#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 4.65 -0.06 3.23 2.20 -1.26 -4.94 119.74 123.56 3k4w s LYS 2 Ca 0.00 1.68 -0.01 0.00 -0.36 0.00 0.00 55.97 57.28 3k4w s LYS 2 Cb 0.00 -3.27 0.03 0.00 -1.51 0.00 0.00 37.83 33.08 3k4w s LYS 2 CO 0.00 0.18 -0.00 0.42 -0.36 0.00 0.00 175.35 175.59 3k4w s ILE 3 N -0.56 0.35 -0.26 5.43 1.01 -1.25 -4.28 121.20 121.63 3k4w s ILE 3 Ca 0.47 0.09 -0.09 0.00 0.00 0.00 0.00 60.65 61.12 3k4w s ILE 3 Cb -0.29 -0.48 -0.03 0.00 0.01 0.00 0.00 42.46 41.67 3k4w s ILE 3 CO 0.35 0.23 0.11 -0.63 0.00 0.00 0.00 174.94 175.01 3k4w s ILE 4 N 1.64 4.60 -0.30 2.92 1.01 -0.25 -0.68 121.20 130.14 3k4w s ILE 4 Ca -0.00 -0.11 -0.23 0.00 0.00 0.00 0.00 60.65 60.30 3k4w s ILE 4 Cb -0.13 -3.19 -0.00 0.00 0.01 0.00 0.00 42.46 39.15 3k4w s ILE 4 CO -0.04 0.28 0.78 -0.62 0.00 0.00 0.00 174.94 175.35 3k4w s ASP 5 N 1.65 6.66 0.00 3.58 -1.08 0.06 -4.65 116.67 122.89 3k4w s ASP 5 Ca 0.06 0.66 0.31 0.00 -0.52 0.00 0.00 52.55 53.06 3k4w s ASP 5 Cb -0.16 -2.40 1.67 0.00 -1.46 0.00 0.00 42.92 40.57 3k4w s ASP 5 CO 0.06 -0.60 2.10 0.33 0.52 0.00 0.00 175.17 177.58 3k4w n PHE 6 N 6.18 0.00 -3.43 -5.34 7.35 0.47 -0.42 117.46 122.27 3k4w n PHE 6 Ca 0.03 0.00 -0.16 0.00 -0.76 0.00 0.00 57.45 56.56 3k4w n PHE 6 Cb 0.48 -0.06 -0.11 0.00 0.35 0.00 0.00 39.48 40.15 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 -2.13 0.28 -0.01 -4.13 3.52 -1.26 -4.67 118.95 110.55 3k4w s ARG 7 Ca 0.42 0.13 0.00 0.00 -0.13 0.00 0.00 55.73 56.15 3k4w s ARG 7 Cb 0.21 -0.84 0.01 0.00 -1.56 0.00 0.00 34.95 32.77 3k4w s ARG 7 CO 0.39 -0.81 -0.00 -1.17 -0.81 0.00 0.00 175.30 172.90 3k4w s LEU 8 N 2.38 1.80 -0.35 -0.88 0.20 -0.39 -1.23 118.68 120.22 3k4w s LEU 8 Ca 0.09 -0.01 0.00 0.00 0.69 0.00 0.00 54.13 54.91 3k4w s LEU 8 Cb -0.15 -0.06 0.11 0.00 -0.43 0.00 0.00 46.19 45.66 3k4w s LEU 8 CO -0.22 -0.02 0.14 -0.13 -0.29 0.00 0.00 176.35 175.83 3k4w s ARG 9 N 0.22 0.91 0.64 1.98 3.00 -0.67 -2.64 118.95 122.39 3k4w s ARG 9 Ca -0.02 -1.39 -0.14 0.00 0.00 0.00 0.00 55.73 54.18 3k4w s ARG 9 Cb -0.03 -2.13 -0.01 0.00 0.00 0.00 0.00 34.95 32.78 3k4w s ARG 9 CO -0.01 -1.04 1.07 -1.25 0.00 0.00 0.00 175.30 174.07 3k4w s PRO 10 N 1.21 3.06 -1.52 3.54 0.04 -1.26 -4.16 135.00 135.90 3k4w s PRO 10 Ca 0.12 1.17 -0.12 0.00 0.04 0.00 0.00 61.00 62.21 3k4w s PRO 10 Cb -0.20 -2.00 -0.03 0.00 0.04 0.00 0.00 34.50 32.32 3k4w s PRO 10 CO -0.16 -1.02 2.58 -0.35 0.04 0.00 0.00 177.00 178.09 3k4w n PRO 11 N -2.48 3.23 -4.18 0.56 -0.04 -1.26 -4.67 135.00 126.16 3k4w n PRO 11 Ca 0.09 -2.37 -0.16 0.00 -0.04 0.00 0.00 63.50 61.01 3k4w n PRO 11 Cb 0.53 -3.03 -0.15 0.00 -0.04 0.00 0.00 33.50 30.81 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 2.73 0.48 0.00 0.55 0.00 -1.26 -4.28 121.76 119.99 3k4w s ALA 12 Ca 0.58 -0.23 0.00 0.00 0.00 0.00 0.00 51.96 52.31 3k4w s ALA 12 Cb 0.16 -0.13 0.00 0.00 0.00 0.00 0.00 23.12 23.14 3k4w s ALA 12 CO -0.07 0.11 0.00 -1.33 0.00 0.00 0.00 175.76 174.47 3k4w n MET 13 N 2.99 0.00 0.05 0.00 2.81 -1.26 -2.36 117.12 119.35 3k4w n MET 13 Ca -0.14 0.00 0.06 0.00 -1.81 0.00 0.00 57.70 55.81 3k4w n MET 13 Cb 0.58 0.00 0.49 0.00 -0.71 0.00 0.00 33.22 33.57 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 0.44 0.46 3.03 0.00 -1.93 -2.46 103.07 102.60 3k4w h GLY 14 Ca 0.00 -0.16 0.19 0.00 0.00 0.00 0.00 47.33 47.36 3k4w h GLY 14 CO 0.00 0.15 0.56 0.74 0.00 0.00 0.00 176.54 177.99 3k4w h PHE 15 N 0.41 0.47 0.00 5.60 0.04 -1.76 0.32 116.94 122.01 3k4w h PHE 15 Ca 0.13 0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.92 3k4w h PHE 15 Cb 0.03 -0.15 0.00 0.00 2.20 0.00 0.00 35.95 38.04 3k4w h PHE 15 CO -0.00 0.15 0.00 -0.07 -0.60 0.00 0.00 178.31 177.79 3k4w h LEU 16 N 0.37 0.00 -0.02 1.54 3.38 -1.57 -2.49 115.31 116.53 3k4w h LEU 16 Ca 0.42 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.39 3k4w h LEU 16 Cb 1.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.83 3k4w h LEU 16 CO -0.14 0.00 -0.16 0.59 0.09 0.00 0.00 178.44 178.82 3k4w n ASN 17 N -2.61 0.19 -4.84 -0.43 3.02 0.10 -4.13 115.26 106.56 3k4w n ASN 17 Ca -0.01 0.17 -0.33 0.00 -0.03 0.00 0.00 54.58 54.38 3k4w n ASN 17 Cb 0.09 -0.23 -0.06 0.00 -0.61 0.00 0.00 39.78 38.97 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 -2.95 3.18 0.58 5.41 0.00 -0.94 -4.45 121.76 122.58 3k4w s ALA 18 Ca 0.15 0.20 0.27 0.00 0.00 0.00 0.00 51.96 52.58 3k4w s ALA 18 Cb 0.19 -2.96 1.57 0.00 0.00 0.00 0.00 23.12 21.92 3k4w s ALA 18 CO 0.58 0.19 2.06 0.00 0.00 0.00 0.00 175.76 178.59 3k4w h ARG 19 N 1.97 0.00 -1.18 0.00 3.08 -0.83 -1.12 114.38 116.30 3k4w h ARG 19 Ca -0.48 0.00 0.34 0.00 0.07 0.00 0.00 59.98 59.91 3k4w h ARG 19 Cb 1.18 0.00 -0.06 0.00 0.08 0.00 0.00 29.97 31.17 3k4w h ARG 19 CO 0.63 0.00 0.84 -0.84 -1.07 0.00 0.00 179.97 179.53 3k4w h ILE 20 N 0.00 0.41 0.00 2.04 3.07 -1.87 -1.06 117.51 120.10 3k4w h ILE 20 Ca 0.12 -0.02 -0.15 0.00 1.55 0.00 0.00 64.86 66.36 3k4w h ILE 20 Cb 0.63 0.34 -0.03 0.00 -0.27 0.00 0.00 36.82 37.49 3k4w h