21 63.80 3d3u n SER 359 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 175.04 175.23 3d3u n THR 360 N -1.59 0.00 -3.99 6.66 -2.24 -1.26 -2.37 114.28 109.48 3d3u n THR 360 Ca 0.01 -2.08 -0.09 0.00 -2.27 0.00 0.00 64.05 59.62 3d3u n THR 360 Cb 0.08 0.96 -0.08 0.00 -2.10 0.00 0.00 70.33 69.19 3d3u n THR 360 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3d3u s ALA 361 N -3.10 0.17 -1.22 6.98 0.00 0.37 -4.76 121.76 120.20 3d3u s ALA 361 Ca 0.30 -0.99 -0.09 0.00 0.00 0.00 0.00 51.96 51.18 3d3u s ALA 361 Cb 0.01 0.80 -0.01 0.00 0.00 0.00 0.00 23.12 23.92 3d3u s ALA 361 CO 0.21 -0.59 0.73 1.17 0.00 0.00 0.00 175.76 177.28 3d3u n LYS 362 N -0.16 -2.97 -4.04 0.00 4.81 -1.26 -1.79 118.16 112.76 3d3u n LYS 362 Ca -0.08 0.57 -0.31 0.00 -0.87 0.00 0.00 58.31 57.62 3d3u n LYS 362 Cb 0.63 -4.79 -0.01 0.00 0.02 0.00 0.00 35.03 30.88 3d3u n LYS 362 CO 0.00 0.00 0.00 1.17 1.17 0.00 0.00 177.40 179.74 3d3u n LYS 363 N -4.11 -3.95 -0.83 1.64 4.81 -1.26 -2.83 118.16 111.62 3d3u n LYS 363 Ca -0.19 0.46 0.00 0.00 -0.87 0.00 0.00 58.31 57.71 3d3u n LYS 363 Cb 0.64 -5.06 0.00 0.00 0.02 0.00 0.00 35.03 30.63 3d3u n LYS 363 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3d3u n GLY 364 N -1.64 0.57 0.09 3.14 0.00 -0.85 -4.89 105.19 101.60 3d3u n GLY 364 Ca -0.06 -0.18 -0.05 0.00 0.00 0.00 0.00 46.02 45.73 3d3u n GLY 364 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 3d3u h THR 365 N 0.00 1.57 -3.28 2.61 1.35 -1.23 -3.46 112.91 110.48 3d3u h THR 365 Ca 0.00 -3.00 -0.56 0.00 -0.55 0.00 0.00 66.41 62.30 3d3u h THR 365 Cb 0.00 2.64 -0.35 0.00 -1.73 0.00 0.00 68.15 68.71 3d3u h THR 365 CO 0.00 0.84 -0.83 -1.61 -0.25 0.00 0.00 175.52 173.68 3d3u s GLU 366 N -2.96 2.02 -0.14 4.72 0.41 -0.74 -4.96 118.70 117.06 3d3u s GLU 366 Ca 0.01 -0.49 -0.29 0.00 -0.41 0.00 0.00 54.97 53.79 3d3u s GLU 366 Cb 0.10 -1.76 -0.03 0.00 -1.78 0.00 0.00 34.13 30.66 3d3u s GLU 366 CO 0.80 -0.08 1.43 0.45 -0.49 0.00 0.00 175.26 177.37 3d3u s SER 367 N 1.06 6.78 0.00 -0.19 0.15 -1.26 0.14 113.70 120.38 3d3u s SER 367 Ca -0.06 1.85 0.22 0.00 0.70 0.00 0.00 55.95 58.66 3d3u s SER 367 Cb -0.15 -2.54 1.29 0.00 -1.71 0.00 0.00 66.02 62.92 3d3u s SER 367 CO -0.02 -0.88 1.72 0.54 1.20 0.00 0.00 173.24 175.80 3d3u n ARG 368 N 6.93 0.61 -3.80 5.44 1.74 -1.00 -4.49 116.66 122.09 3d3u n ARG 368 Ca 0.16 0.02 -0.37 0.00 -0.77 0.00 0.00 57.85 56.89 3d3u n ARG 368 Cb 0.44 -1.50 -0.13 0.00 -1.02 0.00 0.00 32.46 30.26 3d3u n ARG 368 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 3d3u s ILE 369 N -2.14 3.52 0.20 0.55 1.01 -1.26 0.17 121.20 123.25 3d3u s ILE 369 Ca 0.31 -1.28 0.10 0.00 0.00 0.00 0.00 60.65 59.78 3d3u s ILE 369 Cb 0.15 -3.03 -0.04 0.00 0.01 0.00 0.00 42.46 39.55 3d3u s ILE 369 CO 0.28 -0.20 -0.20 0.68 0.00 0.00 0.00 174.94 175.50 3d3u s VAL 370 N 1.34 2.15 0.24 2.92 -7.23 0.11 -4.94 120.40 114.99 3d3u s VAL 370 Ca -0.02 -2.09 -0.05 0.00 -1.81 0.00 0.00 61.98 58.01 3d3u s VAL 370 Cb -0.20 -2.06 0.21 0.00 0.56 0.00 0.00 36.38 34.89 3d3u s VAL 370 CO 0.01 -0.28 1.82 1.55 -0.31 0.00 0.00 175.10 177.89 3d3u h PRO 371 N 2.97 0.82 -3.40 4.82 0.13 -1.92 0.21 132.00 135.63 3d3u h PRO 371 Ca -0.43 -0.05 -0.40 0.00 -0.87 0.00 0.00 66.00 64.25 3d3u h PRO 371 Cb 1.22 -0.18 -0.39 0.00 0.13 0.00 0.00 31.00 31.78 3d3u h PRO 371 CO 0.53 0.54 -0.75 -1.50 -0.23 0.00 0.00 178.00 176.59 3d3u s ILE 372 N -6.04 0.05 0.27 -3.56 1.10 -1.26 -3.94 121.20 107.81 3d3u s ILE 372 Ca -0.12 0.24 -0.23 0.00 -0.51 0.00 0.00 60.65 60.03 3d3u s ILE 372 Cb 0.19 -0.33 -0.09 0.00 0.15 0.00 0.00 42.46 42.38 3d3u s ILE 372 CO 0.78 0.14 0.83 -0.76 -2.11 0.00 0.00 174.94 173.82 3d3u s LEU 373 N 2.10 4.35 -0.26 8.50 1.43 -1.26 -5.03 118.68 128.51 3d3u s LEU 373 Ca 0.04 1.62 -0.01 0.00 -1.03 0.00 0.00 54.13 54.75 3d3u s LEU 373 Cb -0.13 -3.78 0.16 0.00 0.03 0.00 0.00 46.19 42.47 3d3u s LEU 373 CO -0.04 -0.01 2.08 2.29 0.23 0.00 0.00 176.35 180.90 3d3u n LYS 374 N 0.68 1.68 -1.22 1.70 2.85 -1.26 -5.17 118.16 117.41 3d3u n LYS 374 Ca -0.00 -1.28 0.00 0.00 -1.05 0.00 0.00 58.31 55.97 3d3u n LYS 374 Cb 0.51 -1.52 0.00 0.00 -0.65 0.00 0.00 35.03 33.36 3d3u n LYS 374 CO 0.00 0.00 0.00 -2.37 -0.05 0.00 0.00 177.40 174.98 3d3u n THR 381 N 0.64 0.00 -1.53 0.58 5.66 -1.26 -5.25 114.28 113.12 3d3u n THR 381 Ca 0.25 0.00 -0.40 0.00 -3.05 0.00 0.00 64.05 60.86 3d3u n THR 381 Cb 0.57 -0.34 0.03 0.00 -1.55 0.00 0.00 70.33 69.03 3d3u n THR 381 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 3d3u n GLY 382 N -1.35 -0.94 0.23 1.09 0.00 -1.26 -4.27 105.19 98.69 3d3u n GLY 382 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.98 3d3u n GLY 382 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 3d3u n ARG 383 N -0.05 -0.13 0.00 1.61 0.00 -1.24 -3.95 116.66 112.90 3d3u n ARG 383 Ca 0.11 0.94 0.00 0.00 -0.00 0.00 0.00 57.85 58.91 3d3u n ARG 383 Cb 0.44 -1.40 0.00 0.00 -0.00 0.00 0.00 32.46 31.49 3d3u n ARG 383 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.63 177.90 3d3u n ASN 384 N -4.92 0.00 0.00 2.89 0.23 -1.26 -2.97 115.26 109.23 3d3u n ASN 384 Ca 0.07 -0.19 0.00 0.00 -0.53 