#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k4w s LYS 2 N 0.00 3.70 -0.10 1.96 2.20 -1.26 -4.96 119.74 121.27 3k4w s LYS 2 Ca 0.00 -0.35 0.03 0.00 -0.36 0.00 0.00 55.97 55.29 3k4w s LYS 2 Cb 0.00 -3.10 -0.00 0.00 -1.51 0.00 0.00 37.83 33.22 3k4w s LYS 2 CO 0.00 0.41 -0.22 0.42 -0.36 0.00 0.00 175.35 175.60 3k4w s ILE 3 N -0.03 2.19 -0.33 5.43 1.01 -1.24 -4.28 121.20 123.94 3k4w s ILE 3 Ca 0.06 -0.97 -0.09 0.00 0.00 0.00 0.00 60.65 59.64 3k4w s ILE 3 Cb -0.12 -1.85 0.01 0.00 0.01 0.00 0.00 42.46 40.51 3k4w s ILE 3 CO 0.01 0.55 0.15 -0.63 0.00 0.00 0.00 174.94 175.03 3k4w s ILE 4 N 0.35 4.38 -0.37 2.92 1.01 -0.56 -0.02 121.20 128.92 3k4w s ILE 4 Ca -0.18 -0.71 -0.29 0.00 0.00 0.00 0.00 60.65 59.47 3k4w s ILE 4 Cb -0.18 -3.35 0.02 0.00 0.01 0.00 0.00 42.46 38.97 3k4w s ILE 4 CO 0.08 -0.07 1.09 -0.62 0.00 0.00 0.00 174.94 175.43 3k4w s ASP 5 N 1.55 6.84 0.00 3.58 -1.08 0.13 -4.67 116.67 123.01 3k4w s ASP 5 Ca 0.03 0.87 0.22 0.00 -0.52 0.00 0.00 52.55 53.14 3k4w s ASP 5 Cb -0.18 -2.54 1.32 0.00 -1.46 0.00 0.00 42.92 40.05 3k4w s ASP 5 CO 0.05 -1.00 1.73 0.33 0.52 0.00 0.00 175.17 176.80 3k4w n PHE 6 N 7.17 0.00 -3.24 -5.34 7.35 -0.24 -0.17 117.46 122.99 3k4w n PHE 6 Ca 0.12 0.00 -0.03 0.00 -0.76 0.00 0.00 57.45 56.78 3k4w n PHE 6 Cb 0.48 0.00 -0.03 0.00 0.35 0.00 0.00 39.48 40.28 3k4w n PHE 6 CO 0.00 0.00 0.00 0.50 -0.76 0.00 0.00 176.76 176.50 3k4w s ARG 7 N -2.00 0.66 -0.04 -4.13 3.52 -1.25 -4.63 118.95 111.07 3k4w s ARG 7 Ca 0.33 -0.11 -0.02 0.00 -0.13 0.00 0.00 55.73 55.80 3k4w s ARG 7 Cb 0.15 -0.08 0.03 0.00 -1.56 0.00 0.00 34.95 33.49 3k4w s ARG 7 CO 0.26 -1.13 0.07 -1.17 -0.81 0.00 0.00 175.30 172.52 3k4w s LEU 8 N 2.12 0.44 -0.33 -0.88 0.20 -0.62 -1.61 118.68 118.00 3k4w s LEU 8 Ca 0.14 0.13 0.01 0.00 0.69 0.00 0.00 54.13 55.10 3k4w s LEU 8 Cb -0.09 -0.01 0.08 0.00 -0.43 0.00 0.00 46.19 45.75 3k4w s LEU 8 CO -0.15 -0.20 0.03 -0.13 -0.29 0.00 0.00 176.35 175.61 3k4w s ARG 9 N 1.77 1.95 0.56 1.98 3.00 -0.05 -4.07 118.95 124.09 3k4w s ARG 9 Ca -0.01 -1.62 -0.15 0.00 0.00 0.00 0.00 55.73 53.95 3k4w s ARG 9 Cb -0.12 -3.21 -0.06 0.00 0.00 0.00 0.00 34.95 31.56 3k4w s ARG 9 CO -0.04 -0.82 1.00 -1.25 0.00 0.00 0.00 175.30 174.20 3k4w s PRO 10 N 1.07 3.78 -1.50 3.54 0.04 -1.26 -4.18 135.00 136.49 3k4w s PRO 10 Ca 0.03 0.90 -0.11 0.00 0.04 0.00 0.00 61.00 61.86 3k4w s PRO 10 Cb -0.20 -2.11 0.00 0.00 0.04 0.00 0.00 34.50 32.23 3k4w s PRO 10 CO -0.05 -0.41 2.54 -0.35 0.04 0.00 0.00 177.00 178.76 3k4w n PRO 11 N -2.01 3.47 -3.98 0.56 -0.04 -1.26 -4.66 135.00 127.08 3k4w n PRO 11 Ca 0.07 -2.60 -0.09 0.00 -0.04 0.00 0.00 63.50 60.84 3k4w n PRO 11 Cb 0.54 -2.98 -0.10 0.00 -0.04 0.00 0.00 33.50 30.92 3k4w n PRO 11 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3k4w s ALA 12 N 2.05 0.11 0.00 0.55 0.00 -1.26 -4.14 121.76 119.06 3k4w s ALA 12 Ca 0.57 -0.64 0.00 0.00 0.00 0.00 0.00 51.96 51.89 3k4w s ALA 12 Cb 0.16 0.18 0.00 0.00 0.00 0.00 0.00 23.12 23.46 3k4w s ALA 12 CO -0.07 -0.22 0.00 -1.33 0.00 0.00 0.00 175.76 174.14 3k4w n MET 13 N 1.21 0.00 0.24 0.00 2.81 -1.26 -1.50 117.12 118.61 3k4w n MET 13 Ca -0.21 0.00 0.07 0.00 -1.81 0.00 0.00 57.70 55.75 3k4w n MET 13 Cb 0.57 0.00 0.57 0.00 -0.71 0.00 0.00 33.22 33.64 3k4w n MET 13 CO 0.00 0.00 0.00 0.78 1.51 0.00 0.00 175.97 178.26 3k4w h GLY 14 N 0.00 0.00 1.40 3.03 0.00 -1.94 -2.55 103.07 103.01 3k4w h GLY 14 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.33 3k4w h GLY 14 CO 0.00 0.00 0.35 0.74 0.00 0.00 0.00 176.54 177.63 3k4w h PHE 15 N 0.00 0.77 0.00 5.60 0.04 -1.56 -2.18 116.94 119.62 3k4w h PHE 15 Ca -0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 3k4w h PHE 15 Cb 0.30 -0.26 0.00 0.00 2.20 0.00 0.00 35.95 38.19 3k4w h PHE 15 CO 0.00 0.52 0.12 1.28 -0.60 0.00 0.00 178.31 179.63 3k4w n LEU 16 N -4.41 0.02 0.00 1.54 4.77 -0.96 -1.70 117.00 116.26 3k4w n LEU 16 Ca 0.06 0.40 0.11 0.00 -0.03 0.00 0.00 56.01 56.54 3k4w n LEU 16 Cb 0.08 -0.40 -0.04 0.00 -2.33 0.00 0.00 43.42 40.73 3k4w n LEU 16 CO 0.37 -0.40 0.03 0.59 -1.33 0.00 0.00 177.39 176.65 3k4w n ASN 17 N -1.42 0.84 -4.79 -1.43 3.02 -0.82 -4.39 115.26 106.26 3k4w n ASN 17 Ca -0.00 -0.77 -0.31 0.00 -0.03 0.00 0.00 54.58 53.47 3k4w n ASN 17 Cb 0.12 0.87 0.07 0.00 -0.61 0.00 0.00 39.78 40.23 3k4w n ASN 17 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3k4w s ALA 18 N -3.03 2.43 -1.12 5.41 0.00 -0.69 -4.20 121.76 120.57 3k4w s ALA 18 Ca 0.08 0.13 0.12 0.00 0.00 0.00 0.00 51.96 52.29 3k4w s ALA 18 Cb 0.16 -3.21 0.55 0.00 0.00 0.00 0.00 23.12 20.62 3k4w s ALA 18 CO 0.83 -1.52 1.36 -2.13 0.00 0.00 0.00 175.76 174.30 3k4w n ARG 19 N -3.34 0.05 0.20 0.00 0.63 -0.99 -0.67 116.66 112.54 3k4w n ARG 19 Ca 0.08 0.26 0.11 0.00 -0.92 0.00 0.00 57.85 57.38 3k4w n ARG 19 Cb 0.54 -1.50 0.14 0.00 0.45 0.00 0.00 32.46 32.08 3k4w n ARG 19 CO 0.00 0.00 0.00 -0.84 -2.51 0.00 0.00 177.63 174.28 3k4w h ILE 20 N 0.00 0.05 0.00 5.15 3.07 -1.87 -2.76 117.51 121.14 3k4w h ILE 20 Ca 0.00 -1.08 0.00 0.00 1.55 0.00 0.00 64.86 65.33 3k4w h ILE 20 Cb 0.18 1.95 0.00 0.00 -0.27 0.00 0.00 36.82 38.69 3k4w h ILE 20 CO 0.00 0.03 -1.26 -1.22 -1.05 0.00 0.00 178.15 174.65 3k4w n TYR 21 N -3.05 0.00 0.08 0.16 4.01 -0.88 -4.64 117.16 112.85 3k4w n TYR 21 Ca 0.03 0.00 0.10 0.00 -0.16 0.00 0.00 57.90 57.88 3k4w n TYR 21 Cb 0.55 -0.17 -0.04 0.00 -0.31 0.00 0.00 39.34 39.37 3k4w n TYR 21 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 3k4w n THR 22 N -1.72 0.55 -3.56 -0.72 -2.24 0.16 -4.40 114.28 102.35 3k4w n THR 22 Ca -0.01 -0.55 -0.29 0.00 -2.27 0.00 0.00 64.05 60.93 3k4w n THR 22 Cb 0.20 -0.30 -0.09 0.00 -2.10 0.00 0.00 70.33 68.05 3k4w n THR 22 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3k4w n ARG 23 N -2.61 2.46 0.01 -0.78 5.12 -1.04 -4.91 116.66 114.90 3k4w n ARG 23 Ca -0.02 -4.60 0.14 0.00 -1.93 0.00 0.00 57.85 51.45 3k4w n ARG 23 Cb 0.58 -2.30 0.60 0.00 -1.16 0.00 0.00 32.46 30.18 3k4w n ARG 23 CO 0.00 0.00 0.00 -1.35 -1.93 0.00 0.00 177.63 174.35 3k4w h PRO 24 N 4.76 0.18 -0.12 5.56 0.11 -1.82 -2.06 132.00 138.61 3k4w h PRO 24 Ca 0.18 -0.01 -0.15 0.00 0.11 0.00 0.00 66.00 66.13 3k4w h PRO 24 Cb 0.70 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 31.76 3k4w h PRO 24 CO 0.84 0.12 -0.58 0.38 -0.21 0.00 0.00 178.00 178.55 3k4w h ASP 25 N 0.18 0.44 -0.07 -2.05 2.03 -1.95 0.15 116.42 115.16 3k4w h ASP 25 Ca 0.22 -0.24 -0.04 0.00 -0.73 0.00 0.00 57.03 56.24 3k4w h ASP 25 Cb 0.63 -0.13 -0.00 0.00 -0.83 0.00 0.00 39.33 39.01 3k4w h ASP 25 CO -0.04 0.92 -0.10 0.40 -1.03 0.00 0.00 179.24 179.40 3k4w h ILE 26 N 0.30 1.39 -0.23 4.15 2.04 -1.76 -3.10 117.51 120.31 3k4w h ILE 26 Ca -0.00 -1.34 0.05 0.00 1.00 0.00 0.00 64.86 64.58 3k4w h ILE 26 Cb 1.10 2.13 -0.07 0.00 -0.74 0.00 0.00 36.82 39.23 3k4w h ILE 26 CO 0.10 0.37 -0.40 -0.09 0.00 0.00 0.00 178.15 178.13 3k4w h ARG 27 N -0.28 -0.40 -0.58 2.37 2.43 -1.17 -2.32 114.38 114.44 3k4w h ARG 27 Ca 0.01 0.03 0.07 0.00 -0.81 0.00 0.00 59.98 59.27 3k4w h ARG 27 Cb 0.65 0.09 -0.03 0.00 -0.42 0.00 0.00 29.97 30.25 3k4w h ARG 27 CO 0.02 -0.26 0.38 -0.91 -1.51 0.00 0.00 179.97 177.69 3k4w h ASN 28 N -0.41 0.45 0.07 -3.80 2.35 -1.08 0.13 115.58 113.29 3k4w h ASN 28 Ca 0.10 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.86 3k4w h ASN 28 Cb 0.60 -0.09 -0.00 0.00 0.05 0.00 0.00 38.32 38.87 3k4w h ASN 28 CO -0.45 0.29 -0.05 -0.09 -1.65 0.00 0.00 177.43 175.48 3k4w h ARG 29 N 0.51 -0.12 -0.93 0.81 2.43 -1.34 -0.89 114.38 114.85 3k4w h ARG 29 Ca 0.25 0.01 0.05 0.00 -0.81 0.00 0.00 59.98 59.48 3k4w h ARG 29 Cb 0.35 0.03 -0.06 0.00 -0.42 0.00 0.00 29.97 29.86 3k4w h ARG 29 CO -0.07 -0.08 0.60 0.74 -1.51 0.00 0.00 179.97 179.65 3k4w h PHE 30 N -0.12 1.12 0.10 2.20 0.04 -0.49 0.42 116.94 120.21 3k4w h PHE 30 Ca -0.00 0.03 -0.00 0.00 2.80 0.00 0.00 57.97 60.79 3k4w h PHE 30 Cb 0.11 -0.37 0.00 0.00 2.20 0.00 0.00 35.95 37.89 3k4w h PHE 30 CO -0.09 0.61 -0.05 1.15 -0.60 0.00 0.00 178.31 179.34 3k4w h THR 31 N 1.13 1.05 -0.49 -1.55 2.02 -0.89 -1.31 112.91 112.87 3k4w h THR 31 Ca 0.39 -0.56 -0.11 0.00 0.77 0.00 0.00 66.41 66.90 3k4w h THR 31 Cb 0.08 1.40 -0.02 0.00 -1.74 0.00 0.00 68.15 67.87 3k4w h THR 31 CO -0.14 0.14 -0.12 0.03 0.37 0.00 0.00 175.52 175.79 3k4w h ARG 32 N -0.39 0.91 -0.46 6.66 3.08 -1.13 -0.46 114.38 122.58 3k4w h ARG 32 Ca -0.01 -0.32 0.06 0.00 0.07 0.00 0.00 59.98 59.77 3k4w h ARG 32 Cb 0.33 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.29 3k4w h ARG 32 CO 0.02 0.97 0.31 0.37 -1.07 0.00 0.00 179.97 180.58 3k4w h GLN 33 N 0.81 0.38 0.00 0.04 4.15 -0.84 0.53 115.11 120.18 3k4w h GLN 33 Ca 0.13 -0.02 -0.01 0.00 0.77 0.00 0.00 58.65 59.51 3k4w h GLN 33 Cb 0.65 -0.09 -0.00 0.00 0.21 0.00 0.00 27.48 28.25 3k4w h GLN 33 CO 0.04 0.25 -0.06 -0.07 -1.93 0.00 0.00 178.83 177.07 3k4w h LEU 34 N 0.40 0.00 0.00 -2.39 3.38 -0.71 -3.47 115.31 112.52 3k4w h LEU 34 Ca 0.20 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.17 3k4w h LEU 34 Cb 0.29 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.04 3k4w h LEU 34 CO -0.05 0.06 0.00 0.61 0.09 0.00 0.00 178.44 179.15 3k4w n GLY 35 N 0.36 1.05 3.90 0.83 0.00 0.18 -4.90 105.19 106.60 3k4w n GLY 35 Ca 0.01 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.82 3k4w n GLY 35 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3k4w s PHE 36 N -2.00 3.22 0.17 1.61 0.08 -0.23 -4.96 117.98 115.87 3k4w s PHE 36 Ca 0.00 -0.11 -0.19 0.00 0.12 0.00 0.00 56.93 56.75 3k4w s PHE 36 Cb 0.00 -1.57 -0.08 0.00 -0.57 0.00 0.00 43.02 40.81 3k4w s PHE 36 