ILE 20 CO -0.00 0.01 -1.55 -1.22 -1.05 0.00 0.00 178.15 174.34 3k4w n TYR 21 N -4.26 0.00 0.63 0.16 4.01 -0.51 -4.55 117.16 112.63 3k4w n TYR 21 Ca 0.26 0.00 0.13 0.00 -0.16 0.00 0.00 57.90 58.13 3k4w n TYR 21 Cb 1.21 -0.39 0.36 0.00 -0.31 0.00 0.00 39.34 40.21 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 -2.31 0.53 -3.32 -0.72 -2.24 -0.66 -3.77 114.28 101.80 3k4w n THR 22 Ca -0.13 -0.28 -0.26 0.00 -2.27 0.00 0.00 64.05 61.12 3k4w n THR 22 Cb 0.76 -0.49 -0.08 0.00 -2.10 0.00 0.00 70.33 68.43 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 -2.21 1.74 0.28 -0.78 5.12 -0.41 -4.91 116.66 115.49 3k4w n ARG 23 Ca 0.05 -4.04 0.16 0.00 -1.93 0.00 0.00 57.85 52.09 3k4w n ARG 23 Cb 0.43 -1.80 0.82 0.00 -1.16 0.00 0.00 32.46 30.75 3k4w n ARG 23 CO 0.00 0.00 0.00 -1.00 -1.93 0.00 0.00 177.63 174.70 3k4w h PRO 24 N 4.08 0.00 -0.35 5.56 0.14 -1.77 -2.22 132.00 137.44 3k4w h PRO 24 Ca 0.14 0.00 0.00 0.00 0.14 0.00 0.00 66.00 66.29 3k4w h PRO 24 Cb 0.76 0.00 -0.02 0.00 0.14 0.00 0.00 31.00 31.88 3k4w h PRO 24 CO 0.67 0.07 0.23 0.38 0.14 0.00 0.00 178.00 179.49 3k4w h ASP 25 N 0.00 0.39 0.24 1.44 2.03 -1.94 0.20 116.42 118.79 3k4w h ASP 25 Ca -0.00 -0.01 -0.01 0.00 -0.73 0.00 0.00 57.03 56.28 3k4w h ASP 25 Cb 0.30 -0.10 0.00 0.00 -0.83 0.00 0.00 39.33 38.71 3k4w h ASP 25 CO 0.01 0.29 -0.12 0.40 -1.03 0.00 0.00 179.24 178.79 3k4w h ILE 26 N 0.47 0.82 -0.26 4.15 2.04 -1.82 -2.71 117.51 120.20 3k4w h ILE 26 Ca 0.13 -0.45 0.06 0.00 1.00 0.00 0.00 64.86 65.60 3k4w h ILE 26 Cb -0.05 1.08 -0.07 0.00 -0.74 0.00 0.00 36.82 37.04 3k4w h ILE 26 CO -0.03 0.10 -0.23 -0.09 0.00 0.00 0.00 178.15 177.89 3k4w h ARG 27 N -0.56 -0.22 -0.66 2.37 2.43 -1.27 -2.58 114.38 113.89 3k4w h ARG 27 Ca -0.03 0.01 0.05 0.00 -0.81 0.00 0.00 59.98 59.20 3k4w h ARG 27 Cb 0.41 0.05 -0.04 0.00 -0.42 0.00 0.00 29.97 29.97 3k4w h ARG 27 CO 0.05 -0.15 0.43 -0.91 -1.51 0.00 0.00 179.97 177.89 3k4w h ASN 28 N -0.23 0.61 -0.86 -3.80 2.35 -0.68 -0.39 115.58 112.57 3k4w h ASN 28 Ca 0.14 -0.00 0.08 0.00 -0.55 0.00 0.00 56.30 55.97 3k4w h ASN 28 Cb 0.45 -0.13 -0.07 0.00 0.05 0.00 0.00 38.32 38.62 3k4w h ASN 28 CO -0.39 0.41 0.52 0.03 -1.65 0.00 0.00 177.43 176.35 3k4w h ARG 29 N 0.70 0.89 -0.08 0.81 3.08 -1.12 -1.21 114.38 117.45 3k4w h ARG 29 Ca 0.28 -0.05 -0.06 0.00 0.07 0.00 0.00 59.98 60.21 3k4w h ARG 29 Cb 0.20 -0.20 0.00 0.00 0.08 0.00 0.00 29.97 30.05 3k4w h ARG 29 CO -0.08 0.59 -0.20 0.35 -1.07 0.00 0.00 179.97 179.55 3k4w h PHE 30 N 0.92 