0.00 0.00 54.58 53.93 3d3u n ASN 384 Cb 0.26 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 37.96 3d3u n ASN 384 CO 0.00 0.00 0.00 -0.62 -0.93 0.00 0.00 177.26 175.71 3d3u n GLU 385 N 1.27 0.00 -4.02 -3.83 4.71 -1.25 -5.13 120.64 112.39 3d3u n GLU 385 Ca 0.00 0.00 -0.31 0.00 -0.01 0.00 0.00 57.16 56.84 3d3u n GLU 385 Cb 0.00 0.00 -0.06 0.00 -1.01 0.00 0.00 31.44 30.37 3d3u n GLU 385 CO 0.00 0.00 0.00 0.08 0.09 0.00 0.00 177.13 177.30 3d3u s VAL 386 N -0.93 4.83 -0.20 2.62 1.01 -1.16 -4.91 120.40 121.66 3d3u s VAL 386 Ca 0.00 -0.57 0.08 0.00 0.00 0.00 0.00 61.98 61.49 3d3u s VAL 386 Cb 0.00 -3.31 -0.18 0.00 0.00 0.00 0.00 36.38 32.90 3d3u s VAL 386 CO 0.00 0.18 -0.08 0.47 0.00 0.00 0.00 175.10 175.68 3d3u n ASP 387 N 0.59 1.54 -4.25 3.32 8.00 -1.02 -3.83 116.55 120.89 3d3u n ASP 387 Ca -0.09 -0.07 -0.16 0.00 0.71 0.00 0.00 54.79 55.19 3d3u n ASP 387 Cb 0.52 0.24 -0.10 0.00 -0.02 0.00 0.00 41.12 41.75 3d3u n ASP 387 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 3d3u s TYR 388 N -2.44 1.35 -0.01 1.24 1.51 -0.92 -0.38 117.35 117.70 3d3u s TYR 388 Ca -0.20 -0.66 -0.00 0.00 -1.01 0.00 0.00 57.07 55.19 3d3u s TYR 388 Cb 0.07 -0.68 0.02 0.00 -0.11 0.00 0.00 41.96 41.25 3d3u s TYR 388 CO 0.61 0.13 0.03 0.08 -1.11 0.00 0.00 175.55 175.29 3d3u s VAL 389 N -2.84 -0.03 -0.02 0.71 1.01 -0.78 -1.95 120.40 116.49 3d3u s VAL 389 Ca 0.14 0.13 0.03 0.00 0.00 0.00 0.00 61.98 62.27 3d3u s VAL 389 Cb -0.01 -0.06 0.00 0.00 0.00 0.00 0.00 36.38 36.31 3d3u s VAL 389 CO 0.02 0.05 -0.09 -0.69 0.00 0.00 0.00 175.10 174.39 3d3u s VAL 390 N 0.64 0.78 0.18 2.92 1.01 -0.76 -0.54 120.40 124.64 3d3u s VAL 390 Ca -0.05 -0.37 0.02 0.00 0.00 0.00 0.00 61.98 61.58 3d3u s VAL 390 Cb -0.08 -0.69 -0.05 0.00 0.00 0.00 0.00 36.38 35.57 3d3u s VAL 390 CO -0.02 0.24 0.00 -0.89 0.00 0.00 0.00 175.10 174.44 3d3u s THR 391 N 0.14 0.70 0.64 3.92 2.01 -0.41 -2.13 115.64 120.51 3d3u s THR 391 Ca -0.02 -1.99 0.05 0.00 0.31 0.00 0.00 61.69 60.05 3d3u s THR 391 Cb -0.08 -2.16 0.05 0.00 0.01 0.00 0.00 72.50 70.33 3d3u s THR 391 CO 0.00 -0.44 1.15 1.05 -0.69 0.00 0.00 174.62 175.70 3d3u h GLU 392 N 2.66 0.00 -0.17 4.92 9.09 -1.85 0.48 114.58 129.71 3d3u h GLU 392 Ca -0.37 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.04 3d3u h GLU 392 Cb 1.21 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.31 3d3u h GLU 392 CO 0.63 0.00 0.00 0.66 0.05 0.00 0.00 179.01 180.35 3d3u n TYR 393 N -2.53 0.19 0.00 2.06 4.01 -1.26 -4.82 117.16 114.82 3d3u n TYR 393 Ca -0.00 -0.10 0.00 0.00 -0.16 0.00 