CO 0.00 0.40 0.66 -1.21 -0.10 0.00 0.00 175.22 174.97 3k4w s GLU 37 N -3.95 4.22 0.41 0.44 0.41 -1.26 -3.20 118.70 115.77 3k4w s GLU 37 Ca 0.35 0.80 -0.26 0.00 -0.41 0.00 0.00 54.97 55.45 3k4w s GLU 37 Cb -0.08 -3.01 -0.09 0.00 -1.78 0.00 0.00 34.13 29.16 3k4w s GLU 37 CO 0.27 0.49 1.40 -2.14 -0.49 0.00 0.00 175.26 174.79 3k4w s PRO 38 N -1.69 3.91 0.22 0.39 0.02 -1.26 -4.49 135.00 132.10 3k4w s PRO 38 Ca 0.38 2.36 -0.32 0.00 0.02 0.00 0.00 61.00 63.44 3k4w s PRO 38 Cb -0.18 -2.79 -0.13 0.00 0.02 0.00 0.00 34.50 31.43 3k4w s PRO 38 CO 0.21 -0.61 1.59 0.00 -0.33 0.00 0.00 177.00 177.85 3k4w n ALA 39 N 0.12 2.00 -0.31 -1.55 0.00 -1.26 -4.91 120.51 114.60 3k4w n ALA 39 Ca 0.03 0.41 0.09 0.00 0.00 0.00 0.00 53.44 53.97 3k4w n ALA 39 Cb 0.42 -2.41 0.31 0.00 0.00 0.00 0.00 19.45 17.77 3k4w n ALA 39 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 3k4w h PRO 40 N 5.54 0.82 0.00 0.00 0.11 -1.99 -2.00 132.00 134.49 3k4w h PRO 40 Ca -0.45 -0.05 -0.04 0.00 0.11 0.00 0.00 66.00 65.57 3k4w h PRO 40 Cb 1.24 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 32.16 3k4w h PRO 40 CO 0.86 0.55 -0.18 0.66 -0.21 0.00 0.00 178.00 179.67 3k4w h SER 41 N 0.85 0.00 0.02 -2.05 4.64 -1.87 -2.64 113.55 112.49 3k4w h SER 41 Ca 0.46 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.78 3k4w h SER 41 Cb 0.56 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.65 3k4w h SER 41 CO -0.22 0.18 -0.01 0.00 -0.87 0.00 0.00 176.83 175.91 3k4w h ALA 42 N 1.82 -0.02 -0.72 5.18 0.00 -1.69 0.25 119.26 124.07 3k4w h ALA 42 Ca -0.00 -0.31 0.12 0.00 0.00 0.00 0.00 54.91 54.72 3k4w h ALA 42 Cb 0.34 0.01 -0.13 0.00 0.00 0.00 0.00 17.79 18.01 3k4w h ALA 42 CO 0.02 -0.19 -0.34 0.93 0.00 0.00 0.00 179.25 179.67 3k4w h GLU 43 N -0.67 -0.10 0.00 0.00 4.39 -1.27 -1.57 114.58 115.36 3k4w h GLU 43 Ca -0.00 0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.70 3k4w h GLU 43 Cb 0.63 0.02 0.00 0.00 -0.10 0.00 0.00 28.75 29.31 3k4w h GLU 43 CO 0.00 -0.07 -0.05 0.93 -1.16 0.00 0.00 179.01 178.67 3k4w h GLU 44 N -0.10 0.00 -5.00 2.33 4.39 -1.60 -3.48 114.58 111.12 3k4w h GLU 44 Ca 0.28 0.00 -0.33 0.00 0.34 0.00 0.00 59.36 59.65 3k4w h GLU 44 Cb 0.57 0.00 0.12 0.00 -0.10 0.00 0.00 28.75 29.33 3k4w h GLU 44 CO -0.78 0.00 -0.57 1.63 -1.16 0.00 0.00 179.01 178.14 3k4w n LYS 45 N -2.85 -6.52 -3.61 2.33 5.02 -0.02 -4.97 118.16 107.54 3k4w n LYS 45 Ca 0.04 0.69 -0.40 0.00 -2.02 0.00 0.00 58.31 56.61 3k4w n LYS 45 Cb 0.50 -5.29 -0.11 0.00 -0.02 0.00 0.00 35.03 30.11 3k4w n LYS 45 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 3k4w s SER 46 N -3.33 5.69 0.22 4.39 0.15 -0.64 -4.90 113.70 115.29 3k4w s SER 46 Ca 0.45 -1.13 -0.07 0.00 0.70 0.00 0.00 55.95 55.90 3k4w s SER 46 Cb -0.20 -2.01 0.33 0.00 -1.71 0.00 0.00 66.02 62.43 3k4w s SER 46 CO 0.60 -0.42 1.78 0.25 1.20 0.00 0.00 173.24 176.65 3k4w h LEU 47 N 8.42 0.46 -1.04 3.45 5.85 -1.85 -2.22 115.31 128.38 3k4w h LEU 47 Ca -0.25 0.06 -0.04 0.00 0.84 0.00 0.00 57.88 58.49 3k4w h LEU 47 Cb 1.10 -0.02 -0.03 0.00 0.37 0.00 0.00 40.66 42.08 3k4w h LEU 47 CO 0.69 0.27 0.20 -0.33 -0.34 0.00 0.00 178.44 178.92 3k4w h GLU 48 N 0.60 0.89 -0.54 1.25 4.39 -1.94 -1.27 114.58 117.95 3k4w h GLU 48 Ca 0.34 -0.16 -0.10 0.00 0.34 0.00 0.00 59.36 59.79 3k4w h GLU 48 Cb 0.35 -0.15 -0.02 0.00 -0.10 0.00 0.00 28.75 28.84 3k4w h GLU 48 CO -0.26 0.76 -0.04 1.25 -1.16 0.00 0.00 179.01 179.55 3k4w h LEU 49 N 0.87 0.95 -0.51 1.33 6.46 -1.91 -2.61 115.31 119.88 3k4w h LEU 49 Ca 0.20 -0.27 -0.00 0.00 -0.12 0.00 0.00 57.88 57.68 3k4w h LEU 49 Cb 0.23 -0.25 -0.03 0.00 -0.73 0.00 0.00 40.66 39.88 3k4w h LEU 49 CO -0.01 1.03 0.32 -0.03 -0.62 0.00 0.00 178.44 179.13 3k4w h MET 50 N 0.88 0.69 -0.79 1.25 4.05 -0.76 -1.61 114.93 118.64 3k4w h MET 50 Ca 0.15 -0.06 0.06 0.00 -0.28 0.00 0.00 59.70 59.57 3k4w h MET 50 Cb 0.57 -0.15 -0.06 0.00 -0.80 0.00 0.00 31.60 31.17 3k4w h MET 50 CO 0.03 0.49 0.48 0.74 0.23 0.00 0.00 176.91 178.88 3k4w h PHE 51 N 0.69 0.88 0.01 1.39 0.04 -1.24 0.11 116.94 118.82 3k4w h PHE 51 Ca 0.19 0.03 0.02 0.00 2.80 0.00 0.00 57.97 61.01 3k4w h PHE 51 Cb -0.03 -0.28 -0.03 0.00 2.20 0.00 0.00 35.95 37.80 3k4w h PHE 51 CO -0.03 0.45 -0.16 1.49 -0.60 0.00 0.00 178.31 179.46 3k4w h GLU 52 N 0.88 -0.25 -0.91 1.51 4.81 -1.08 -2.68 114.58 116.85 3k4w h GLU 52 Ca 0.34 0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.58 3k4w h GLU 52 Cb 0.15 0.06 -0.04 0.00 0.63 0.00 0.00 28.75 29.55 3k4w h GLU 52 CO -0.17 -0.17 0.55 0.93 -0.73 0.00 0.00 179.01 179.43 3k4w h GLU 53 N -0.26 1.23 0.01 1.92 5.08 -0.98 -1.03 114.58 120.55 3k4w h GLU 53 Ca 0.05 -0.11 0.03 0.00 -1.00 0.00 0.00 59.36 58.33 3k4w h GLU 53 Cb 0.33 -0.26 -0.04 0.00 0.50 0.00 0.00 28.75 29.28 3k4w h GLU 53 CO -0.15 0.86 -0.23 1.98 -1.00 0.00 0.00 179.01 180.47 3k4w h MET 54 N 1.25 -0.36 -0.55 2.33 4.05 -0.71 0.11 114.93 121.05 3k4w h MET 54 Ca 0.33 0.02 -0.07 0.00 -0.28 0.00 0.00 59.70 59.70 3k4w h MET 54 Cb -0.06 0.08 -0.02 0.00 -0.80 0.00 0.00 31.60 30.80 3k4w h MET 54 CO -0.06 -0.24 0.07 0.00 0.23 0.00 0.00 176.91 176.90 3k4w h ALA 55 N 0.47 0.73 -0.79 0.39 0.00 -1.40 0.14 119.26 118.80 3k4w h ALA 55 Ca 0.06 -0.26 0.04 0.00 0.00 0.00 0.00 54.91 54.74 3k4w h ALA 55 Cb 0.45 -0.21 -0.05 0.00 0.00 0.00 0.00 17.79 17.99 3k4w h ALA 55 CO -0.20 0.50 0.52 0.00 0.00 0.00 0.00 179.25 180.07 3k4w h ALA 56 N 0.98 1.53 0.00 0.00 0.00 -0.81 -1.89 119.26 119.07 3k4w h ALA 56 Ca 0.16 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.04 3k4w h ALA 56 Cb 0.45 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 17.96 3k4w h ALA 56 CO 0.02 0.39 0.00 0.00 0.00 0.00 0.00 179.25 179.66 3k4w h ALA 57 N 1.54 1.00 0.00 0.00 0.00 -0.45 -3.48 119.26 117.88 3k4w h ALA 57 Ca 0.32 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.23 3k4w h ALA 57 Cb 0.05 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.84 3k4w h ALA 57 CO -0.09 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.57 3k4w n GLY 58 N 0.99 0.60 3.68 0.00 0.00 -0.44 -4.85 105.19 105.16 3k4w n GLY 58 Ca 0.04 -0.57 -0.37 0.00 0.00 0.00 0.00 46.02 45.12 3k4w n GLY 58 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3k4w s ILE 59 N -2.00 5.25 -0.14 -0.61 1.01 0.36 -3.67 121.20 121.40 3k4w s ILE 59 Ca 0.00 0.57 0.02 0.00 0.00 0.00 0.00 60.65 61.24 3k4w s ILE 59 Cb 0.00 -3.66 -0.23 0.00 0.01 0.00 0.00 42.46 38.57 3k4w s ILE 59 CO 0.00 0.29 0.28 1.21 0.00 0.00 0.00 174.94 176.72 3k4w n GLU 60 N 4.29 0.70 -3.89 2.79 2.13 0.98 -4.30 120.64 123.34 3k4w n GLU 60 Ca -0.10 0.22 -0.09 0.00 0.66 0.00 0.00 57.16 57.85 3k4w n GLU 60 Cb 0.51 -1.67 -0.08 0.00 0.27 0.00 0.00 31.44 30.48 3k4w n GLU 60 CO 0.00 0.00 0.00 -0.65 -0.41 0.00 0.00 177.13 176.07 3k4w s GLN 61 N -2.55 0.80 0.03 5.31 -0.21 -1.01 -4.67 119.66 117.36 3k4w s GLN 61 Ca -0.20 -0.98 0.02 0.00 0.02 0.00 0.00 55.36 54.22 3k4w s GLN 61 Cb 0.07 0.32 -0.02 0.00 1.00 0.00 0.00 33.01 34.38 3k4w s GLN 61 CO 0.75 -0.24 -0.07 0.20 -2.12 0.00 0.00 175.29 173.82 3k4w s GLY 62 N -2.82 0.42 -0.31 3.09 0.00 -0.12 0.19 107.32 107.78 3k4w s GLY 62 Ca 0.05 -0.67 -0.14 0.00 0.00 0.00 0.00 44.72 43.96 3k4w s GLY 62 CO -0.10 -0.72 0.31 0.14 0.00 0.00 0.00 173.10 172.73 3k4w s VAL 63 N -1.26 5.21 -0.62 1.40 1.01 0.76 -0.74 120.40 126.16 3k4w s VAL 63 Ca -0.10 0.17 -0.20 0.00 0.00 0.00 0.00 61.98 61.85 3k4w s VAL 63 Cb -0.09 -3.72 0.09 0.00 0.00 0.00 0.00 36.38 32.66 3k4w s VAL 63 CO 0.00 0.05 0.80 0.00 0.00 0.00 0.00 175.10 175.95 3k4w s VAL 65 N 3.20 4.88 0.53 0.00 1.01 -1.26 -2.56 120.40 126.20 3k4w s VAL 65 Ca 0.15 0.95 -0.16 0.00 0.00 0.00 0.00 61.98 62.93 3k4w s VAL 65 Cb -0.22 -4.07 -0.07 0.00 0.00 0.00 0.00 36.38 32.03 3k4w s VAL 65 CO 0.08 -0.20 0.99 -0.83 0.00 0.00 0.00 175.10 175.14 3k4w s GLY 66 N 1.65 2.00 -0.19 4.51 0.00 -1.24 -4.93 107.32 109.13 3k4w s GLY 66 Ca 0.28 0.14 -0.03 0.00 0.00 0.00 0.00 44.72 45.11 3k4w s GLY 66 CO 0.12 0.42 -0.05 -1.60 0.00 0.00 0.00 173.10 171.99 3k4w s ARG 67 N -4.24 3.49 -0.76 2.90 3.52 -1.26 -4.70 118.95 117.90 3k4w s ARG 67 Ca 0.58 -0.59 0.03 0.00 -0.13 0.00 0.00 55.73 55.62 3k4w s ARG 67 Cb -0.10 -2.93 0.21 0.00 -1.56 0.00 0.00 34.95 30.57 3k4w s ARG 67 CO 0.35 0.01 0.67 0.09 -0.81 0.00 0.00 175.30 175.61 3k4w n ASN 68 N 4.18 3.64 -4.34 -2.12 3.02 -1.26 -1.30 115.26 117.08 3k4w n ASN 68 Ca -0.18 -3.26 -0.25 0.00 -0.03 0.00 0.00 54.58 50.87 3k4w n ASN 68 Cb 0.52 -0.84 -0.12 0.00 -0.61 0.00 0.00 39.78 38.73 3k4w n ASN 68 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 3k4w s SER 69 N -1.38 2.85 0.05 6.41 0.15 -1.20 -4.47 113.70 116.11 3k4w s SER 69 Ca 0.29 -0.77 0.22 0.00 0.70 0.00 0.00 55.95 56.40 3k4w s SER 69 Cb -0.00 -0.18 -0.22 0.00 -1.71 0.00 0.00 66.02 63.92 3k4w s SER 69 CO -0.11 0.07 0.69 -1.54 1.20 0.00 0.00 173.24 173.54 3k4w n SER 70 N 0.75 0.31 0.14 5.45 3.41 -1.26 -3.63 113.62 118.80 3k4w n SER 70 Ca -0.17 0.09 -0.25 0.00 -0.26 0.00 0.00 58.87 58.28 3k4w n SER 70 Cb 0.55 1.44 -0.16 0.00 -0.26 0.00 0.00 64.21 65.78 3k4w n SER 70 CO 0.00 0.00 0.00 0.58 -0.16 0.00 0.00 175.04 175.46 3k4w h VAL 71 N 0.00 1.27 -0.24 -3.33 2.07 -1.86 -3.39 116.25 110.76 3k4w h VAL 71 Ca 0.00 -2.70 0.00 0.00 0.82 0.00 0.00 66.70 64.82 3k4w h VAL 71 Cb 0.98 3.03 0.00 0.00 -1.52 0.00 0.00 31.29 33.78 3k4w h VAL 71 CO 0.00 0.82 0.00 0.18 0.02 0.00 0.00 177.57 178.59 3k4w n LEU 72 N -3.70 3.19 0.00 2.57 4.77 -1.26 -5.01 117.00 117.56 3k4w n LEU 72 Ca -0.17 -2.56 0.00 0.00 -0.03 0.00 0.00 56.01 53.25 3k4w n LEU 72 Cb 1.10 -0.37 0.00 0.00 -2.33 0.00 0.00 43.42 41.83 3k4w n