0.36 -0.46 3.04 3.04 -0.90 -1.03 116.94 121.91 3k4w h PHE 30 Ca 0.39 -0.14 0.09 0.00 3.98 0.00 0.00 57.97 62.29 3k4w h PHE 30 Cb 0.26 -0.06 -0.08 0.00 2.56 0.00 0.00 35.95 38.63 3k4w h PHE 30 CO -0.04 0.81 -0.01 1.15 -2.02 0.00 0.00 178.31 178.21 3k4w h THR 31 N -0.20 0.64 -0.16 4.41 2.02 -1.07 -0.94 112.91 117.61 3k4w h THR 31 Ca -0.00 -0.04 -0.14 0.00 0.77 0.00 0.00 66.41 67.00 3k4w h THR 31 Cb 0.81 0.52 -0.01 0.00 -1.74 0.00 0.00 68.15 67.73 3k4w h THR 31 CO 0.04 0.02 -0.52 0.03 0.37 0.00 0.00 175.52 175.47 3k4w h ARG 32 N 0.11 0.44 -0.70 6.66 3.08 -1.19 -1.85 114.38 120.92 3k4w h ARG 32 Ca 0.23 -0.26 0.00 0.00 0.07 0.00 0.00 59.98 60.02 3k4w h ARG 32 Cb 0.34 0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.38 3k4w h ARG 32 CO -0.39 0.85 0.44 0.37 -1.07 0.00 0.00 179.97 180.18 3k4w h GLN 33 N 0.34 0.94 0.00 0.04 4.15 -0.95 -2.52 115.11 117.11 3k4w h GLN 33 Ca 0.01 -0.07 -0.06 0.00 0.77 0.00 0.00 58.65 59.30 3k4w h GLN 33 Cb 1.02 -0.21 -0.01 0.00 0.21 0.00 0.00 27.48 28.50 3k4w h GLN 33 CO 0.09 0.64 -0.29 -0.07 -1.93 0.00 0.00 178.83 177.26 3k4w h LEU 34 N 0.96 0.00 0.00 -2.39 3.38 -0.90 -3.47 115.31 112.89 3k4w h LEU 34 Ca 0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.23 3k4w h LEU 34 Cb -0.08 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.67 3k4w h LEU 34 CO -0.05 0.29 0.00 0.61 0.09 0.00 0.00 178.44 179.38 3k4w n GLY 35 N -0.51 1.55 3.64 0.83 0.00 -0.95 -4.92 105.19 104.83 3k4w n GLY 35 Ca -0.02 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.76 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 2.55 -0.04 1.61 0.08 -0.73 -5.01 117.98 114.44 3k4w s PHE 36 Ca 0.00 -0.44 -0.04 0.00 0.12 0.00 0.00 56.93 56.58 3k4w s PHE 36 Cb 0.00 -1.50 -0.04 0.00 -0.57 0.00 0.00 43.02 40.91 3k4w s PHE 36 CO 0.00 0.47 0.15 -1.21 -0.10 0.00 0.00 175.22 174.53 3k4w s GLU 37 N -3.72 3.37 0.39 0.44 0.41 -1.26 -3.44 118.70 114.89 3k4w s GLU 37 Ca 0.35 -0.29 -0.26 0.00 -0.41 0.00 0.00 54.97 54.36 3k4w s GLU 37 Cb -0.00 -3.08 -0.11 0.00 -1.78 0.00 0.00 34.13 29.16 3k4w s GLU 37 CO 0.19 0.70 1.22 -2.30 -0.49 0.00 0.00 175.26 174.58 3k4w n PRO 38 N 1.32 1.85 -1.94 0.39 -0.02 -1.26 -4.45 135.00 130.88 3k4w n PRO 38 Ca -0.14 0.65 -0.42 0.00 -2.02 0.00 0.00 63.50 61.57 3k4w n PRO 38 Cb 0.53 -2.28 -0.03 0.00 -0.02 0.00 0.00 33.50 31.70 3k4w n PRO 38 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3k4w s ALA 39 N -1.18 3.72 0.27 3.55 0.00 -1.26 -4.93 121.76 121.92 3k4w s ALA 39 Ca 0.60 1.26 -0.01 0.00 0.00 0.00 0.00 51.96 53.81 3k4w s ALA 39 Cb -0.54 -3.66 0.47 0.00 0.00 0.00 0.00 23.12 19.39 3k4w s ALA 39 CO 0.59 -0.96 1.85 -1.00 0.00 0.00 0.00 175.76 176.24 3k4w h PRO 40 N 7.67 1.02 0.00 0.00 0.13 -1.99 0.16 132.00 138.99 3k4w h PRO 40 Ca -0.43 -0.06 -0.02 0.00 -0.87 0.00 0.00 66.00 64.63 3k4w h PRO 40 Cb 1.20 -0.23 -0.00 0.00 0.13 0.00 0.00 31.00 32.10 3k4w h PRO 40 CO 0.92 0.67 -0.07 0.66 -0.23 0.00 0.00 178.00 179.95 3k4w h SER 41 N 1.05 0.00 0.42 1.44 4.64 -1.87 0.24 113.55 119.46 3k4w h SER 41 Ca 0.46 0.00 -0.31 0.00 -0.47 0.00 0.00 61.79 61.46 3k4w h SER 41 Cb 0.34 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 62.45 3k4w h SER 41 CO -0.22 0.07 -1.39 0.00 -0.87 0.00 0.00 176.83 174.42 3k4w h ALA 42 N 1.93 -0.04 -0.92 5.18 0.00 -1.34 0.53 119.26 124.59 3k4w h ALA 42 Ca -0.00 -0.88 -0.01 0.00 0.00 0.00 0.00 54.91 54.02 3k4w h ALA 42 Cb 0.16 0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.02 3k4w h ALA 42 CO 0.01 0.83 0.55 0.93 0.00 0.00 0.00 179.25 181.57 3k4w h GLU 43 N 0.12 1.25 -0.00 0.00 4.39 -0.06 -2.53 114.58 117.74 3k4w h GLU 43 Ca -0.21 -0.11 0.00 0.00 0.34 0.00 0.00 59.36 59.38 3k4w h GLU 43 Cb 2.09 -0.26 0.00 0.00 -0.10 0.00 0.00 28.75 30.48 3k4w h GLU 43 CO 0.24 0.87 -0.47 0.39 -1.16 0.00 0.00 179.01 178.89 3k4w n GLU 44 N -4.36 0.15 -3.67 2.33 -0.58 0.75 -4.94 120.64 110.33 3k4w n GLU 44 Ca 0.10 -0.09 -0.22 0.00 -0.42 0.00 0.00 57.16 56.53 3k4w n GLU 44 Cb 0.06 -1.50 0.05 0.00 -0.57 0.00 0.00 31.44 29.48 3k4w n GLU 44 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 3k4w n LYS 45 N -1.34 -5.77 -4.06 3.49 5.02 -0.50 -4.96 118.16 110.04 3k4w n LYS 45 Ca 0.07 0.69 -0.33 0.00 -2.02 0.00 0.00 58.31 56.72 3k4w n LYS 45 Cb 0.34 -5.47 -0.15 0.00 -0.02 0.00 0.00 35.03 29.72 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 -4.06 4.03 0.21 4.39 0.15 0.06 -4.93 113.70 113.54 3k4w s SER 46 Ca 0.19 -1.05 -0.10 0.00 0.70 0.00 0.00 55.95 55.68 3k4w s SER 46 Cb -0.09 -1.56 0.16 0.00 -1.71 0.00 0.00 66.02 62.82 3k4w s SER 46 CO 0.79 -0.12 1.88 0.25 1.20 0.00 0.00 173.24 177.24 3k4w h LEU 47 N 7.88 0.87 -0.14 3.45 5.85 -1.85 -0.75 115.31 130.61 3k4w h LEU 47 Ca -0.30 -0.02 0.05 0.00 0.84 0.00 0.00 57.88 58.44 3k4w h LEU 47 Cb 1.09 -0.22 -0.05 0.00 0.37 0.00 0.00 40.66 41.85 3k4w h LEU 47 CO 0.54 0.63 -0.17 -0.33 -0.34 0.00 0.00 178.44 178.77 3k4w h GLU 48 N 1.03 -0.20 -0.59 1.25 4.39 -1.96 0.23 114.58 118.73 3k4w h GLU 48 Ca 0.28 0.01 -0.05 0.00 0.34 0.00 0.00 