0.00 57.90 57.64 3d3u n TYR 393 Cb 0.87 -0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.90 3d3u n TYR 393 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3d3u n GLY 394 N 1.36 0.75 3.77 2.72 0.00 0.17 -4.75 105.19 109.21 3d3u n GLY 394 Ca 0.16 -2.07 -0.29 0.00 0.00 0.00 0.00 46.02 43.82 3d3u n GLY 394 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3d3u s VAL 395 N -1.53 4.42 -0.04 1.61 1.01 -1.26 -1.28 120.40 123.32 3d3u s VAL 395 Ca 0.00 -0.93 -0.02 0.00 0.00 0.00 0.00 61.98 61.03 3d3u s VAL 395 Cb 0.00 -3.18 0.03 0.00 0.00 0.00 0.00 36.38 33.23 3d3u s VAL 395 CO 0.00 0.03 0.04 0.00 0.00 0.00 0.00 175.10 175.18 3d3u s ALA 396 N -1.52 0.30 -0.10 5.51 0.00 0.30 -4.83 121.76 121.42 3d3u s ALA 396 Ca 0.29 0.15 -0.24 0.00 0.00 0.00 0.00 51.96 52.16 3d3u s ALA 396 Cb -0.11 -0.58 -0.03 0.00 0.00 0.00 0.00 23.12 22.39 3d3u s ALA 396 CO 0.22 -0.42 0.72 0.50 0.00 0.00 0.00 175.76 176.79 3d3u s ARG 397 N 1.94 4.38 -0.16 0.00 3.52 -1.26 -1.87 118.95 125.51 3d3u s ARG 397 Ca 0.03 0.89 -0.09 0.00 -0.13 0.00 0.00 55.73 56.42 3d3u s ARG 397 Cb -0.12 -3.49 -0.07 0.00 -1.56 0.00 0.00 34.95 29.71 3d3u s ARG 397 CO -0.03 -0.06 -0.22 1.28 -0.81 0.00 0.00 175.30 175.46 3d3u n LEU 398 N 4.25 1.28 -4.68 -0.88 4.77 0.49 -4.80 117.00 117.42 3d3u n LEU 398 Ca 0.00 0.22 -0.58 0.00 -0.03 0.00 0.00 56.01 55.62 3d3u n LEU 398 Cb 0.51 -0.52 -0.07 0.00 -2.33 0.00 0.00 43.42 41.00 3d3u n LEU 398 CO 0.47 0.22 1.17 -1.14 -1.33 0.00 0.00 177.39 176.78 3d3u n ARG 399 N -3.82 0.94 -2.11 3.23 0.00 -1.16 -0.91 116.66 112.83 3d3u n ARG 399 Ca -0.30 0.34 0.00 0.00 -0.00 0.00 0.00 57.85 57.89 3d3u n ARG 399 Cb 0.67 -1.98 0.00 0.00 0.00 0.00 0.00 32.46 31.15 3d3u n ARG 399 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 3d3u n GLY 400 N 3.67 0.74 3.30 5.14 0.00 -1.26 -5.08 105.19 111.69 3d3u n GLY 400 Ca 0.25 -0.72 -0.30 0.00 0.00 0.00 0.00 46.02 45.24 3d3u n GLY 400 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3d3u s ALA 401 N -2.50 2.11 0.60 4.61 0.00 -0.09 -5.10 121.76 121.40 3d3u s ALA 401 Ca 0.00 -1.11 -0.19 0.00 0.00 0.00 0.00 51.96 50.66 3d3u s ALA 401 Cb 0.00 -0.52 -0.03 0.00 0.00 0.00 0.00 23.12 22.56 3d3u s ALA 401 CO 0.00 0.52 1.22 0.95 0.00 0.00 0.00 175.76 178.44 3d3u s THR 402 N -0.62 2.56 0.05 0.00 -4.23 -1.26 -4.77 115.64 107.36 3d3u s THR 402 Ca 0.10 0.35 -0.03 0.00 -1.18 0.00 0.00 61.69 60.93 3d3u s THR 402 Cb -0.10 -3.14 0.06 0.00 1.34 0.00 0.00 72.50 70.66 3d3u s THR 402 CO -0.01 -0.07 0.29 0.18 -0.54 0.00 0.00 174.62 174.47 3d3u n LEU 403 N -1.61 -0.11 -0.06 4.79 4.77 -1.26 -1.65 117.00 121.86 3d3u n LEU 403 Ca 0.14 0.33 -0.12 0.00 -0.03 0.00 0.00 56.01 56.33 3d3u n LEU 403 Cb 0.49 -0.08 0.01 0.00 -2.33 0.00 0.00 43.42 41.51 3d3u n LEU 403 CO 0.45 -0.30 0.52 0.08 -1.33 0.00 0.00 177.39 176.80 3d3u h ARG 404 N 0.00 0.78 0.13 3.23 -0.00 -1.95 -2.95 114.38 113.62 3d3u h ARG 404 Ca 0.07 -0.44 -0.01 0.00 -0.00 0.00 0.00 59.98 59.60 3d3u h ARG 404 Cb 0.12 0.03 0.00 0.00 -0.00 0.00 0.00 29.97 30.12 3d3u h ARG 404 CO -0.19 1.07 -0.06 1.96 -0.00 0.00 0.00 179.97 182.75 3d3u h GLN 405 N 0.62 -0.16 -0.55 0.08 4.20 -1.67 -2.97 115.11 114.67 3d3u h GLN 405 Ca 0.04 0.01 0.11 0.00 0.06 0.00 0.00 58.65 58.87 3d3u h GLN 405 Cb 1.03 0.04 -0.09 0.00 0.30 0.00 0.00 27.48 28.76 3d3u h GLN 405 CO 0.10 0.11 0.01 0.00 -0.67 0.00 0.00 178.83 178.38 3d3u h ARG 406 N -0.44 0.12 -0.68 1.46 3.08 -1.51 0.70 114.38 117.12 3d3u h ARG 406 Ca -0.02 -0.01 0.07 0.00 0.07 0.00 0.00 59.98 60.09 3d3u h ARG 406 Cb 0.35 -0.03 -0.10 0.00 0.08 0.00 0.00 29.97 30.28 3d3u h ARG 406 CO 0.03 0.08 -0.55 0.00 -1.07 0.00 0.00 179.97 178.46 3d3u h ALA 407 N 1.49 -0.64 0.00 0.04 0.00 -1.36 -2.61 119.26 116.18 3d3u h ALA 407 Ca 0.28 0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.25 3d3u h ALA 407 Cb 0.43 1.24 0.00 0.00 0.00 0.00 0.00 17.79 19.46 3d3u h ALA 407 CO -0.45 -0.97 -0.83 -0.85 0.00 0.00 0.00 179.25 176.14 3d3u n GLU 408 N -5.20 0.13 0.08 0.00 0.00 -0.34 -2.26 120.64 113.04 3d3u n GLU 408 Ca -0.01 -0.00 -0.04 0.00 0.00 0.00 0.00 57.16 57.11 3d3u n GLU 408 Cb 0.29 -1.54 -0.08 0.00 0.00 0.00 0.00 31.44 30.10 3d3u n GLU 408 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 3d3u h ALA 409 N 2.80 0.47 0.04 -1.84 0.00 0.41 -2.07 119.26 119.07 3d3u h ALA 409 Ca 0.00 -0.81 -0.00 0.00 0.00 0.00 0.00 54.91 54.10 3d3u h ALA 409 Cb 0.60 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.30 3d3u h ALA 409 CO 0.00 1.08 -0.02 -0.07 0.00 0.00 0.00 179.25 180.24 3d3u h LEU 410 N 0.00 -0.05 -1.55 0.00 -0.00 -1.50 -3.22 115.31 108.99 3d3u h LEU 410 Ca -0.03 -0.50 0.19 0.00 -0.00 0.00 0.00 57.88 57.54 3d3u h LEU 410 Cb 1.67 0.01 -0.06 0.00 -0.00 0.00 0.00 40.66 42.28 3d3u h LEU 410 CO 0.11 0.49 0.57 0.74 -0.00 0.00 0.00 178.44 180.35 3d3u h THR 411 N -0.62 0.71 -0.23 0.22 2.02 -1.22 0.96 112.91 114.75 3d3u h THR 411 Ca -0.01 -0.13 -0.02 0.00 0.77 0.00 0.00 66.41 67.02 3d3u h THR 411 Cb 0.55 0.28 -0.01 0.00 -1.74 0.00 0.00 68.15 67.23 3d3u h THR 411 CO 0.01 0.07 0.07 0.00 0.37 0.00 0.00 175.52 176.04 3d3u h ALA 412 N 1.62 1.69 -0.13 6.16 