LEU 72 CO 0.60 0.68 0.00 0.61 -1.33 0.00 0.00 177.39 177.95 3k4w n GLY 73 N -0.23 -1.70 3.04 -0.72 0.00 -1.24 -2.34 105.19 102.00 3k4w n GLY 73 Ca 0.15 -1.52 -0.23 0.00 0.00 0.00 0.00 46.02 44.42 3k4w n GLY 73 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3k4w s SER 74 N -4.13 1.62 -0.20 1.61 0.01 -1.26 -3.21 113.70 108.15 3k4w s SER 74 Ca 0.00 -0.26 0.01 0.00 1.31 0.00 0.00 55.95 57.00 3k4w s SER 74 Cb 0.00 -0.55 0.05 0.00 0.21 0.00 0.00 66.02 65.72 3k4w s SER 74 CO 0.00 0.07 -0.08 0.54 0.41 0.00 0.00 173.24 174.18 3k4w s VAL 75 N 0.32 1.50 0.89 3.43 0.11 -0.42 -4.50 120.40 121.74 3k4w s VAL 75 Ca -0.07 -0.96 -0.11 0.00 -2.93 0.00 0.00 61.98 57.91 3k4w s VAL 75 Cb -0.12 -1.63 0.13 0.00 -1.53 0.00 0.00 36.38 33.23 3k4w s VAL 75 CO 0.02 0.11 1.10 -0.94 -3.33 0.00 0.00 175.10 172.07 3k4w s SER 76 N 1.45 3.34 0.33 3.54 1.04 -1.26 -4.12 113.70 118.02 3k4w s SER 76 Ca -0.02 1.83 0.04 0.00 0.48 0.00 0.00 55.95 58.28 3k4w s SER 76 Cb -0.16 -2.43 0.59 0.00 0.10 0.00 0.00 66.02 64.12 3k4w s SER 76 CO -0.08 -2.78 1.89 0.78 0.98 0.00 0.00 173.24 174.04 3k4w h ASN 77 N -1.64 0.55 -0.37 7.02 2.35 -1.94 -2.42 115.58 119.12 3k4w h ASN 77 Ca -0.47 -0.09 0.05 0.00 -0.55 0.00 0.00 56.30 55.25 3k4w h ASN 77 Cb 1.27 -0.14 -0.05 0.00 0.05 0.00 0.00 38.32 39.45 3k4w h ASN 77 CO 0.49 0.57 0.08 0.00 -1.65 0.00 0.00 177.43 176.92 3k4w h ALA 78 N 1.50 0.40 -0.17 -0.83 0.00 -1.96 -1.21 119.26 116.99 3k4w h ALA 78 Ca 0.13 0.07 -0.00 0.00 0.00 0.00 0.00 54.91 55.10 3k4w h ALA 78 Cb 0.27 0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 3k4w h ALA 78 CO 0.00 -0.32 0.09 -0.44 0.00 0.00 0.00 179.25 178.58 3k4w h ASP 79 N 0.21 0.22 -0.58 0.00 5.19 -1.85 -0.21 116.42 119.40 3k4w h ASP 79 Ca 0.18 -0.10 0.11 0.00 -0.62 0.00 0.00 57.03 56.60 3k4w h ASP 79 Cb 0.20 -0.06 -0.09 0.00 0.18 0.00 0.00 39.33 39.57 3k4w h ASP 79 CO -0.22 0.25 0.10 0.58 -3.12 0.00 0.00 179.24 176.83 3k4w h VAL 80 N 0.16 0.63 -0.59 -1.35 2.07 -1.29 -1.00 116.25 114.88 3k4w h VAL 80 Ca 0.06 -0.08 0.06 0.00 0.82 0.00 0.00 66.70 67.56 3k4w h VAL 80 Cb 0.09 0.38 -0.04 0.00 -1.52 0.00 0.00 31.29 30.21 3k4w h VAL 80 CO -0.01 0.04 0.39 0.00 0.02 0.00 0.00 177.57 178.02 3k4w h ALA 81 N 1.47 1.82 0.03 1.67 0.00 -0.79 -2.42 119.26 121.04 3k4w h ALA 81 Ca 0.30 -0.02 -0.25 0.00 0.00 0.00 0.00 54.91 54.94 3k4w h ALA 81 Cb 0.45 -0.15 0.01 0.00 0.00 0.00 0.00 17.79 18.10 3k4w h ALA 81 CO -0.41 0.08 -1.04 0.00 0.00 0.00 0.00 179.25 177.89 3k4w h ALA 82 N 1.68 0.24 -0.37 0.00 0.00 0.11 -1.79 119.26 119.13 3k4w h ALA 82 Ca 0.26 -0.73 0.01 0.00 0.00 0.00 0.00 54.91 54.44 3k4w h ALA 82 Cb 0.28 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 3k4w h ALA 82 CO -0.07 0.79 0.24 0.28 0.00 0.00 0.00 179.25 180.48 3k4w h VAL 83 N 0.25 1.09 -0.61 0.00 2.07 -0.98 -1.60 116.25 116.47 3k4w h VAL 83 Ca -0.11 -0.17 -0.10 0.00 0.82 0.00 0.00 66.70 67.14 3k4w h VAL 83 Cb 1.69 0.55 -0.02 0.00 -1.52 0.00 0.00 31.29 31.99 3k4w h VAL 83 CO 0.19 0.09 -0.00 0.00 0.02 0.00 0.00 177.57 177.86 3k4w h ALA 84 N 1.14 0.84 0.00 1.67 0.00 -1.40 -1.55 119.26 119.95 3k4w h ALA 84 Ca 0.14 -0.31 -0.11 0.00 0.00 0.00 0.00 54.91 54.62 3k4w h ALA 84 Cb -0.05 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 3k4w h ALA 84 CO -0.04 0.67 -0.53 1.57 0.00 0.00 0.00 179.25 180.93 3k4w h LYS 85 N 0.98 0.00 0.00 0.00 2.10 -1.24 -2.36 116.57 116.05 3k4w h LYS 85 Ca 0.17 0.00 -0.07 0.00 -2.00 0.00 0.00 60.65 58.76 3k4w h LYS 85 Cb 0.56 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.88 3k4w h LYS 85 CO 0.03 0.53 -0.32 0.00 -2.00 0.00 0.00 179.45 177.69 3k4w h ALA 86 N 1.47 1.07 -2.07 0.07 0.00 -1.12 -3.36 119.26 115.32 3k4w h ALA 86 Ca -0.01 -0.29 -0.52 0.00 0.00 0.00 0.00 54.91 54.09 3k4w h ALA 86 Cb 1.20 -0.05 -0.40 0.00 0.00 0.00 0.00 17.79 18.54 3k4w h ALA 86 CO 0.07 0.40 -1.04 0.66 0.00 0.00 0.00 179.25 179.34 3k4w n TYR 87 N -3.58 1.09 0.39 0.00 4.01 -0.60 -4.98 117.16 113.50 3k4w n TYR 87 Ca -0.01 -3.84 0.13 0.00 -0.16 0.00 0.00 57.90 54.03 3k4w n TYR 87 Cb 0.45 -0.43 0.51 0.00 -0.31 0.00 0.00 39.34 39.57 3k4w n TYR 87 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 3k4w h PRO 88 N 3.19 0.00 -0.01 -0.72 0.13 -1.58 -0.64 132.00 132.37 3k4w h PRO 88 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 3k4w h PRO 88 Cb 0.84 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.97 3k4w h PRO 88 CO 0.58 0.00 -0.18 -0.40 -0.23 0.00 0.00 178.00 177.77 3k4w n ASP 89 N -2.49 0.90 0.00 1.44 5.75 -1.26 -4.47 116.55 116.42 3k4w n ASP 89 Ca 0.02 -0.87 0.00 0.00 -0.01 0.00 0.00 54.79 53.94 3k4w n ASP 89 Cb 0.29 0.05 0.00 0.00 -1.03 0.00 0.00 41.12 40.43 3k4w n ASP 89 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 3k4w n LYS 90 N -0.65 3.34 -4.56 0.11 4.76 -0.35 -4.75 118.16 116.05 3k4w n LYS 90 Ca 0.14 0.00 -0.23 0.00 -2.87 0.00 0.00 58.31 55.35 3k4w n LYS 90 Cb 0.32 -0.98 -0.16 0.00 -1.84 0.00 0.00 35.03 32.37 3k4w n LYS 90 CO 0.00 0.00 0.00 -0.06 -1.37 0.00 0.00 177.40 175.97 3k4w s PHE 91 N -1.97 1.28 -0.25 2.13 0.08 -0.58 -0.94 117.98 117.72 3k4w s PHE 91 Ca 0.00 -0.37 -0.09 0.00 0.12 0.00 0.00 56.93 56.59 3k4w s PHE 91 Cb 0.00 -0.90 -0.04 0.00 -0.57 0.00 0.00 43.02 41.51 3k4w s PHE 91 CO 0.00 -0.16 0.12 -1.01 -0.10 0.00 0.00 175.22 174.07 3k4w s HIS 92 N 0.26 3.17 0.29 0.36 3.76 0.08 -4.76 115.29 118.45 3k4w s HIS 92 Ca -0.06 -0.12 -0.27 0.00 -0.15 0.00 0.00 55.06 54.46 3k4w s HIS 92 Cb -0.11 -2.28 -0.09 0.00 1.11 0.00 0.00 32.58 31.21 3k4w s HIS 92 CO 0.02 -0.20 0.93 -1.25 -0.85 0.00 0.00 174.74 173.39 3k4w s PRO 93 N 1.49 4.66 -0.07 8.40 0.04 -1.26 -1.22 135.00 147.04 3k4w s PRO 93 Ca 0.06 1.36 0.03 0.00 0.04 0.00 0.00 61.00 62.50 3k4w s PRO 93 Cb -0.15 -2.97 0.01 0.00 0.04 0.00 0.00 34.50 31.43 3k4w s PRO 93 CO 0.06 0.37 -0.16 0.08 0.04 0.00 0.00 177.00 177.39 3k4w s VAL 94 N -1.46 1.41 -0.06 -0.36 1.01 -1.06 -4.50 120.40 115.38 3k4w s VAL 94 Ca 0.47 -0.66 -0.18 0.00 0.00 0.00 0.00 61.98 61.60 3k4w s VAL 94 Cb -0.21 -1.24 -0.05 0.00 0.00 0.00 0.00 36.38 34.88 3k4w s VAL 94 CO 0.26 0.41 0.51 -0.83 0.00 0.00 0.00 175.10 175.45 3k4w s GLY 95 N 0.42 2.48 0.15 4.51 0.00 0.58 -3.68 107.32 111.78 3k4w s GLY 95 Ca -0.13 -0.12 0.08 0.00 0.00 0.00 0.00 44.72 44.55 3k4w s GLY 95 CO 0.04 0.66 -0.08 -1.35 0.00 0.00 0.00 173.10 172.37 3k4w s SER 96 N 0.06 4.41 -0.10 1.64 1.04 -1.26 1.00 113.70 120.48 3k4w s SER 96 Ca 0.27 -0.46 0.03 0.00 0.48 0.00 0.00 55.95 56.27 3k4w s SER 96 Cb -0.16 -0.82 0.01 0.00 0.10 0.00 0.00 66.02 65.14 3k4w s SER 96 CO 0.13 0.13 -0.19 -0.63 0.98 0.00 0.00 173.24 173.66 3k4w s ILE 97 N -1.50 1.73 -0.22 -1.02 1.01 -0.96 -4.89 121.20 115.35 3k4w s ILE 97 Ca 0.24 -0.81 -0.02 0.00 0.00 0.00 0.00 60.65 60.06 3k4w s ILE 97 Cb -0.10 -1.53 0.07 0.00 0.01 0.00 0.00 42.46 40.91 3k4w s ILE 97 CO 0.15 0.49 0.04 -0.70 0.00 0.00 0.00 174.94 174.92 3k4w s GLU 98 N 0.66 0.72 0.02 2.79 2.12 -1.26 -4.54 118.70 119.21 3k4w s GLU 98 Ca -0.13 -0.57 -0.08 0.00 0.36 0.00 0.00 54.97 54.55 3k4w s GLU 98 Cb -0.16 -2.10 0.00 0.00 0.26 0.00 0.00 34.13 32.13 3k4w s GLU 98 CO 0.03 -0.70 0.16 0.00 -0.54 0.00 0.00 175.26 174.21 3k4w s ALA 99 N 1.80 -0.32 -0.13 6.30 0.00 -1.26 -4.94 121.76 123.20 3k4w s ALA 99 Ca 0.01 -0.23 -0.12 0.00 0.00 0.00 0.00 51.96 51.61 3k4w s ALA 99 Cb -0.17 0.19 -0.10 0.00 0.00 0.00 0.00 23.12 23.04 3k4w s ALA 99 CO -0.11 -0.28 0.19 0.00 0.00 0.00 0.00 175.76 175.56 3k4w h ALA 100 N 3.87 0.04 -2.81 0.00 0.00 -1.98 -3.48 119.26 114.89 3k4w h ALA 100 Ca -0.31 -0.41 -0.59 0.00 0.00 0.00 0.00 54.91 53.60 3k4w h ALA 100 Cb 1.19 0.21 -0.07 0.00 0.00 0.00 0.00 17.79 19.12 3k4w h ALA 100 CO 0.45 0.20 -0.56 0.95 0.00 0.00 0.00 179.25 180.30 3k4w s THR 101 N -1.98 4.66 0.27 0.00 -4.23 -1.26 -4.99 115.64 108.11 3k4w s THR 101 Ca -0.12 -0.92 -0.01 0.00 -1.18 0.00 0.00 61.69 59.46 3k4w s THR 101 Cb 0.00 -3.35 0.28 0.00 1.34 0.00 0.00 72.50 70.78 3k4w s THR 101 CO 0.31 -0.04 1.87 -0.09 -0.54 0.00 0.00 174.62 176.13 3k4w h ARG 102 N 2.62 1.10 0.00 3.99 2.43 -1.94 -1.00 114.38 121.58 3k4w h ARG 102 Ca -0.47 -0.07 -0.01 0.00 -0.81 0.00 0.00 59.98 58.62 3k4w h ARG 102 Cb 1.19 -0.25 -0.00 0.00 -0.42 0.00 0.00 29.97 30.49 3k4w h ARG 102 CO 0.65 0.73 -0.03 0.87 -1.51 0.00 0.00 179.97 180.68 3k4w h LYS 103 N 1.13 0.00 0.20 0.20 1.57 -1.99 -1.96 116.57 115.72 3k4w h LYS 103 Ca 0.45 0.00 -0.27 0.00 -1.87 0.00 0.00 60.65 58.96 3k4w h LYS 103 Cb 0.25 0.00 0.03 0.00 0.08 0.00 0.00 32.23 32.59 3k4w h LYS 103 CO -0.20 0.03 -1.18 1.49 -0.57 0.00 0.00 179.45 179.03 3k4w h GLU 104 N 0.00 0.42 -0.73 3.15 4.81 -1.61 -2.78 114.58 117.85 3k4w h GLU 104 Ca -0.00 -0.73 0.00 0.00 -0.13 0.00 0.00 59.36 58.51 3k4w h GLU 104 Cb 0.59 0.27 -0.04 0.00 0.63 0.00 0.00 28.75 30.20 3k4w h GLU 104 CO 0.00 1.35 0.47 0.00 -0.73 0.00 0.00 179.01 180.10 3k4w h ALA 105 N 0.11 0.93 -0.11 2.92 0.00 -1.08 -2.13 119.26 119.89 3k4w h ALA 105 Ca -0.21 -0.06 -0.18 0.00 0.00 0.00 0.00 54.91 54.46 3k4w h ALA 105 Cb 1.92 -0.30 -0.00 0.00 0.00 0.00 0.00 17.79 19.41 3k4w h ALA 105 CO 0.21 0.36 -0.68 0.52 0.00 0.00 0.00 179.25 179.67 3k4w h MET 106 N 0.99 0.46 -0.26 0.00 2.86 -1.39 0.12 114.93 117.71 3k4w h MET 106 Ca 0.27 -0.35 -0.07 0.00 -2.06 0.00 0.00 59.70 57.49 3k4w h MET 106 Cb -0.09 0.06 -0.02 0.00 0.06 0.00 0.00 31.60 31.62 3k4w h MET 106 CO -0.06 0.98 -0.13 0.00 1.06 0.00 0.00 176.91 178.76 3k4w h ALA 107 N 0.93 1.29 -0.19 6.32 0.00 -1.41 -0.92 119.26 125.29 3k4w h ALA 107 Ca -0.02 -0.26 -0.20 0.00 0.00 0.00 0.00 54.91 54.43 3k4w h ALA 107 Cb 1.24 