59.36 59.95 3k4w h GLU 48 Cb -0.12 0.05 -0.03 0.00 -0.10 0.00 0.00 28.75 28.55 3k4w h GLU 48 CO -0.06 -0.13 0.18 1.25 -1.16 0.00 0.00 179.01 179.09 3k4w h LEU 49 N -0.21 0.82 0.16 1.33 6.46 -1.90 -1.70 115.31 120.28 3k4w h LEU 49 Ca 0.10 -0.13 -0.01 0.00 -0.12 0.00 0.00 57.88 57.72 3k4w h LEU 49 Cb 0.36 -0.21 0.00 0.00 -0.73 0.00 0.00 40.66 40.07 3k4w h LEU 49 CO -0.27 0.77 -0.08 -0.03 -0.62 0.00 0.00 178.44 178.22 3k4w h MET 50 N 0.86 -0.21 -0.94 1.25 4.05 0.59 -0.69 114.93 119.84 3k4w h MET 50 Ca 0.20 0.01 0.19 0.00 -0.28 0.00 0.00 59.70 59.82 3k4w h MET 50 Cb 0.25 0.05 -0.08 0.00 -0.80 0.00 0.00 31.60 31.02 3k4w h MET 50 CO -0.01 -0.05 0.60 0.74 0.23 0.00 0.00 176.91 178.43 3k4w h PHE 51 N -0.34 0.73 -0.17 1.39 0.04 -0.47 -1.21 116.94 116.93 3k4w h PHE 51 Ca -0.02 0.02 -0.19 0.00 2.80 0.00 0.00 57.97 60.58 3k4w h PHE 51 Cb 0.26 -0.22 -0.00 0.00 2.20 0.00 0.00 35.95 38.19 3k4w h PHE 51 CO -0.03 0.19 -0.66 0.93 -0.60 0.00 0.00 178.31 178.14 3k4w h GLU 52 N 0.55 0.64 -0.45 1.51 5.08 -0.30 -2.28 114.58 119.33 3k4w h GLU 52 Ca 0.50 -0.47 -0.10 0.00 -1.00 0.00 0.00 59.36 58.30 3k4w h GLU 52 Cb 1.05 0.08 -0.02 0.00 0.50 0.00 0.00 28.75 30.36 3k4w h GLU 52 CO -0.24 1.09 -0.11 0.93 -1.00 0.00 0.00 179.01 179.67 3k4w h GLU 53 N 0.46 0.81 -0.21 2.33 5.08 -0.58 -1.03 114.58 121.44 3k4w h GLU 53 Ca -0.02 -0.27 0.03 0.00 -1.00 0.00 0.00 59.36 58.10 3k4w h GLU 53 Cb 1.25 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 30.40 3k4w h GLU 53 CO 0.13 0.89 0.02 1.98 -1.00 0.00 0.00 179.01 181.03 3k4w h MET 54 N 0.73 0.10 -0.53 2.33 4.05 -1.16 0.13 114.93 120.58 3k4w h MET 54 Ca 0.12 -0.01 -0.02 0.00 -0.28 0.00 0.00 59.70 59.52 3k4w h MET 54 Cb 0.61 -0.02 -0.02 0.00 -0.80 0.00 0.00 31.60 31.36 3k4w h MET 54 CO 0.04 0.07 0.26 0.00 0.23 0.00 0.00 176.91 177.51 3k4w h ALA 55 N 1.17 0.68 -0.00 0.39 0.00 -1.33 -0.99 119.26 119.18 3k4w h ALA 55 Ca 0.10 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 3k4w h ALA 55 Cb 0.11 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 3k4w h ALA 55 CO -0.15 0.23 -0.24 0.00 0.00 0.00 0.00 179.25 179.10 3k4w h ALA 56 N 1.10 1.59 0.00 0.00 0.00 -0.97 -2.59 119.26 118.40 3k4w h ALA 56 Ca 0.18 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.87 3k4w h ALA 56 Cb 0.10 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.85 3k4w h ALA 56 CO -0.02 0.31 -0.10 0.00 0.00 0.00 0.00 179.25 179.43 3k4w n ALA 57 N -2.49 2.41 -0.83 0.00 0.00 0.43 -4.94 120.51 115.08 3k4w n ALA 57 