0.00 -1.39 -2.91 119.26 124.29 3d3u h ALA 412 Ca 0.44 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.26 3d3u h ALA 412 Cb 1.09 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.77 3d3u h ALA 412 CO -0.15 0.25 0.00 0.44 0.00 0.00 0.00 179.25 179.79 3d3u n ILE 413 N -4.41 0.15 -0.64 0.00 -5.35 0.33 -4.92 119.36 104.51 3d3u n ILE 413 Ca 0.00 -0.55 -0.30 0.00 -0.27 0.00 0.00 62.75 61.64 3d3u n ILE 413 Cb 0.14 1.27 0.21 0.00 -1.74 0.00 0.00 39.64 39.53 3d3u n ILE 413 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 3d3u s ALA 414 N -1.85 0.47 0.44 -1.28 0.00 -0.86 -4.14 121.76 114.55 3d3u s ALA 414 Ca 0.32 0.20 -0.24 0.00 0.00 0.00 0.00 51.96 52.24 3d3u s ALA 414 Cb 0.21 -3.34 -0.08 0.00 0.00 0.00 0.00 23.12 19.91 3d3u s ALA 414 CO 0.31 -3.30 1.27 -1.58 0.00 0.00 0.00 175.76 172.45 3d3u s HIS 415 N -2.56 2.74 0.42 0.00 2.46 -1.26 -4.81 115.29 112.28 3d3u s HIS 415 Ca 0.67 1.44 0.16 0.00 0.47 0.00 0.00 55.06 57.81 3d3u s HIS 415 Cb -0.24 -3.61 1.06 0.00 -0.13 0.00 0.00 32.58 29.66 3d3u s HIS 415 CO 0.61 -2.06 1.89 -1.35 -2.47 0.00 0.00 174.74 171.36 3d3u h PRO 416 N 2.29 0.41 -0.59 2.88 0.11 -1.93 -2.15 132.00 133.02 3d3u h PRO 416 Ca -0.50 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.59 3d3u h PRO 416 Cb 1.26 -0.09 -0.03 0.00 0.11 0.00 0.00 31.00 32.24 3d3u h PRO 416 CO 0.61 0.27 0.36 -0.44 -0.21 0.00 0.00 178.00 178.59 3d3u h ASP 417 N 0.42 0.70 1.07 -2.05 3.32 -1.98 -3.17 116.42 114.74 3d3u h ASP 417 Ca 0.42 -0.05 -0.14 0.00 0.02 0.00 0.00 57.03 57.28 3d3u h ASP 417 Cb 1.00 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 40.36 3d3u h ASP 417 CO -0.15 0.55 -0.66 -0.26 -1.72 0.00 0.00 179.24 177.00 3d3u h PHE 418 N 0.80 0.00 -0.81 4.55 0.05 -1.85 -3.36 116.94 116.32 3d3u h PHE 418 Ca 0.21 0.00 0.19 0.00 3.82 0.00 0.00 57.97 62.20 3d3u h PHE 418 Cb -0.03 0.00 -0.12 0.00 2.00 0.00 0.00 35.95 37.80 3d3u h PHE 418 CO -0.02 0.66 0.22 0.00 -0.18 0.00 0.00 178.31 178.99 3d3u h ARG 419 N 0.00 0.25 -0.09 1.51 3.08 -1.37 0.19 114.38 117.96 3d3u h ARG 419 Ca -0.01 -0.02 -0.14 0.00 0.07 0.00 0.00 59.98 59.89 3d3u h ARG 419 Cb 1.38 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 31.36 3d3u h ARG 419 CO 0.09 0.17 -0.55 -1.00 -1.07 0.00 0.00 179.97 177.61 3d3u h PRO 420 N 0.26 0.26 0.38 0.04 0.13 -1.76 0.28 132.00 131.58 3d3u h PRO 420 Ca 0.48 -0.16 -0.02 0.00 -0.87 0.00 0.00 66.00 65.43 3d3u h PRO 420 Cb 0.89 0.02 0.00 0.00 0.13 0.00 0.00 31.00 32.04 3d3u h PRO 420 CO -0.57 0.74 -0.18 0.00 -0.23 0.00 0.00 178.00 177.76 3d3u h ALA 421 N 