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.91 3k4w h ALA 107 CO 0.12 0.47 -0.68 1.96 0.00 0.00 0.00 179.25 181.12 3k4w h GLN 108 N 0.41 0.73 -0.82 0.00 4.20 -0.64 -2.09 115.11 116.90 3k4w h GLN 108 Ca 0.08 -0.54 -0.01 0.00 0.06 0.00 0.00 58.65 58.24 3k4w h GLN 108 Cb 0.48 0.09 -0.04 0.00 0.30 0.00 0.00 27.48 28.31 3k4w h GLN 108 CO 0.03 1.16 0.48 1.98 -0.67 0.00 0.00 178.83 181.81 3k4w h MET 109 N 0.53 1.12 -0.47 1.46 4.05 -0.71 -1.11 114.93 119.79 3k4w h MET 109 Ca -0.02 -0.11 -0.02 0.00 -0.28 0.00 0.00 59.70 59.27 3k4w h MET 109 Cb 1.28 -0.23 -0.02 0.00 -0.80 0.00 0.00 31.60 31.83 3k4w h MET 109 CO 0.14 0.79 0.22 0.37 0.23 0.00 0.00 176.91 178.65 3k4w h GLN 110 N 1.13 0.68 -0.53 0.39 5.75 -1.00 -1.86 115.11 119.68 3k4w h GLN 110 Ca 0.29 -0.11 -0.09 0.00 -0.15 0.00 0.00 58.65 58.60 3k4w h GLN 110 Cb -0.03 -0.12 -0.02 0.00 1.07 0.00 0.00 27.48 28.38 3k4w h GLN 110 CO -0.05 0.59 -0.02 1.49 -2.65 0.00 0.00 178.83 178.18 3k4w h GLU 111 N 0.61 0.95 -0.14 1.69 4.81 -1.03 0.53 114.58 122.01 3k4w h GLU 111 Ca 0.16 -0.32 0.05 0.00 -0.13 0.00 0.00 59.36 59.12 3k4w h GLU 111 Cb 0.14 -0.08 -0.06 0.00 0.63 0.00 0.00 28.75 29.38 3k4w h GLU 111 CO -0.02 0.98 -0.28 0.82 -0.73 0.00 0.00 179.01 179.78 3k4w h ILE 112 N 0.83 0.35 -0.51 2.32 2.04 -1.14 0.95 117.51 122.35 3k4w h ILE 112 Ca 0.15 0.00 -0.09 0.00 1.00 0.00 0.00 64.86 65.92 3k4w h ILE 112 Cb 0.56 0.35 -0.02 0.00 -0.74 0.00 0.00 36.82 36.98 3k4w h ILE 112 CO 0.03 0.00 -0.03 -0.07 0.00 0.00 0.00 178.15 178.08 3k4w h LEU 113 N -0.35 0.85 -1.73 1.44 3.38 -1.23 -2.39 115.31 115.28 3k4w h LEU 113 Ca 0.10 -0.23 -0.01 0.00 0.09 0.00 0.00 57.88 57.83 3k4w h LEU 113 Cb 0.50 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.01 3k4w h LEU 113 CO -0.33 0.93 0.06 0.44 0.09 0.00 0.00 178.44 179.62 3k4w h ASP 114 N 0.80 0.20 0.27 -0.43 3.32 -0.16 -1.60 116.42 118.83 3k4w h ASP 114 Ca 0.15 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.18 3k4w h ASP 114 Cb 0.52 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 40.02 3k4w h ASP 114 CO 0.03 0.20 0.00 0.18 -1.72 0.00 0.00 179.24 177.93 3k4w n LEU 115 N -4.45 0.00 0.00 1.55 4.77 0.26 -4.89 117.00 114.24 3k4w n LEU 115 Ca -0.00 0.18 0.00 0.00 -0.03 0.00 0.00 56.01 56.16 3k4w n LEU 115 Cb 0.12 -0.18 0.00 0.00 -2.33 0.00 0.00 43.42 41.03 3k4w n LEU 115 CO 0.35 -0.05 0.00 0.61 -1.33 0.00 0.00 177.39 176.98 3k4w n GLY 116 N 0.58 0.78 3.75 -0.72 0.00 -0.60 -5.00 105.19 103.99 3k4w n GLY 116 Ca 0.13 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.75 3k4w n GLY 116 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3k4w s ILE 117 N -2.91 3.51 0.00 -0.61 1.01 -0.94 -4.98 121.20 116.27 3k4w s ILE 117 Ca 0.00 1.46 0.00 0.00 0.00 0.00 0.00 60.65 62.11 3k4w s ILE 117 Cb 0.00 -3.93 0.00 0.00 0.01 0.00 0.00 42.46 38.54 3k4w s ILE 117 CO 0.00 0.32 0.43 0.54 0.00 0.00 0.00 174.94 176.24 3k4w n ARG 118 N 1.48 -0.33 -4.58 2.79 5.12 -1.26 -4.07 116.66 115.82 3k4w n ARG 118 Ca 0.00 -0.49 -0.22 0.00 -1.93 0.00 0.00 57.85 55.21 3k4w n ARG 118 Cb 0.45 -0.87 -0.14 0.00 -1.16 0.00 0.00 32.46 30.74 3k4w n ARG 118 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 3k4w s ILE 119 N -0.10 1.21 -0.00 0.55 1.01 -1.26 -4.33 121.20 118.27 3k4w s ILE 119 Ca 0.00 -0.82 0.08 0.00 0.00 0.00 0.00 60.65 59.91 3k4w s ILE 119 Cb 0.00 -1.04 -0.02 0.00 0.01 0.00 0.00 42.46 41.40 3k4w s ILE 119 CO 0.00 0.21 -0.25 0.54 0.00 0.00 0.00 174.94 175.44 3k4w s VAL 120 N -0.56 2.02 -0.07 2.92 0.11 -1.10 -0.31 120.40 123.41 3k4w s VAL 120 Ca 0.05 -1.15 0.03 0.00 -2.93 0.00 0.00 61.98 57.97 3k4w s VAL 120 Cb -0.07 -1.69 -0.02 0.00 -1.53 0.00 0.00 36.38 33.07 3k4w s VAL 120 CO 0.00 0.51 -0.14 0.21 -3.33 0.00 0.00 175.10 172.35 3k4w s ASN 121 N -0.75 4.01 -0.09 3.54 2.47 0.28 -0.31 114.94 124.08 3k4w s ASN 121 Ca 0.10 -0.23 -0.01 0.00 0.42 0.00 0.00 52.86 53.15 3k4w s ASN 121 Cb -0.10 -1.00 0.03 0.00 -1.45 0.00 0.00 41.25 38.72 3k4w s ASN 121 CO -0.00 0.31 -0.04 -0.76 -3.72 0.00 0.00 177.10 172.89 3k4w s LEU 122 N -0.50 0.92 -0.48 3.21 1.43 0.06 -2.28 118.68 121.04 3k4w s LEU 122 Ca 0.07 -0.20 0.08 0.00 -1.03 0.00 0.00 54.13 53.05 3k4w s LEU 122 Cb -0.12 -0.65 0.36 0.00 0.03 0.00 0.00 46.19 45.81 3k4w s LEU 122 CO 0.02 -0.15 0.89 -0.62 0.23 0.00 0.00 176.35 176.71 3k4w n GLU 123 N 5.00 2.37 0.20 1.70 1.02 -1.26 -1.87 120.64 127.79 3k4w n GLU 123 Ca -0.10 -4.25 0.14 0.00 -0.02 0.00 0.00 57.16 52.93 3k4w n GLU 123 Cb 0.50 -2.01 0.69 0.00 -0.02 0.00 0.00 31.44 30.60 3k4w n GLU 123 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 3k4w h PRO 124 N 2.96 0.00 0.00 3.49 0.13 -1.88 -1.46 132.00 135.24 3k4w h PRO 124 Ca 0.12 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.23 3k4w h PRO 124 Cb 0.73 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.85 3k4w h PRO 124 CO 0.70 0.00 -0.10 0.78 -0.23 0.00 0.00 178.00 179.14 3k4w h GLY 125 N 0.79 0.00 -2.46 1.56 0.00 -1.58 -1.21 103.07 100.17 3k4w h GLY 125 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 3k4w h GLY 125 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 176.54 179.87 3k4w n VAL 126 N -3.34 1.67 -1.22 4.60 0.24 -0.55 -4.07 118.33 115.66 3k4w n VAL 126 Ca -0.01 -1.25 -0.30 0.00 -2.04 0.00 0.00 64.34 60.74 3k4w n VAL 126 Cb 0.30 0.18 0.12 0.00 -1.47 0.00 0.00 33.84 32.96 3k4w n VAL 126 CO 0.00 0.00 0.00 0.26 -2.14 0.00 0.00 176.83 174.95 3k4w s TRP 127 N -1.76 2.43 0.53 6.34 0.51 -1.08 -3.76 118.94 122.16 3k4w s TRP 127 Ca 0.44 1.41 0.25 0.00 -2.12 0.00 0.00 56.10 56.07 3k4w s TRP 127 Cb 0.28 -3.11 1.40 0.00 -0.81 0.00 0.00 33.47 31.24 3k4w s TRP 127 CO 0.21 -2.11 2.01 0.00 -0.51 0.00 0.00 176.95 176.55 3k4w h ALA 128 N -1.35 2.43 -3.50 0.98 0.00 -1.93 -3.13 119.26 112.76 3k4w h ALA 128 Ca -0.47 -0.02 -0.64 0.00 0.00 0.00 0.00 54.91 53.78 3k4w h ALA 128 Cb 1.26 0.04 -0.40 0.00 0.00 0.00 0.00 17.79 18.68 3k4w h ALA 128 CO 0.53 -0.59 -0.69 0.99 0.00 0.00 0.00 179.25 179.49 3k4w s THR 129 N -4.99 2.24 0.32 0.00 2.01 -1.26 -5.06 115.64 108.91 3k4w s THR 129 Ca -0.05 -2.66 -0.29 0.00 0.31 0.00 0.00 61.69 59.00 3k4w s THR 129 Cb 0.19 -2.62 -0.12 0.00 0.01 0.00 0.00 72.50 69.97 3k4w s THR 129 CO 0.71 -0.70 1.50 -2.65 -0.69 0.00 0.00 174.62 172.80 3k4w n PRO 130 N 3.82 2.56 -4.20 4.92 -0.02 -1.18 -4.98 135.00 135.92 3k4w n PRO 130 Ca 0.04 0.90 -0.12 0.00 -2.02 0.00 0.00 63.50 62.31 3k4w n PRO 130 Cb 0.38 -2.63 -0.10 0.00 -0.02 0.00 0.00 33.50 31.13 3k4w n PRO 130 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3k4w s MET 131 N -1.24 0.99 0.69 -0.52 0.23 -0.48 -4.96 119.30 114.01 3k4w s MET 131 Ca 0.59 -1.46 -0.10 0.00 -1.03 0.00 0.00 55.69 53.69 3k4w s MET 131 Cb -0.51 -0.09 0.01 0.00 -1.53 0.00 0.00 34.83 32.71 3k4w s MET 131 CO 0.56 -0.15 1.06 -1.01 -2.03 0.00 0.00 175.02 173.45 3k4w s HIS 132 N -3.77 3.30 -0.63 3.16 3.76 -1.26 -3.04 115.29 116.80 3k4w s HIS 132 Ca 0.21 0.97 0.25 0.00 -0.15 0.00 0.00 55.06 56.34 3k4w s HIS 132 Cb 0.06 -3.02 0.69 0.00 1.11 0.00 0.00 32.58 31.42 3k4w s HIS 132 CO 0.01 -1.13 1.73 -0.39 -0.85 0.00 0.00 174.74 174.11 3k4w h VAL 133 N -0.58 0.00 -0.61 -0.90 -1.51 -1.92 -2.36 116.25 108.37 3k4w h VAL 133 Ca -0.45 -0.62 0.00 0.00 -1.23 0.00 0.00 66.70 64.40 3k4w h VAL 133 Cb 1.26 1.61 0.00 0.00 -2.13 0.00 0.00 31.29 32.03 3k4w h VAL 133 CO 0.63 0.00 0.00 -0.90 -1.23 0.00 0.00 177.57 176.07 3k4w n ASP 134 N -2.51 4.92 -4.68 4.19 5.75 -1.26 -4.90 116.55 118.06 3k4w n ASP 134 Ca 0.05 -2.57 -0.44 0.00 -0.01 0.00 0.00 54.79 51.82 3k4w n ASP 134 Cb 0.45 -0.61 -0.02 0.00 -1.03 0.00 0.00 41.12 39.91 3k4w n ASP 134 CO 0.00 0.00 0.00 -0.67 -0.11 0.00 0.00 177.20 176.42 3k4w n ASP 135 N 0.95 2.82 -0.35 -1.12 -0.08 -0.89 -4.82 116.55 113.06 3k4w n ASP 135 Ca 0.26 1.15 0.25 0.00 -1.51 0.00 0.00 54.79 54.93 3k4w n ASP 135 Cb 0.96 -1.44 0.51 0.00 2.34 0.00 0.00 41.12 43.48 3k4w n ASP 135 CO 0.00 0.00 0.00 0.08 0.12 0.00 0.00 177.20 177.40 3k4w h ARG 136 N 4.10 0.34 0.00 -0.67 0.11 -1.94 0.06 114.38 116.39 3k4w h ARG 136 Ca -0.45 -0.02 0.00 0.00 0.10 0.00 0.00 59.98 59.61 3k4w h ARG 136 Cb 1.27 -0.08 0.00 0.00 1.11 0.00 0.00 29.97 32.28 3k4w h ARG 136 CO 0.75 0.23 0.00 0.00 0.10 0.00 0.00 179.97 181.04 3k4w h ARG 137 N 0.35 0.00 0.00 0.08 3.08 -1.97 -1.91 114.38 114.01 3k4w h ARG 137 Ca 0.68 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.73 3k4w h ARG 137 Cb 1.70 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.75 3k4w h ARG 137 CO -0.42 0.00 -0.78 -0.07 -1.07 0.00 0.00 179.97 177.63 3k4w h LEU 138 N 0.00 0.00 -1.08 3.04 3.38 -1.32 -3.39 115.31 115.94 3k4w h LEU 138 Ca 0.00 -0.03 0.13 0.00 0.09 0.00 0.00 57.88 58.07 3k4w h LEU 138 Cb 0.36 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.03 3k4w h LEU 138 CO 0.00 0.02 0.62 1.88 0.09 0.00 0.00 178.44 181.04 3k4w h TYR 139 N 0.00 1.06 -0.78 1.13 -1.99 -1.35 -0.73 116.97 114.31 3k4w h TYR 139 Ca 0.00 0.03 -0.01 0.00 2.00 0.00 0.00 58.73 60.75 3k4w h TYR 139 Cb 0.96 -0.33 -0.04 0.00 2.00 0.00 0.00 36.73 39.32 3k4w h TYR 139 CO 0.00 0.40 0.43 -1.35 -0.00 0.00 0.00 178.16 177.64 3k4w h PRO 140 N 0.90 1.08 -0.42 4.88 0.11 -1.76 -1.74 132.00 135.05 3k4w h PRO 140 Ca 0.49 -0.12 0.03 0.00 0.11 0.00 0.00 66.00 66.52 3k4w h PRO 140 Cb 0.58 -0.22 -0.04 0.00 0.11 0.00 0.00 31.00 31.43 3k4w h PRO 140 CO -0.26 0.79 0.21 1.25 -0.21 0.00 0.00 178.00 179.78 3k4w h LEU 141 N 1.09 0.30 -1.23 2.35 5.85 -1.44 -2.47 115.31 119.77 3k4w h LEU 141 Ca 0.28 0.02 -0.04 0.00 0.84 0.00 0.00 57.88 58.98 3k4w h LEU 141 Cb 0.02 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.00 3k4w h