Ca -0.02 -0.07 0.00 0.00 0.00 0.00 0.00 53.44 53.35 3k4w n ALA 57 Cb 0.30 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.33 3k4w n ALA 57 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3k4w n GLY 58 N 1.34 0.56 3.60 0.00 0.00 -0.87 -4.84 105.19 104.98 3k4w n GLY 58 Ca 0.05 -0.23 -0.43 0.00 0.00 0.00 0.00 46.02 45.42 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 4.59 -0.09 -0.61 1.01 -0.43 -3.96 121.20 119.71 3k4w s ILE 59 Ca 0.00 1.12 -0.27 0.00 0.00 0.00 0.00 60.65 61.51 3k4w s ILE 59 Cb 0.00 -4.33 -0.25 0.00 0.01 0.00 0.00 42.46 37.89 3k4w s ILE 59 CO 0.00 -0.55 0.93 -0.08 0.00 0.00 0.00 174.94 175.23 3k4w h GLU 60 N 8.53 0.07 -4.83 2.79 4.57 -1.18 -3.38 114.58 121.15 3k4w h GLU 60 Ca -0.23 -0.09 -0.27 0.00 -1.18 0.00 0.00 59.36 57.59 3k4w h GLU 60 Cb 1.08 0.03 -0.15 0.00 -0.16 0.00 0.00 28.75 29.55 3k4w h GLU 60 CO 0.98 0.92 -0.70 -0.65 -1.18 0.00 0.00 179.01 178.38 3k4w s GLN 61 N -2.79 0.93 0.00 1.92 -0.21 -1.13 -4.65 119.66 113.74 3k4w s GLN 61 Ca -0.17 -1.38 0.01 0.00 0.02 0.00 0.00 55.36 53.84 3k4w s GLN 61 Cb -0.01 -0.38 -0.01 0.00 1.00 0.00 0.00 33.01 33.61 3k4w s GLN 61 CO 0.71 0.02 -0.04 0.20 -2.12 0.00 0.00 175.29 174.06 3k4w s GLY 62 N -3.09 0.23 -0.38 3.09 0.00 0.53 -0.76 107.32 106.95 3k4w s GLY 62 Ca 0.14 -0.26 -0.16 0.00 0.00 0.00 0.00 44.72 44.44 3k4w s GLY 62 CO -0.03 -0.24 0.40 0.14 0.00 0.00 0.00 173.10 173.37 3k4w s VAL 63 N -0.29 5.13 -0.72 1.40 1.01 0.44 -1.12 120.40 126.25 3k4w s VAL 63 Ca -0.00 -0.13 -0.26 0.00 0.00 0.00 0.00 61.98 61.59 3k4w s VAL 63 Cb -0.03 -3.92 0.04 0.00 0.00 0.00 0.00 36.38 32.47 3k4w s VAL 63 CO -0.00 -0.24 1.19 0.00 0.00 0.00 0.00 175.10 176.04 3k4w s VAL 65 N 5.25 4.57 0.72 0.00 1.01 -1.08 -1.82 120.40 129.05 3k4w s VAL 65 Ca 0.31 0.56 -0.17 0.00 0.00 0.00 0.00 61.98 62.69 3k4w s VAL 65 Cb -0.11 -4.37 -0.08 0.00 0.00 0.00 0.00 36.38 31.82 3k4w s VAL 65 CO 0.14 -0.77 0.16 0.61 0.00 0.00 0.00 175.10 175.23 3k4w n GLY 66 N 4.97 -2.44 2.84 4.51 0.00 -0.69 -4.87 105.19 109.50 3k4w n GLY 66 Ca 0.04 -0.42 -0.15 0.00 0.00 0.00 0.00 46.02 45.49 3k4w n GLY 66 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3k4w s ARG 67 N -2.26 0.17 -0.27 1.61 3.52 -1.26 -4.74 118.95 115.72 3k4w s ARG 67 Ca 0.59 0.05 -0.00 0.00 -0.13 0.00 0.00 55.73 56.24 3k4w s ARG 67 Cb -0.35 -0.31 0.08 0.00 -1.56 0.00 0.00 34.95 32.81 3k4w s ARG 67 CO 0.64 -0.08 0.04 -0.80 -0.81 0.00 0.00 175.30 174.29 3k4w s ASN 68 N 0.67 3.80 -0.08 -2.12 0.01 -1.26 -0.58 114.94 