1.23 -0.50 -0.96 -0.56 0.00 -1.53 -0.86 119.26 116.08 3d3u h ALA 421 Ca 0.00 -0.12 0.16 0.00 0.00 0.00 0.00 54.91 54.96 3d3u h ALA 421 Cb 1.03 0.19 -0.10 0.00 0.00 0.00 0.00 17.79 18.91 3d3u h ALA 421 CO 0.09 -0.77 0.57 -0.07 0.00 0.00 0.00 179.25 179.06 3d3u h LEU 422 N -0.53 0.75 -0.46 0.00 3.38 -0.60 -1.88 115.31 115.98 3d3u h LEU 422 Ca -0.05 0.08 -0.17 0.00 0.09 0.00 0.00 57.88 57.83 3d3u h LEU 422 Cb 0.40 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 3d3u h LEU 422 CO 0.08 0.31 -0.76 -0.08 0.09 0.00 0.00 178.44 178.09 3d3u h GLU 423 N 0.78 0.16 -0.56 1.13 4.57 -0.30 -2.63 114.58 117.73 3d3u h GLU 423 Ca 0.53 -0.14 0.08 0.00 -1.18 0.00 0.00 59.36 58.64 3d3u h GLU 423 Cb 0.73 0.03 -0.06 0.00 -0.16 0.00 0.00 28.75 29.29 3d3u h GLU 423 CO -0.35 0.84 0.21 1.49 -1.18 0.00 0.00 179.01 180.02 3d3u h GLU 424 N 0.10 0.38 -0.38 1.92 4.57 -0.35 -2.80 114.58 118.01 3d3u h GLU 424 Ca -0.02 -0.02 -0.02 0.00 -1.18 0.00 0.00 59.36 58.12 3d3u h GLU 424 Cb 1.33 -0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 29.82 3d3u h GLU 424 CO 0.11 0.25 0.17 1.49 -1.18 0.00 0.00 179.01 179.86 3d3u h GLU 425 N 0.39 0.56 -0.62 1.92 4.57 -1.07 -2.67 114.58 117.66 3d3u h GLU 425 Ca 0.27 -0.09 0.09 0.00 -1.18 0.00 0.00 59.36 58.45 3d3u h GLU 425 Cb 0.31 -0.10 -0.07 0.00 -0.16 0.00 0.00 28.75 28.73 3d3u h GLU 425 CO -0.27 0.51 0.26 0.82 -1.18 0.00 0.00 179.01 179.15 3d3u h ILE 426 N 0.48 0.81 -0.49 2.32 2.04 -1.47 -1.99 117.51 119.21 3d3u h ILE 426 Ca 0.13 -0.16 0.06 0.00 1.00 0.00 0.00 64.86 65.90 3d3u h ILE 426 Cb 0.15 0.31 -0.05 0.00 -0.74 0.00 0.00 36.82 36.48 3d3u h ILE 426 CO -0.01 0.08 0.18 0.03 0.00 0.00 0.00 178.15 178.42 3d3u h ARG 427 N 0.46 0.34 -3.43 2.37 2.47 -1.21 -2.83 114.38 112.55 3d3u h ARG 427 Ca 0.31 -0.02 -0.67 0.00 -1.26 0.00 0.00 59.98 58.33 3d3u h ARG 427 Cb 0.35 -0.08 0.00 0.00 -1.65 0.00 0.00 29.97 28.60 3d3u h ARG 427 CO -0.28 0.23 3.51 2.89 0.56 0.00 0.00 179.97 186.88 3d3u n ARG 428 N -5.00 3.28 0.00 0.04 -4.01 -0.75 -1.45 116.66 108.77 3d3u n ARG 428 Ca 0.05 -2.32 0.00 0.00 -1.04 0.00 0.00 57.85 54.54 3d3u n ARG 428 Cb 0.19 -2.97 0.00 0.00 -3.04 0.00 0.00 32.46 26.64 3d3u n ARG 428 CO 0.00 0.00 0.00 0.54 -3.04 0.00 0.00 177.63 175.13 3d3u n ARG 429 N 4.63 0.00 0.00 2.89 3.00 -1.07 -4.97 116.66 121.14 3d3u n ARG 429 Ca 0.67 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 58.51 3d3u n ARG 429 Cb 0.29 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.75 3d3u n ARG 429 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.63 178.82