LEU 141 CO -0.05 0.22 0.08 1.88 -0.34 0.00 0.00 178.44 180.23 3k4w h TYR 142 N 0.42 0.63 -0.65 1.25 0.05 -1.00 -2.17 116.97 115.50 3k4w h TYR 142 Ca 0.18 -0.05 -0.05 0.00 0.05 0.00 0.00 58.73 58.87 3k4w h TYR 142 Cb 0.09 -0.19 -0.03 0.00 1.01 0.00 0.00 36.73 37.62 3k4w h TYR 142 CO -0.10 0.55 0.23 0.00 -1.05 0.00 0.00 178.16 177.79 3k4w h ALA 143 N 1.50 0.85 -0.27 3.88 0.00 -1.09 0.60 119.26 124.72 3k4w h ALA 143 Ca 0.14 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 3k4w h ALA 143 Cb 0.25 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 3k4w h ALA 143 CO -0.00 0.50 0.09 0.35 0.00 0.00 0.00 179.25 180.19 3k4w h PHE 144 N 0.93 0.42 -0.67 0.00 3.57 -1.18 -1.54 116.94 118.46 3k4w h PHE 144 Ca 0.21 -0.04 -0.02 0.00 3.53 0.00 0.00 57.97 61.65 3k4w h PHE 144 Cb 0.26 -0.12 -0.03 0.00 2.79 0.00 0.00 35.95 38.84 3k4w h PHE 144 CO 0.02 0.44 0.33 0.00 -2.23 0.00 0.00 178.31 176.87 3k4w h GLU 146 N 0.93 0.38 -0.50 0.00 4.81 -0.79 -1.53 114.58 117.88 3k4w h GLU 146 Ca 0.23 -0.12 -0.03 0.00 -0.13 0.00 0.00 59.36 59.31 3k4w h GLU 146 Cb 0.11 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.43 3k4w h GLU 146 CO -0.03 0.57 0.19 -0.44 -0.73 0.00 0.00 179.01 178.57 3k4w h ASP 147 N 0.14 0.65 -0.30 1.04 3.32 -1.10 -2.85 116.42 117.32 3k4w h ASP 147 Ca 0.06 -0.08 0.00 0.00 0.02 0.00 0.00 57.03 57.03 3k4w h ASP 147 Cb 0.40 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 39.78 3k4w h ASP 147 CO 0.01 0.59 0.00 0.59 -1.72 0.00 0.00 179.24 178.71 3k4w n ASN 148 N -4.35 2.29 -2.14 6.45 3.02 0.11 -4.94 115.26 115.70 3k4w n ASN 148 Ca 0.04 -1.86 -0.20 0.00 -0.03 0.00 0.00 54.58 52.53 3k4w n ASN 148 Cb 0.16 -0.20 -0.03 0.00 -0.61 0.00 0.00 39.78 39.11 3k4w n ASN 148 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3k4w n GLY 149 N 1.24 0.04 3.67 7.41 0.00 -0.72 -4.98 105.19 111.85 3k4w n GLY 149 Ca 0.17 -0.04 -0.40 0.00 0.00 0.00 0.00 46.02 45.75 3k4w n GLY 149 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3k4w s ILE 150 N -2.95 5.02 0.31 -0.61 1.01 -0.66 -4.58 121.20 118.74 3k4w s ILE 150 Ca 0.00 1.22 -0.29 0.00 0.00 0.00 0.00 60.65 61.58 3k4w s ILE 150 Cb 0.00 -3.96 -0.10 0.00 0.01 0.00 0.00 42.46 38.41 3k4w s ILE 150 CO 0.00 0.12 1.21 -2.84 0.00 0.00 0.00 174.94 173.44 3k4w s PRO 151 N 1.81 4.47 -0.12 2.79 0.02 -1.26 -4.58 135.00 138.12 3k4w s PRO 151 Ca 0.30 2.03 0.02 0.00 0.02 0.00 0.00 61.00 63.37 3k4w s PRO 151 Cb -0.16 -3.11 -0.00 0.00 0.02 0.00 0.00 34.50 31.25 3k4w s PRO 151 CO 0.11 -0.02 -0.20 0.08 -0.33 0.00 0.00 177.00 176.64 3k4w s VAL 152 N -1.16 2.39 -0.15 3.83 1.01 0.13 -2.72 120.40 123.73 3k4w s VAL 152 Ca 0.47 -0.89 -0.13 0.00 0.00 0.00 0.00 61.98 61.43 3k4w s VAL 152 Cb -0.36 -1.96 -0.05 0.00 0.00 0.00 0.00 36.38 34.02 3k4w s VAL 152 CO 0.47 0.54 0.28 -0.63 0.00 0.00 0.00 175.10 175.77 3k4w s ILE 153 N 0.43 5.31 -0.04 2.22 1.01 0.57 -1.32 121.20 129.39 3k4w s ILE 153 Ca -0.14 0.51 0.03 0.00 0.00 0.00 0.00 60.65 61.05 3k4w s ILE 153 Cb -0.17 -3.61 0.00 0.00 0.01 0.00 0.00 42.46 38.70 3k4w s ILE 153 CO 0.06 0.42 -0.11 0.00 0.00 0.00 0.00 174.94 175.32 3k4w s MET 154 N 0.25 1.23 -0.42 2.79 0.23 -0.40 -0.76 119.30 122.21 3k4w s MET 154 Ca 0.16 -0.37 -0.29 0.00 -1.03 0.00 0.00 55.69 54.16 3k4w s MET 154 Cb -0.13 -1.10 0.02 0.00 -1.53 0.00 0.00 34.83 32.09 3k4w s MET 154 CO 0.04 0.11 1.18 1.41 -2.03 0.00 0.00 175.02 175.73 3k4w s MET 155 N 0.28 3.79 -0.02 3.16 1.75 -0.78 -1.05 119.30 126.43 3k4w s MET 155 Ca -0.06 0.78 0.02 0.00 -1.25 0.00 0.00 55.69 55.18 3k4w s MET 155 Cb -0.11 -3.89 0.03 0.00 2.84 0.00 0.00 34.83 33.71 3k4w s MET 155 CO 0.01 -1.29 0.81 0.25 -0.65 0.00 0.00 175.02 174.15 3k4w n THR 156 N 6.63 0.37 -4.48 10.11 -2.24 -1.18 -4.83 114.28 118.67 3k4w n THR 156 Ca 0.13 -0.41 -0.23 0.00 -2.27 0.00 0.00 64.05 61.27 3k4w n THR 156 Cb 0.48 0.62 -0.10 0.00 -2.10 0.00 0.00 70.33 69.23 3k4w n THR 156 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 3k4w s GLY 157 N -0.81 2.01 0.00 3.38 0.00 -1.13 -3.97 107.32 106.80 3k4w s GLY 157 Ca 0.04 -2.00 0.00 0.00 0.00 0.00 0.00 44.72 42.76 3k4w s GLY 157 CO 0.00 -1.91 0.00 0.61 0.00 0.00 0.00 173.10 171.80 3k4w n GLY 158 N -0.68 1.71 2.34 0.20 0.00 0.23 -3.49 105.19 105.51 3k4w n GLY 158 Ca -0.05 -0.59 -0.39 0.00 0.00 0.00 0.00 46.02 44.99 3k4w n GLY 158 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3k4w n ASN 159 N 0.15 8.51 0.24 1.61 3.02 -1.26 -4.66 115.26 122.88 3k4w n ASN 159 Ca 0.00 -2.63 0.13 0.00 -0.03 0.00 0.00 54.58 52.05 3k4w n ASN 159 Cb 0.00 -1.55 0.46 0.00 -0.61 0.00 0.00 39.78 38.08 3k4w n ASN 159 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3k4w h ALA 160 N 5.01 0.99 -2.46 5.41 0.00 -1.88 -3.47 119.26 122.86 3k4w h ALA 160 Ca 0.85 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.69 3k4w h ALA 160 Cb 0.30 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.08 3k4w h ALA 160 CO 1.77 0.09 0.00 0.41 0.00 0.00 0.00 179.25 181.52 3k4w n GLY 161 N 0.43 2.68 0.35 0.00 0.00 -1.26 -3.54 105.19 103.85 3k4w n GLY 161 Ca 0.02 -1.01 0.16 0.00 0.00 0.00 0.00 46.02 45.18 3k4w n GLY 161 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3k4w h PRO 162 N 0.00 0.10 -3.40 1.61 0.11 -1.91 -3.46 132.00 125.05 3k4w h PRO 162 Ca 0.00 -0.01 -0.05 0.00 0.11 0.00 0.00 66.00 66.06 3k4w h PRO 162 Cb 0.00 -0.02 -0.06 0.00 0.11 0.00 0.00 31.00 31.03 3k4w h PRO 162 CO 0.00 0.06 0.05 0.16 -0.21 0.00 0.00 178.00 178.07 3k4w s ASP 163 N -6.36 0.04 0.44 -2.05 1.47 -1.26 -5.06 116.67 103.88 3k4w s ASP 163 Ca -0.06 -0.97 0.30 0.00 1.18 0.00 0.00 52.55 53.00 3k4w s ASP 163 Cb 0.19 0.70 1.33 0.00 -0.34 0.00 0.00 42.92 44.80 3k4w s ASP 163 CO 0.73 -1.34 1.90 -0.29 0.68 0.00 0.00 175.17 176.84 3k4w h ILE 164 N 2.11 0.00 -0.01 2.11 2.10 -1.95 -2.27 117.51 119.60 3k4w h ILE 164 Ca -0.26 -0.31 0.00 0.00 1.08 0.00 0.00 64.86 65.37 3k4w h ILE 164 Cb 1.25 1.17 -0.00 0.00 -1.09 0.00 0.00 36.82 38.15 3k4w h ILE 164 CO 0.34 0.00 0.01 0.71 -1.08 0.00 0.00 178.15 178.12 3k4w h THR 165 N 0.00 0.78 0.00 2.19 1.35 -1.97 -0.71 112.91 114.54 3k4w h THR 165 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 3k4w h THR 165 Cb 0.36 1.00 0.00 0.00 -1.73 0.00 0.00 68.15 67.78 3k4w h THR 165 CO 0.00 0.00 0.00 -1.22 -0.25 0.00 0.00 175.52 174.05 3k4w n TYR 166 N -4.22 0.00 -0.08 4.73 4.01 -0.86 -2.21 117.16 118.53 3k4w n TYR 166 Ca -0.03 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.71 3k4w n TYR 166 Cb 0.09 -0.13 0.00 0.00 -0.31 0.00 0.00 39.34 38.99 3k4w n TYR 166 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 3k4w n THR 167 N -1.13 0.00 -1.63 -0.72 -2.24 -0.29 -4.71 114.28 103.56 3k4w n THR 167 Ca 0.09 -0.45 -0.49 0.00 -2.27 0.00 0.00 64.05 60.92 3k4w n THR 167 Cb 0.08 1.08 -0.05 0.00 -2.10 0.00 0.00 70.33 69.34 3k4w n THR 167 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 3k4w n ASN 168 N -0.11 2.38 0.10 3.42 2.85 -0.94 -4.81 115.26 118.15 3k4w n ASN 168 Ca 0.00 1.10 0.11 0.00 -0.11 0.00 0.00 54.58 55.68 3k4w n ASN 168 Cb 0.02 -1.30 0.45 0.00 1.24 0.00 0.00 39.78 40.19 3k4w n ASN 168 CO 0.00 0.00 0.00 -0.81 -2.11 0.00 0.00 177.26 174.34 3k4w n PRO 169 N 3.10 0.16 0.21 1.20 -0.04 -1.26 -2.27 135.00 136.09 3k4w n PRO 169 Ca 0.18 0.38 0.11 0.00 -0.04 0.00 0.00 63.50 64.13 3k4w n PRO 169 Cb 0.24 -1.79 0.65 0.00 -0.04 0.00 0.00 33.50 32.56 3k4w n PRO 169 CO 0.00 0.00 0.00 1.05 -0.04 0.00 0.00 175.50 176.51 3k4w h GLU 170 N 0.00 0.00 0.13 0.54 4.11 -1.96 -1.96 114.58 115.45 3k4w h GLU 170 Ca 0.00 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.42 3k4w h GLU 170 Cb 0.35 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.60 3k4w h GLU 170 CO 0.00 0.00 -0.06 0.45 0.07 0.00 0.00 179.01 179.47 3k4w h HIS 171 N 0.00 -0.16 -0.02 2.06 3.86 -1.82 -2.51 115.15 116.57 3k4w h HIS 171 Ca 0.05 -0.00 -0.04 0.00 -1.16 0.00 0.00 60.37 59.22 3k4w h HIS 171 Cb 0.22 0.05 -0.01 0.00 1.06 0.00 0.00 27.41 28.73 3k4w h HIS 171 CO 0.00 0.30 -0.19 0.97 0.86 0.00 0.00 177.93 179.87 3k4w h ILE 172 N -0.78 1.15 -0.25 2.45 2.10 -1.76 -2.88 117.51 117.53 3k4w h ILE 172 Ca -0.02 -0.70 -0.06 0.00 1.08 0.00 0.00 64.86 65.17 3k4w h ILE 172 Cb 0.54 1.35 -0.01 0.00 -1.09 0.00 0.00 36.82 37.61 3k4w h ILE 172 CO 0.03 0.20 -0.09 -0.78 -1.08 0.00 0.00 178.15 176.43 3k4w h ASP 173 N 0.02 0.39 -0.28 2.19 3.58 -1.29 -2.10 116.42 118.93 3k4w h ASP 173 Ca 0.00 -0.08 -0.05 0.00 0.42 0.00 0.00 57.03 57.32 3k4w h ASP 173 Cb 0.36 -0.10 -0.01 0.00 1.72 0.00 0.00 39.33 41.29 3k4w h ASP 173 CO 0.03 0.52 -0.02 0.03 -2.88 0.00 0.00 179.24 176.91 3k4w h ARG 174 N 0.39 0.51 -0.22 0.28 3.08 -1.22 -2.36 114.38 114.83 3k4w h ARG 174 Ca 0.08 -0.17 0.03 0.00 0.07 0.00 0.00 59.98 59.98 3k4w h ARG 174 Cb 0.40 -0.04 -0.03 0.00 0.08 0.00 0.00 29.97 30.38 3k4w h ARG 174 CO 0.02 0.68 0.06 0.28 -1.07 0.00 0.00 179.97 179.94 3k4w h VAL 175 N 0.29 0.92 -0.76 2.04 2.07 -1.47 0.69 116.25 120.03 3k4w h VAL 175 Ca 0.08 -0.05 -0.03 0.00 0.82 0.00 0.00 66.70 67.52 3k4w h VAL 175 Cb 0.46 0.76 -0.04 0.00 -1.52 0.00 0.00 31.29 30.95 3k4w h VAL 175 CO 0.02 0.03 0.37 -0.07 0.02 0.00 0.00 177.57 177.93 3k4w h LEU 176 N 0.15 0.98 -0.78 2.57 3.38 -1.42 0.12 115.31 120.31 3k4w h LEU 176 Ca 0.10 -0.11 -0.11 0.00 0.09 0.00 0.00 57.88 57.85 3k4w h LEU 176 Cb 0.08 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 3k4w h LEU 176 CO -0.11 0.83 -0.52 1.23 0.09 0.00 0.00 178.44 179.95 3k4w h GLY 177 N 1.12 0.00 0.72 0.83 0.00 -1.04 -3.10 103.07 101.60 3k4w h GLY 177 Ca 0.26 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.59 3k4w h GLY 177 CO -0.03 0.00 -1.15 1.22 0.00 0.00 0.00 176.54 176.57 3k4w n ASP 178 N -3.65 0.62 -3.46 0.19 8.00 0.20 -4.39 116.55 114.05 3k4w n ASP 178 Ca -0.01 0.10 -0.26 0.00 0.71 0.00 0.00 54.79 55.33 3k4w n ASP 178 Cb 0.59 0.80 -0.09 0.00 -0.02 0.00 0.00 41.12 42.39 3k4w n ASP 178 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 3k4w n PHE 179 N -2.35 1.69 0.32 1.24 3.72 0.38 -4.98 117.46 117.48 3k4w n PHE 179 Ca 0.00 -3.88 0.15 0.00 -0.05 0.00 0.00 57.45 53.67 3k4w n PHE 179 Cb 0.51 -0.37 0.67 0.00 -0.94 0.00 0.00 39.48 39.35 3k4w n PHE 179 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 3k4w h PRO 180 N 4.66 0.00 -0.29 -1.08 0.13 -1.74 -1.40 132.00 132.28 3k4w h PRO 180 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 3k4w h PRO 180 Cb 0.78 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.91 3k4w h PRO 180 CO 0.63 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.15 3k4w n ASP 181 N -2.71 3.06 -4.70 1.44 8.00 -1.26 -4.67 116.55 115.71 3k4w n ASP 181 Ca 0.01 -2.27 -0.42 0.00 0.71 0.00 0.00 54.79 52.82 3k4w n ASP 181 Cb 0.23 -0.29 -0.03 0.00 -0.02 0.00 0.00 41.12 41.01 3k4w n ASP 181 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 3k4w s LEU 182 N -1.48 4.32 -0.22 0.64 2.96 -0.53 -4.90 118.68 119.47 3k4w s LEU 182 Ca 0.26 1.67 -0.29 0.00 -0.22 0.00 0.00 54.13 55.55 3k4w s LEU 182 Cb 0.17 -3.57 -0.00 0.00 0.50 0.00 0.00 46.19 43.29 3k4w s LEU 182 CO 0.12 -0.37 1.23 -0.89 -1.32 0.00 0.00 176.35 175.13 3k4w s THR 183 N 1.42 4.30 -0.05 3.68 2.01 -1.26 -4.75 115.64 120.99 3k4w s THR 183 Ca 0.52 1.54 0.06 0.00 0.31 0.00 0.00 61.69 64.13 3k4w s THR 183 Cb -0.21 -4.11 -0.01 0.00 0.01 0.00 0.00 72.50 68.17 3k4w s THR 183 CO 0.25 -0.26 -0.25 -0.69 -0.69 0.00 0.00 174.62 172.97 3k4w s VAL 184 N 3.74 2.01 -0.20 3.82 1.01 -0.92 -0.69 120.40 129.18 3k4w s VAL 184 Ca 0.53 -1.05 -0.02 0.00 0.00 0.00 0.00 61.98 61.44 3k4w s VAL 184 Cb -0.19 -1.70 -0.00 0.00 0.00 0.00 0.00 36.38 34.49 3k4w s VAL 184 CO 0.16 0.56 -0.09 -0.69 0.00 0.00 0.00 175.10 175.04 3k4w s VAL 185 N -0.20 3.06 -0.46 2.92 1.01 -0.43 -0.18 120.40 126.11 3k4w s VAL 185 Ca -0.02 -0.61 -0.26 0.00 0.00 0.00 0.00 61.98 61.08 3k4w s VAL 185 Cb -0.13 -2.36 0.03 0.00 0.00 0.00 0.00 36.38 33.92 3k4w s VAL 185 CO 0.03 0.46 0.99 -0.55 0.00 0.00 0.00 175.10 176.03 3k4w s SER 186 N 1.23 6.55 0.26 3.32 0.15 -0.01 -1.28 113.70 123.92 3k4w s SER 186 Ca 0.03 0.24 -0.29 0.00 0.70 0.00 0.00 55.95 56.63 3k4w s SER 186 Cb -0.14 -2.48 -0.09 0.00 -1.71 0.00 0.00 66.02 61.60 3k4w s SER 186 CO -0.04 -1.10 0.97 -0.94 1.20 0.00 0.00 173.24 173.34 3k4w s SER 187 N 2.30 7.53 0.00 5.45 1.04 -0.22 -1.96 113.70 127.84 3k4w s SER 187 Ca 0.40 2.00 0.00 0.00 0.48 0.00 0.00 55.95 58.83 3k4w s SER 187 Cb -0.09 -2.61 0.00 0.00 0.10 0.00 0.00 66.02 63.42 3k4w s SER 187 CO 0.27 0.07 0.00 1.41 0.98 0.00 0.00 173.24 175.97 3k4w n HIS 188 N 1.30 0.00 -1.89 5.02 8.25 -0.04 -2.86 115.22 125.00 3k4w n HIS 188 Ca -0.01 0.00 -0.16 0.00 -0.26 0.00 0.00 57.72 57.29 3k4w n HIS 188 Cb 0.47 -0.70 -0.04 0.00 1.12 0.00 0.00 29.99 30.84 3k4w n HIS 188 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3k4w n GLY 189 N -1.69 0.62 2.15 -1.41 0.00 -0.91 -1.39 105.19 102.56 3k4w n GLY 189 Ca 0.00 -0.25 -0.12 0.00 0.00 0.00 0.00 46.02 45.66 3k4w n GLY 189 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 3k4w n ASN 190 N -0.78 -3.36 -4.71 1.61 5.15 -1.25 -4.86 115.26 107.05 3k4w n ASN 190 Ca -0.17 0.25 -0.43 0.00 -0.60 0.00 0.00 54.58 53.63 3k4w n ASN 190 Cb 0.58 -3.03 -0.01 0.00 -0.53 0.00 0.00 39.78 36.79 3k4w n ASN 190 CO 0.00 0.00 0.00 1.87 1.40 0.00 0.00 177.26 180.53 3k4w n TRP 191 N -2.51 2.47 0.27 1.20 -0.00 -0.49 -1.28 117.44 117.10 3k4w n TRP 191 Ca -0.13 0.48 0.09 0.00 -0.00 0.00 0.00 57.50 57.94 3k4w n TRP 191 Cb 0.49 -2.47 0.24 0.00 -0.00 0.00 0.00 31.31 29.57 3k4w n TRP 191 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 177.69 177.34 3k4w n PRO 192 N 0.97 2.27 -2.06 5.87 -0.04 -1.26 -0.60 135.00 140.16 3k4w n PRO 192 Ca 0.06 -1.94 -0.40 0.00 -0.04 0.00 0.00 63.50 61.18 3k4w n PRO 192 Cb 0.36 -1.43 -0.00 0.00 -0.04 0.00 0.00 33.50 32.39 3k4w n PRO 192 CO 0.00 0.00 0.00 0.91 -0.04 0.00 0.00 175.50 176.37 3k4w n TRP 193 N 1.07 2.59 -0.06 0.54 7.02 -0.40 -4.70 117.44 123.49 3k4w n TRP 193 Ca 0.18 -2.75 -0.14 0.00 -1.02 0.00 0.00 57.50 53.77 3k4w n TRP 193 Cb 0.46 -1.73 -0.07 0.00 -2.42 0.00 0.00 31.31 27.55 3k4w n TRP 193 CO 0.00 0.00 0.00 0.28 -2.02 0.00 0.00 177.69 175.95 3k4w h VAL 194 N 2.52 1.35 -0.79 -0.99 2.07 -1.90 0.06 116.25 118.58 3k4w h VAL 194 Ca 0.67 -1.53 0.08 0.00 0.82 0.00 0.00 66.70 66.74 3k4w h VAL 194 Cb 0.32 1.94 -0.07 0.00 -1.52 0.00 0.00 31.29 31.96 3k4w h VAL 194 CO 1.42 0.46 0.45 1.56 0.02 0.00 0.00 177.57 181.48 3k4w h GLN 195 N 0.12 0.75 0.02 1.57 4.20 -1.96 -2.79 115.11 117.02 3k4w h GLN 195 Ca 0.01 -0.05 -0.00 0.00 0.06 0.00 0.00 58.65 58.67 3k4w h GLN 195 Cb 0.88 -0.17 0.00 0.00 0.30 0.00 0.00 27.48 28.49 3k4w h GLN 195 CO 0.07 0.50 -0.01 0.93 -0.67 0.00 0.00 178.83 179.64 3k4w h GLU 196 N 0.77 -0.03 0.00 1.46 3.07 -1.90 -3.20 114.58 114.75 3k4w h GLU 196 Ca 0.37 0.00 -0.03 0.00 -0.50 0.00 0.00 59.36 59.21 3k4w h GLU 196 Cb 0.31 0.01 -0.00 0.00 -0.84 0.00 0.00 28.75 28.22 3k4w h GLU 196 CO -0.23 0.32 -0.12 0.97 -1.40 0.00 0.00 179.01 178.55 3k4w h ILE 197 N -0.37 0.61 -0.22 3.13 6.09 -0.88 -1.60 117.51 124.27 3k4w h ILE 197 Ca -0.00 -0.52 -0.03 0.00 -1.37 0.00 0.00 64.86 62.94 3k4w h ILE 197 Cb 0.36 1.33 -0.01 0.00 0.47 0.00 0.00 36.82 38.97 3k4w h ILE 197 CO 0.00 0.12 0.01 0.40 -3.07 0.00 0.00 178.15 175.61 3k4w h ILE 198 N 0.00 1.25 -0.78 2.19 1.08 -1.50 -0.38 117.51 119.36 3k4w h ILE 198 Ca -0.00 -0.84 0.08 0.00 -0.39 0.00 0.00 64.86 63.71 3k4w h ILE 198 Cb 0.32 1.38 -0.06 0.00 -3.07 0.00 0.00 36.82 35.38 3k4w h ILE 198 CO 0.02 0.26 0.45 -0.74 -0.69 0.00 0.00 178.15 177.45 3k4w h HIS 199 N 0.15 0.83 -0.27 1.37 -0.00 -1.44 0.33 115.15 116.11 3k4w h HIS 199 Ca 0.06 0.03 -0.01 0.00 -0.00 0.00 0.00 60.37 60.45 3k4w h HIS 199 Cb 0.37 -0.26 -0.01 0.00 -0.00 0.00 0.00 27.41 27.51 3k4w h HIS 199 CO 0.03 0.38 0.13 0.28 -0.00 0.00 0.00 177.93 178.74 3k4w h VAL 200 N 0.80 1.16 -0.52 5.26 2.07 -1.08 0.03 116.25 123.97 3k4w h VAL 200 Ca 0.36 -0.46 -0.04 0.00 0.82 0.00 0.00 66.70 67.38 3k4w h VAL 200 Cb 0.26 0.95 -0.02 0.00 -1.52 0.00 0.00 31.29 30.96 3k4w h VAL 200 CO -0.21 0.16 0.15 0.00 0.02 0.00 0.00 177.57 177.69 3k4w h ALA 201 N 0.98 1.28 -0.74 1.67 0.00 -0.92 0.39 119.26 121.91 3k4w h ALA 201 Ca 0.09 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.81 3k4w h ALA 201 Cb 0.14 -0.21 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 3k4w h ALA 201 CO -0.01 0.51 0.41 0.35 0.00 0.00 0.00 179.25 180.51 3k4w h PHE 202 N 0.76 1.02 0.19 0.00 3.57 -0.61 -3.19 116.94 118.68 3k4w h PHE 202 Ca 0.17 -0.02 -0.33 0.00 3.53 0.00 0.00 57.97 61.31 3k4w h PHE 202 Cb 0.25 -0.33 0.01 0.00 2.79 0.00 0.00 35.95 38.68 3k4w h PHE 202 CO 0.01 0.72 -1.61 -0.09 -2.23 0.00 0.00 178.31 175.11 3k4w h ARG 203 N 1.02 0.40 -4.40 1.11 2.43 -0.24 -3.44 114.38 111.27 3k4w h ARG 203 Ca 0.26 -0.68 -0.72 0.00 -0.81 0.00 0.00 59.98 58.04 3k4w h ARG 203 Cb 0.03 0.25 -0.30 0.00 -0.42 0.00 0.00 29.97 29.54 3k4w h ARG 203 CO -0.04 1.30 -0.45 1.03 -1.51 0.00 0.00 179.97 180.30 3k4w s ARG 204 N -2.60 2.45 0.06 0.20 1.81 0.13 -4.98 118.95 116.03 3k4w s ARG 204 Ca -0.12 -1.64 0.18 0.00 -1.72 0.00 0.00 55.73 52.43 3k4w s ARG 204 Cb 0.05 -3.80 0.75 0.00 -0.45 0.00 0.00 34.95 31.51 3k4w s ARG 204 CO 0.88 -1.07 1.56 -0.35 -0.68 0.00 0.00 175.30 175.64 3k4w n PRO 205 N 4.86 0.05 0.00 3.54 -0.04 -1.26 -2.33 135.00 139.81 3k4w n PRO 205 Ca -0.08 0.27 0.13 0.00 -0.04 0.00 0.00 63.50 63.78 3k4w n PRO 205 Cb 0.42 -1.59 0.33 0.00 -0.04 0.00 0.00 33.50 32.61 3k4w n PRO 205 CO 0.00 0.00 0.00 0.27 -0.04 0.00 0.00 175.50 175.73 3k4w n ASN 206 N -1.69 1.47 -4.70 3.54 6.94 -1.26 -4.93 115.26 114.63 3k4w n ASN 206 Ca 0.03 -1.24 -0.41 0.00 -0.02 0.00 0.00 54.58 52.95 3k4w n ASN 206 Cb 0.20 0.15 -0.04 0.00 -2.36 0.00 0.00 39.78 37.73 3k4w n ASN 206 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 3k4w s LEU 207 N -2.33 4.29 -0.03 -4.53 2.96 -0.98 -2.16 118.68 115.89 3k4w s LEU 207 Ca 0.27 1.33 0.05 0.00 -0.22 0.00 0.00 54.13 55.56 3k4w s LEU 207 Cb 0.20 -3.28 -0.03 0.00 0.50 0.00 0.00 46.19 43.58 3k4w s LEU 207 CO 0.47 -0.25 -0.17 -0.31 -1.32 0.00 0.00 176.35 174.77 3k4w s TYR 208 N 1.30 2.62 -0.10 5.38 2.02 0.74 -4.87 117.35 124.44 3k4w s TYR 208 Ca 0.42 -0.21 -0.00 0.00 -0.37 0.00 0.00 57.07 56.91 3k4w s TYR 208 Cb -0.18 -1.58 -0.03 0.00 -0.40 0.00 0.00 41.96 39.77 3k4w s TYR 208 CO 0.19 0.16 -0.08 -0.51 -1.57 0.00 0.00 175.55 173.74 3k4w s LEU 209 N -0.82 3.04 -0.45 -1.29 1.43 -0.05 -0.83 118.68 119.71 3k4w s LEU 209 Ca 0.12 -0.14 0.03 0.00 -1.03 0.00 0.00 54.13 53.11 3k4w s LEU 209 Cb -0.10 -1.68 0.16 0.00 0.03 0.00 0.00 46.19 44.60 3k4w s LEU 209 CO 0.01 0.27 0.32 -0.55 0.23 0.00 0.00 176.35 176.63 3k4w s SER 210 N -0.25 2.54 0.51 2.29 0.15 -0.83 -1.51 113.70 116.61 3k4w s SER 210 Ca 0.03 -2.95 0.32 0.00 0.70 0.00 0.00 55.95 54.05 3k4w s SER 210 Cb -0.13 -0.69 1.31 0.00 -1.71 0.00 0.00 66.02 64.80 3k4w s SER 210 CO 0.03 -0.20 1.94 1.55 1.20 0.00 0.00 173.24 177.76 3k4w h PRO 211 N 6.02 0.00 0.00 5.44 0.13 -1.80 -0.03 132.00 141.76 3k4w h PRO 211 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 3k4w h PRO 211 Cb 0.90 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.03 3k4w h PRO 211 CO 0.42 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 177.79 3k4w n ASP 212 N -2.96 0.00 -0.18 1.44 5.68 -1.26 -1.14 116.55 118.13 3k4w n ASP 212 Ca 0.01 0.00 0.25 0.00 -0.50 0.00 0.00 54.79 54.54 3k4w n ASP 212 Cb 0.30 0.00 0.66 0.00 -1.14 0.00 0.00 41.12 40.93 3k4w n ASP 212 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3k4w h MET 213 N 0.00 0.12 0.00 0.11 -0.00 -1.73 -2.41 114.93 111.02 3k4w h MET 213 Ca 0.00 -0.01 0.00 0.00 -0.00 0.00 0.00 59.70 59.69 3k4w h MET 213 Cb 0.00 -0.03 0.00 0.00 -0.00 0.00 0.00 31.60 31.57 3k4w h MET 213 CO 0.00 0.08 0.00 0.66 -0.00 0.00 0.00 176.91 177.65 3k4w n TYR 214 N -4.36 0.00 0.21 -0.10 4.01 -0.30 -1.98 117.16 114.65 3k4w n TYR 214 Ca 0.18 0.00 0.09 0.00 -0.16 0.00 0.00 57.90 58.01 3k4w n TYR 214 Cb 0.84 -0.36 0.40 0.00 -0.31 0.00 0.00 39.34 39.91 3k4w n TYR 214 CO 0.00 0.00 0.00 1.25 -0.46 0.00 0.00 176.86 177.65 3k4w h LEU 215 N 0.00 0.00 -8.46 7.72 5.85 -1.53 -3.41 115.31 115.48 3k4w h LEU 215 Ca 0.00 0.00 -0.52 0.00 0.84 0.00 0.00 57.88 58.20 3k4w h LEU 215 Cb 0.32 0.00 -0.05 0.00 0.37 0.00 0.00 40.66 41.29 3k4w h LEU 215 CO 0.00 0.24 1.24 -0.47 -0.34 0.00 0.00 178.44 179.10 3k4w s TYR 216 N -3.55 1.91 -1.37 1.25 5.04 -0.84 -4.31 117.35 115.47 3k4w s TYR 216 Ca 0.01 0.48 -0.07 0.00 -2.44 0.00 0.00 57.07 55.06 3k4w s TYR 216 Cb 0.10 -4.29 0.03 0.00 0.35 0.00 0.00 41.96 38.14 3k4w s TYR 216 CO 0.65 -2.22 0.96 -1.71 -1.34 0.00 0.00 175.55 171.89 3k4w n ASN 217 N 11.38 -3.75 -4.11 4.32 5.15 -1.26 -4.97 115.26 122.01 3k4w n ASN 217 Ca 0.14 -0.71 -0.08 0.00 -0.60 0.00 0.00 54.58 53.33 3k4w n ASN 217 Cb 0.51 -4.42 -0.10 0.00 -0.53 0.00 0.00 39.78 35.24 3k4w n ASN 217 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 3k4w s LEU 218 N -6.98 2.14 0.52 1.20 1.43 -1.26 -5.10 118.68 110.63 3k4w s LEU 218 Ca 0.36 -1.09 -0.22 0.00 -1.03 0.00 0.00 54.13 52.14 3k4w s LEU 218 Cb -0.17 0.26 -0.06 0.00 0.03 0.00 0.00 46.19 46.24 3k4w s LEU 218 CO 0.78 -0.66 1.26 -2.65 0.23 0.00 0.00 176.35 175.31 3k4w n PRO 219 N 0.01 1.60 -0.12 1.29 -0.02 -1.26 -2.07 135.00 134.43 3k4w n PRO 219 Ca -0.10 0.58 0.00 0.00 -2.02 0.00 0.00 63.50 61.97 3k4w n PRO 219 Cb 0.62 -2.44 0.00 0.00 -0.02 0.00 0.00 33.50 31.66 3k4w n PRO 219 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3k4w n GLY 220 N 0.88 1.41 0.27 -1.23 0.00 -1.26 -4.90 105.19 100.36 3k4w n GLY 220 Ca 0.10 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.14 3k4w n GLY 220 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 3k4w h HIS 221 N 0.00 0.64 0.00 1.61 6.17 -1.71 -0.65 115.15 121.22 3k4w h HIS 221 Ca 0.00 0.03 -0.20 0.00 0.71 0.00 0.00 60.37 60.91 3k4w h HIS 221 Cb 0.00 -0.18 -0.03 0.00 2.52 0.00 0.00 27.41 29.72 3k4w h HIS 221 CO 0.00 0.22 -0.94 0.00 0.71 0.00 0.00 177.93 177.92 3k4w h ALA 222 N 1.45 0.42 -0.26 5.26 0.00 -1.91 -2.00 119.26 122.21 3k4w h ALA 222 Ca 0.36 -0.85 0.00 0.00 0.00 0.00 0.00 54.91 54.42 3k4w h ALA 222 Cb 0.40 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 3k4w h ALA 222 CO -0.28 1.17 0.17 -0.44 0.00 0.00 0.00 179.25 179.87 3k4w h ASP 223 N 0.00 0.30 -0.29 0.00 3.32 -1.77 -0.05 116.42 117.93 3k4w h ASP 223 Ca -0.01 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.04 3k4w h ASP 223 Cb 1.69 -0.07 -0.02 0.00 0.22 0.00 0.00 39.33 41.15 3k4w h ASP 223 CO 0.12 0.22 0.19 -0.26 -1.72 0.00 0.00 179.24 177.78 3k4w h PHE 224 N 0.35 0.35 -0.39 4.55 0.04 -0.96 -2.35 116.94 118.53 3k4w h PHE 224 Ca 0.10 0.01 -0.09 0.00 2.80 0.00 0.00 57.97 60.79 3k4w h PHE 224 Cb -0.04 -0.12 -0.01 0.00 2.20 0.00 0.00 35.95 37.98 3k4w h PHE 224 CO -0.06 0.22 -0.09 0.82 -0.60 0.00 0.00 178.31 178.60 3k4w h ILE 225 N 0.38 1.28 -0.90 -0.55 1.08 -1.24 -0.45 117.51 117.11 3k4w h ILE 225 Ca 0.11 -1.17 0.07 0.00 -0.39 0.00 0.00 64.86 63.47 3k4w h ILE 225 Cb -0.04 1.24 -0.06 0.00 -3.07 0.00 0.00 36.82 34.89 3k4w h ILE 225 CO -0.03 0.39 0.59 -0.61 -0.69 0.00 0.00 178.15 177.80 3k4w h GLN 226 N 0.55 0.98 0.01 2.37 4.15 -0.98 -1.99 115.11 120.20 3k4w h GLN 226 Ca 0.10 -0.06 -0.20 0.00 0.77 0.00 0.00 58.65 59.26 3k4w h GLN 226 Cb 0.61 -0.22 -0.01 0.00 0.21 0.00 0.00 27.48 28.07 3k4w h GLN 226 CO 0.04 0.65 -0.90 0.00 -1.93 0.00 0.00 178.83 176.69 3k4w h ALA 227 N 1.52 0.50 -0.40 3.38 0.00 -1.14 -3.01 119.26 120.12 3k4w h ALA 227 Ca 0.39 -0.74 0.11 0.00 0.00 0.00 0.00 54.91 54.66 3k4w h ALA 227 Cb 0.23 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.92 3k4w h ALA 227 CO -0.15 0.95 0.28 0.00 0.00 0.00 0.00 179.25 180.33 3k4w h ALA 228 N 0.98 2.31 -0.03 0.00 0.00 -0.36 -1.13 119.26 121.02 3k4w h ALA 228 Ca -0.04 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.85 3k4w h ALA 228 Cb 1.54 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.34 3k4w h ALA 228 CO 0.13 -0.41 0.00 0.09 0.00 0.00 0.00 179.25 179.06 3k4w n ASN 229 N -4.43 1.58 0.00 0.00 3.02 -0.94 -3.29 115.26 111.20 3k4w n ASN 229 Ca 0.06 -1.54 0.00 0.00 -0.03 0.00 0.00 54.58 53.07 3k4w n ASN 229 Cb 0.44 -0.01 0.00 0.00 -0.61 0.00 0.00 39.78 39.60 3k4w n ASN 229 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 3k4w n SER 230 N 0.24 0.00 0.12 6.41 2.88 -0.74 -4.96 113.62 117.56 3k4w n SER 230 Ca 0.19 0.00 0.12 0.00 -1.33 0.00 0.00 58.87 57.85 3k4w n SER 230 Cb 0.36 0.00 0.45 0.00 -0.75 0.00 0.00 64.21 64.28 3k4w n SER 230 CO 0.00 0.00 0.00 2.22 -1.23 0.00 0.00 175.04 176.03 3k4w n PHE 231 N 0.00 0.85 0.30 0.66 1.16 -1.20 -2.81 117.46 116.41 3k4w n PHE 231 Ca 0.00 0.29 0.12 0.00 -1.87 0.00 0.00 57.45 55.99 3k4w n PHE 231 Cb 0.00 -0.97 0.23 0.00 -1.61 0.00 0.00 39.48 37.13 3k4w n PHE 231 CO 0.00 0.00 0.00 -0.11 -1.87 0.00 0.00 176.76 174.78 3k4w n LEU 232 N -2.23 3.45 -0.33 5.98 7.94 -0.51 -4.48 117.00 126.82 3k4w n LEU 232 Ca 0.04 -1.50 0.13 0.00 -1.11 0.00 0.00 56.01 53.57 3k4w n LEU 232 Cb 0.32 -0.26 0.32 0.00 0.53 0.00 0.00 43.42 44.33 3k4w n LEU 232 CO 0.25 0.75 1.14 0.00 -1.11 0.00 0.00 177.39 178.41 3k4w h ALA 233 N 4.50 1.58 -0.00 1.96 0.00 -1.51 0.28 119.26 126.07 3k4w h ALA 233 Ca 0.00 0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.02 3k4w h ALA 233 Cb 0.97 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.77 3k4w h ALA 233 CO 0.00 -0.18 -0.02 -0.25 0.00 0.00 0.00 179.25 178.80 3k4w n ASP 234 N -4.88 0.03 -0.23 0.00 8.00 -1.26 -4.16 116.55 114.06 3k4w n ASP 234 Ca 0.23 0.16 0.07 0.00 0.71 0.00 0.00 54.79 55.95 3k4w n ASP 234 Cb 0.61 -0.37 0.09 0.00 -0.02 0.00 0.00 41.12 41.44 3k4w n ASP 234 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3k4w n ARG 235 N -1.39 0.85 -4.21 -1.24 1.74 0.05 -4.85 116.66 107.61 3k4w n ARG 235 Ca 0.10 -2.06 -0.29 0.00 -0.77 0.00 0.00 57.85 54.83 3k4w n ARG 235 Cb 0.30 -1.16 -0.09 0.00 -1.02 0.00 0.00 32.46 30.48 3k4w n ARG 235 CO 0.00 0.00 0.00 1.41 -1.52 0.00 0.00 177.63 177.52 3k4w s MET 236 N -1.91 2.19 -0.05 5.56 1.75 -0.98 -0.87 119.30 124.98 3k4w s MET 236 Ca 0.22 -1.02 0.01 0.00 -1.25 0.00 0.00 55.69 53.64 3k4w s MET 236 Cb 0.19 -2.33 0.02 0.00 2.84 0.00 0.00 34.83 35.55 3k4w s MET 236 CO 0.02 0.50 -0.05 -0.51 -0.65 0.00 0.00 175.02 174.33 3k4w s LEU 237 N -2.30 1.27 0.38 4.11 1.43 -0.57 -4.35 118.68 118.65 3k4w s LEU 237 Ca 0.22 -0.15 -0.27 0.00 -1.03 0.00 0.00 54.13 52.91 3k4w s LEU 237 Cb -0.11 -0.50 -0.09 0.00 0.03 0.00 0.00 46.19 45.52 3k4w s LEU 237 CO 0.15 -0.07 1.23 0.12 0.23 0.00 0.00 176.35 178.01 3k4w s PHE 238 N 1.05 3.04 -0.14 0.29 5.36 -0.54 -4.47 117.98 122.56 3k4w s PHE 238 Ca -0.09 1.50 -0.32 0.00 -0.96 0.00 0.00 56.93 57.06 3k4w s PHE 238 Cb -0.14 -3.53 0.13 0.00 -0.34 0.00 0.00 43.02 39.14 3k4w s PHE 238 CO -0.01 -1.59 1.09 0.20 -1.46 0.00 0.00 175.22 173.45 3k4w s GLY 239 N -0.85 -0.30 -0.02 13.12 0.00 -1.26 -1.08 107.32 116.92 3k4w s GLY 239 Ca 0.54 1.65 0.15 0.00 0.00 0.00 0.00 44.72 47.06 3k4w s GLY 239 CO 0.45 0.64 0.34 -1.30 0.00 0.00 0.00 173.10 173.23 3k4w n THR 240 N 0.10 0.00 -1.76 0.90 -2.24 -1.26 -4.17 114.28 105.86 3k4w n THR 240 Ca -0.04 -0.34 -0.17 0.00 -2.27 0.00 0.00 64.05 61.23 3k4w n THR 240 Cb 0.59 0.18 -0.05 0.00 -2.10 0.00 0.00 70.33 68.95 3k4w n THR 240 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3k4w n ALA 241 N -2.00 -0.38 -1.47 6.98 0.00 -0.64 -3.95 120.51 119.05 3k4w n ALA 241 Ca -0.03 0.23 -0.54 0.00 0.00 0.00 0.00 53.44 53.10 3k4w n ALA 241 Cb 0.39 -1.75 -0.06 0.00 0.00 0.00 0.00 19.45 18.03 3k4w n ALA 241 CO 0.00 0.00 0.00 0.98 0.00 0.00 0.00 177.50 178.48 3k4w n TYR 242 N -2.58 0.28 1.35 0.00 9.36 -1.17 0.52 117.16 124.93 3k4w n TYR 242 Ca -0.18 1.00 0.03 0.00 3.32 0.00 0.00 57.90 62.07 3k4w n TYR 242 Cb 0.58 -2.06 0.08 0.00 -0.63 0.00 0.00 39.34 37.31 3k4w n TYR 242 CO 0.00 0.00 0.00 -0.35 0.22 0.00 0.00 176.86 176.73 3k4w n PRO 243 N 1.35 1.46 0.13 2.98 -0.04 -1.26 -0.87 135.00 138.74 3k4w n PRO 243 Ca 0.19 -0.63 0.01 0.00 -0.04 0.00 0.00 63.50 63.03 3k4w n PRO 243 Cb 0.15 -1.19 0.34 0.00 -0.04 0.00 0.00 33.50 32.76 3k4w n PRO 243 CO 0.00 0.00 0.00 0.52 -0.04 0.00 0.00 175.50 175.98 3k4w h MET 244 N 1.00 0.18 -5.84 0.54 2.86 -0.22 -3.43 114.93 110.02 3k4w h MET 244 Ca 0.00 -0.06 -0.56 0.00 -2.06 0.00 0.00 59.70 57.02 3k4w h MET 244 Cb 0.30 -0.02 -0.28 0.00 0.06 0.00 0.00 31.60 31.66 3k4w h MET 244 CO 0.01 0.43 -0.84 0.00 1.06 0.00 0.00 176.91 177.58 3k4w s PRO 246 N -0.66 4.25 0.13 0.00 0.04 -1.26 -4.01 135.00 133.48 3k4w s PRO 246 Ca 0.07 2.33 -0.19 0.00 0.04 0.00 0.00 61.00 63.25 3k4w s PRO 246 Cb -0.08 -3.11 -0.04 0.00 0.04 0.00 0.00 34.50 31.31 3k4w s PRO 246 CO 0.00 -0.46 1.78 -0.07 0.04 0.00 0.00 177.00 178.29 3k4w h LEU 247 N 5.28 0.24 0.19 -3.56 3.38 -1.96 -2.89 115.31 115.99 3k4w h LEU 247 Ca -0.46 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.50 3k4w h LEU 247 Cb 1.22 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.92 3k4w h LEU 247 CO 0.80 0.17 -0.09 0.50 0.09 0.00 0.00 178.44 179.91 3k4w h LYS 248 N 0.30 -0.25 -0.36 1.13 3.64 -1.93 -1.79 116.57 117.31 3k4w h LYS 248 Ca 0.09 0.02 0.05 0.00 -1.27 0.00 0.00 60.65 59.54 3k4w h LYS 248 Cb -0.01 0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 31.82 3k4w h LYS 248 CO -0.04 0.15 0.10 0.93 -2.27 0.00 0.00 179.45 178.32 3k4w h GLU 249 N -0.78 0.23 0.01 1.90 3.07 -1.99 -1.21 114.58 115.80 3k4w h GLU 249 Ca -0.03 -0.01 0.02 0.00 -0.50 0.00 0.00 59.36 58.84 3k4w h GLU 249 Cb 0.51 -0.05 -0.02 0.00 -0.84 0.00 0.00 28.75 28.35 3k4w h GLU 249 CO 0.04 0.15 -0.10 -0.92 -1.40 0.00 0.00 179.01 176.79 3k4w h TYR 250 N 0.23 -0.24 -0.35 4.33 3.20 -1.60 -2.37 116.97 120.16 3k4w h TYR 250 Ca 0.17 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.04 3k4w h TYR 250 Cb 0.18 0.11 -0.02 0.00 1.54 0.00 0.00 36.73 38.54 3k4w h TYR 250 CO -0.17 -0.15 0.17 1.15 -1.64 0.00 0.00 178.16 177.53 3k4w h THR 251 N -0.17 1.16 -1.00 1.81 2.02 -1.18 -0.10 112.91 115.45 3k4w h THR 251 Ca 0.03 -0.44 0.04 0.00 0.77 0.00 0.00 66.41 66.81 3k4w h THR 251 Cb 0.21 0.81 -0.06 0.00 -1.74 0.00 0.00 68.15 67.37 3k4w h THR 251 CO -0.09 0.17 0.66 -0.33 0.37 0.00 0.00 175.52 176.29 3k4w h GLU 252 N 0.43 1.23 -0.51 6.66 5.08 -1.22 0.31 114.58 126.56 3k4w h GLU 252 Ca 0.12 -0.07 -0.12 0.00 -1.00 0.00 0.00 59.36 58.28 3k4w h GLU 252 Cb 0.11 -0.28 -0.02 0.00 0.50 0.00 0.00 28.75 29.06 3k4w h GLU 252 CO -0.02 0.81 -0.17 2.35 -1.00 0.00 0.00 179.01 180.99 3k4w h TRP 253 N 1.27 1.14 -0.35 4.33 7.01 -1.25 -3.18 115.95 124.92 3k4w h TRP 253 Ca 0.40 -0.26 -0.16 0.00 2.11 0.00 0.00 58.89 60.98 3k4w h TRP 253 Cb 0.01 -0.27 -0.00 0.00 -2.10 0.00 0.00 29.16 26.79 3k4w h TRP 253 CO -0.00 1.08 -0.41 0.35 -2.79 0.00 0.00 178.44 176.67 3k4w h PHE 254 N 0.88 1.07 0.00 2.65 3.57 -0.18 -2.62 116.94 122.31 3k4w h PHE 254 Ca 0.12 -0.34 -0.01 0.00 3.53 0.00 0.00 57.97 61.27 3k4w h PHE 254 Cb 0.74 -0.22 -0.00 0.00 2.79 0.00 0.00 35.95 39.26 3k4w h PHE 254 CO 0.05 1.16 -0.06 -0.07 -2.23 0.00 0.00 178.31 177.16 3k4w h LEU 255 N 0.68 0.00 -1.56 0.59 3.38 -0.95 -1.61 115.31 115.84 3k4w h LEU 255 Ca 0.05 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.02 3k4w h LEU 255 Cb 1.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.75 3k4w h LEU 255 CO 0.10 0.06 0.00 0.35 0.09 0.00 0.00 178.44 179.03 3k4w n THR 256 N -4.17 0.74 -2.78 0.22 -2.24 -0.99 -4.93 114.28 100.13 3k4w n THR 256 Ca -0.03 -0.51 -0.35 0.00 -2.27 0.00 0.00 64.05 60.89 3k4w n THR 256 Cb 0.14 -0.02 -0.06 0.00 -2.10 0.00 0.00 70.33 68.29 3k4w n THR 256 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3k4w s LEU 257 N -1.09 4.12 -0.72 3.22 1.43 -0.61 -4.87 118.68 120.16 3k4w s LEU 257 Ca 0.23 1.78 -0.15 0.00 -1.03 0.00 0.00 54.13 54.96 3k4w s LEU 257 Cb 0.14 -4.30 -0.12 0.00 0.03 0.00 0.00 46.19 41.95 3k4w s LEU 257 CO 0.12 -0.26 1.91 -0.81 0.23 0.00 0.00 176.35 177.54 3k4w n PRO 258 N -0.10 1.53 -4.72 1.29 -0.04 -1.26 -4.83 135.00 126.86 3k4w n PRO 258 Ca 0.05 -1.55 -0.33 0.00 -0.04 0.00 0.00 63.50 61.63 3k4w n PRO 258 Cb 0.52 -2.65 -0.15 0.00 -0.04 0.00 0.00 33.50 31.18 3k4w n PRO 258 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 3k4w s ILE 259 N 4.51 2.77 0.50 0.52 1.01 -1.26 -4.97 121.20 124.28 3k4w s ILE 259 Ca 0.47 -0.75 -0.22 0.00 0.00 0.00 0.00 60.65 60.15 3k4w s ILE 259 Cb 0.12 -2.16 -0.06 0.00 0.01 0.00 0.00 42.46 40.37 3k4w s ILE 259 CO 0.06 0.52 1.25 -1.59 0.00 0.00 0.00 174.94 175.19 3k4w s LYS 260 N 0.55 3.49 0.21 2.79 -2.85 -1.26 -4.57 119.74 118.10 3k4w s LYS 260 Ca -0.09 1.98 -0.11 0.00 -1.00 0.00 0.00 55.97 56.74 3k4w s LYS 260 Cb -0.16 -2.34 0.29 0.00 -2.06 0.00 0.00 37.83 33.56 3k4w s LYS 260 CO 0.04 -0.83 1.67 -1.35 0.10 0.00 0.00 175.35 174.98 3k4w h PRO 261 N 1.79 0.14 -0.45 1.78 0.11 -1.99 0.71 132.00 134.10 3k4w h PRO 261 Ca -0.50 -0.01 -0.02 0.00 0.11 0.00 0.00 66.00 65.58 3k4w h PRO 261 Cb 1.27 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 32.33 3k4w h PRO 261 CO 0.59 0.09 0.19 0.38 -0.21 0.00 0.00 178.00 179.04 3k4w h ASP 262 N 0.14 0.61 -0.80 -2.05 2.03 -2.00 -0.34 116.42 114.02 3k4w h ASP 262 Ca 0.32 -0.15 -0.00 0.00 -0.73 0.00 0.00 57.03 56.46 3k4w h ASP 262 Cb 0.51 -0.16 -0.04 0.00 -0.83 0.00 0.00 39.33 38.81 3k4w h ASP 262 CO -0.50 0.59 0.50 0.00 -1.03 0.00 0.00 179.24 178.80 3k4w h ALA 263 N 1.04 1.01 -0.49 4.15 0.00 -1.80 -2.89 119.26 120.29 3k4w h ALA 263 Ca 0.15 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.99 3k4w h ALA 263 Cb 0.17 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 3k4w h ALA 263 CO -0.01 0.46 0.32 1.98 0.00 0.00 0.00 179.25 181.99 3k4w h MET 264 N 1.09 0.65 -0.57 0.00 1.85 0.13 -1.82 114.93 116.26 3k4w h MET 264 Ca 0.29 -0.05 -0.05 0.00 -0.61 0.00 0.00 59.70 59.28 3k4w h MET 264 Cb -0.07 -0.14 -0.03 0.00 0.43 0.00 0.00 31.60 31.79 3k4w h MET 264 CO -0.06 0.45 0.13 1.05 -0.40 0.00 0.00 176.91 178.08 3k4w h GLU 265 N 0.66 0.88 -0.15 0.39 4.11 -1.05 -0.28 114.58 119.13 3k4w h GLU 265 Ca 0.18 -0.18 -0.00 0.00 0.07 0.00 0.00 59.36 59.42 3k4w h GLU 265 Cb -0.06 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.06 3k4w h GLU 265 CO -0.04 0.79 0.09 0.87 0.07 0.00 0.00 179.01 180.79 3k4w h LYS 266 N 0.84 0.21 -0.55 1.06 1.57 -1.26 -0.91 116.57 117.54 3k4w h LYS 266 Ca 0.18 -0.02 -0.11 0.00 -1.87 0.00 0.00 60.65 58.83 3k4w h LYS 266 Cb 0.31 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.56 3k4w h LYS 266 CO -0.00 0.20 -0.10 0.82 -0.57 0.00 0.00 179.45 179.80 3k4w h ILE 267 N 0.17 1.27 -0.22 1.86 2.04 -1.19 0.19 117.51 121.63 3k4w h ILE 267 Ca 0.06 -1.25 -0.15 0.00 1.00 0.00 0.00 64.86 64.51 3k4w h ILE 267 Cb 0.04 0.94 -0.01 0.00 -0.74 0.00 0.00 36.82 37.05 3k4w h ILE 267 CO -0.01 0.44 -0.48 -0.07 0.00 0.00 0.00 178.15 178.04 3k4w h LEU 268 N 0.92 0.63 0.00 1.44 3.38 -1.01 -1.43 115.31 119.23 3k4w h LEU 268 Ca 0.14 -0.31 0.00 0.00 0.09 0.00 0.00 57.88 57.81 3k4w h LEU 268 Cb 0.66 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.23 3k4w h LEU 268 CO 0.05 1.00 0.00 0.00 0.09 0.00 0.00 178.44 179.58 3k4w n HIS 269 N -3.99 0.00 -0.18 1.13 1.44 -0.42 -1.49 115.22 111.70 3k4w n HIS 269 Ca -0.02 0.00 -0.09 0.00 -2.01 0.00 0.00 57.72 55.60 3k4w n HIS 269 Cb 0.56 0.00 0.01 0.00 0.12 0.00 0.00 29.99 30.68 3k4w n HIS 269 CO 0.00 0.00 0.00 0.78 -2.81 0.00 0.00 176.34 174.31 3k4w h GLY 270 N 0.00 0.89 0.87 -1.39 0.00 -0.56 0.17 103.07 103.05 3k4w h GLY 270 Ca 0.00 -0.55 -0.04 0.00 0.00 0.00 0.00 47.33 46.74 3k4w h GLY 270 CO 0.00 0.51 0.00 3.43 0.00 0.00 0.00 176.54 180.48 3k4w h ASN 271 N 0.73 0.47 -0.70 0.19 2.35 -0.93 -2.01 115.58 115.69 3k4w h ASN 271 Ca 0.17 -0.31 0.01 0.00 -0.55 0.00 0.00 56.30 55.62 3k4w h ASN 271 Cb 0.31 -0.13 -0.03 0.00 0.05 0.00 0.00 38.32 38.52 3k4w h ASN 271 CO -0.00 0.67 0.46 0.00 -1.65 0.00 0.00 177.43 176.91 3k4w h ALA 272 N 0.83 0.88 -0.96 -0.83 0.00 -1.70 -2.31 119.26 115.18 3k4w h ALA 272 Ca 0.08 -0.05 0.17 0.00 0.00 0.00 0.00 54.91 55.11 3k4w h ALA 272 Cb 0.42 -0.28 -0.10 0.00 0.00 0.00 0.00 17.79 17.83 3k4w h ALA 272 CO 0.01 0.30 0.56 0.93 0.00 0.00 0.00 179.25 181.06 3k4w h GLU 273 N 0.94 0.72 -0.21 0.00 5.08 -0.85 -1.12 114.58 119.13 3k4w h GLU 273 Ca 0.26 -0.04 -0.04 0.00 -1.00 0.00 0.00 59.36 58.53 3k4w h GLU 273 Cb -0.11 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 28.97 3k4w h GLU 273 CO -0.06 0.47 -0.02 -0.09 -1.00 0.00 0.00 179.01 178.32 3k4w h ARG 274 N 0.74 0.39 -0.35 2.33 2.43 -0.84 0.16 114.38 119.24 3k4w h ARG 274 Ca 0.54 -0.14 0.05 0.00 -0.81 0.00 0.00 59.98 59.62 3k4w h ARG 274 Cb 0.80 -0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 30.27 3k4w h ARG 274 CO -0.37 0.61 0.09 -0.07 -1.51 0.00 0.00 179.97 178.72 3k4w h LEU 275 N 0.14 0.05 -1.00 3.80 3.38 -1.22 0.16 115.31 120.62 3k4w h LEU 275 Ca 0.06 0.05 -0.03 0.00 0.09 0.00 0.00 57.88 58.04 3k4w h LEU 275 Cb 0.45 0.06 -0.03 0.00 0.09 0.00 0.00 40.66 41.23 3k4w h LEU 275 CO 0.02 0.07 0.29 -0.07 0.09 0.00 0.00 178.44 178.84 3k4w h LEU 276 N 0.22 0.92 -0.77 1.67 3.38 -1.11 -1.14 115.31 118.49 3k4w h LEU 276 Ca 0.17 -0.12 -0.05 0.00 0.09 0.00 0.00 57.88 57.97 3k4w h LEU 276 Cb 0.17 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.65 3k4w h LEU 276 CO -0.20 0.81 0.30 0.00 0.09 0.00 0.00 178.44 179.44 3k4w h ALA 277 N 1.32 1.00 -0.13 1.53 0.00 -0.34 -1.11 119.26 121.54 3k4w h ALA 277 Ca 0.24 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.95 3k4w h ALA 277 Cb 0.16 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 3k4w h ALA 277 CO -0.02 0.63 0.08 0.37 0.00 0.00 0.00 179.25 180.31 3k4w h GLN 278 N 1.11 0.17 -0.10 0.00 4.15 -0.60 -1.23 115.11 118.61 3k4w h GLN 278 Ca 0.25 -0.01 -0.02 0.00 0.77 0.00 0.00 58.65 59.64 3k4w h GLN 278 Cb 0.23 -0.04 -0.01 0.00 0.21 0.00 0.00 27.48 27.87 3k4w h GLN 278 CO -0.02 0.12 -0.04 0.00 -1.93 0.00 0.00 178.83 176.97 3k4w h ALA 279 N 1.04 1.75 0.00 3.38 0.00 -1.12 -1.56 119.26 122.75 3k4w h ALA 279 Ca 0.05 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.86 3k4w h ALA 279 Cb -0.01 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.73 3k4w h ALA 279 CO -0.01 0.19 0.00 0.78 0.00 0.00 0.00 179.25 180.21 3k4w h GLY 280 N 0.42 0.00 0.00 0.00 0.00 -0.72 -3.46 103.07 99.31 3k4w h GLY 280 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.36 3k4w h GLY 280 CO 0.01 0.00 0.00 0.54 0.00 0.00 0.00 176.54 177.09