115.38 3k4w s ASN 68 Ca -0.06 -1.37 -0.03 0.00 -0.71 0.00 0.00 52.86 50.68 3k4w s ASN 68 Cb -0.09 -0.96 0.04 0.00 0.41 0.00 0.00 41.25 40.65 3k4w s ASN 68 CO -0.01 -0.34 0.15 -0.55 -1.51 0.00 0.00 177.10 174.84 3k4w s SER 69 N 1.54 0.52 0.50 -1.22 0.15 -0.55 -4.45 113.70 110.20 3k4w s SER 69 Ca 0.03 0.31 0.19 0.00 0.70 0.00 0.00 55.95 57.18 3k4w s SER 69 Cb -0.18 0.22 1.26 0.00 -1.71 0.00 0.00 66.02 65.62 3k4w s SER 69 CO -0.14 -0.22 2.04 0.28 1.20 0.00 0.00 173.24 176.40 3k4w h SER 70 N 8.05 0.10 0.11 5.45 0.02 -1.82 -2.12 113.55 123.32 3k4w h SER 70 Ca -0.22 0.00 -0.32 0.00 -0.84 0.00 0.00 61.79 60.42 3k4w h SER 70 Cb 1.12 -0.02 -0.01 0.00 0.14 0.00 0.00 62.40 63.63 3k4w h SER 70 CO 0.23 0.06 -1.68 -0.37 -1.14 0.00 0.00 176.83 173.92 3k4w h VAL 71 N 0.11 0.82 0.00 2.27 -1.51 -1.93 -3.42 116.25 112.59 3k4w h VAL 71 Ca 0.18 -2.34 0.00 0.00 -1.23 0.00 0.00 66.70 63.31 3k4w h VAL 71 Cb 0.57 2.54 0.00 0.00 -2.13 0.00 0.00 31.29 32.27 3k4w h VAL 71 CO -0.02 0.74 -0.41 0.18 -1.23 0.00 0.00 177.57 176.83 3k4w n LEU 72 N -3.79 0.45 0.00 4.19 4.77 -1.16 -4.84 117.00 116.62 3k4w n LEU 72 Ca -0.29 0.16 0.00 0.00 -0.03 0.00 0.00 56.01 55.85 3k4w n LEU 72 Cb 0.94 -0.29 0.00 0.00 -2.33 0.00 0.00 43.42 41.75 3k4w n LEU 72 CO 0.39 0.05 0.00 0.61 -1.33 0.00 0.00 177.39 177.11 3k4w n GLY 73 N 1.46 3.19 2.99 -0.72 0.00 -0.81 -0.10 105.19 111.20 3k4w n GLY 73 Ca 0.05 -1.91 -0.22 0.00 0.00 0.00 0.00 46.02 43.94 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 0.00 1.44 -0.15 1.61 0.01 -1.26 -1.48 113.70 113.87 3k4w s SER 74 Ca 0.00 -0.23 0.02 0.00 1.31 0.00 0.00 55.95 57.04 3k4w s SER 74 Cb 0.00 -0.60 0.01 0.00 0.21 0.00 0.00 66.02 65.64 3k4w s SER 74 CO 0.00 0.02 -0.19 0.54 0.41 0.00 0.00 173.24 174.02 3k4w s VAL 75 N 0.59 2.27 0.67 3.43 0.11 0.26 -4.60 120.40 123.12 3k4w s VAL 75 Ca -0.11 -0.90 -0.16 0.00 -2.93 0.00 0.00 61.98 57.88 3k4w s VAL 75 Cb -0.14 -1.93 0.01 0.00 -1.53 0.00 0.00 36.38 32.79 3k4w s VAL 75 CO 0.02 0.54 1.16 -0.94 -3.33 0.00 0.00 175.10 172.55 3k4w s SER 76 N 0.87 4.77 0.37 3.54 1.04 -1.26 -4.50 113.70 118.54 3k4w s SER 76 Ca -0.05 2.21 0.11 0.00 0.48 0.00 0.00 55.95 58.69 3k4w s SER 76 Cb -0.15 -2.57 0.73 0.00 0.10 0.00 0.00 66.02 64.13 3k4w s SER 76 CO -0.02 -1.87 1.86 0.78 0.98 0.00 0.00 173.24 174.97 3k4w h ASN 77 N 0.07 0.12 -0.63 7.02 2.35 -1.95 -2.42 115.58 120.13 3k4w h ASN 77 Ca -0.48 -0.03 0.04 0.00 -0.55 0.00 0.00 56.30 55.28 3k4w h ASN 77 Cb 1.27 -0.03 -0.04 0.00 0.05 0.00 0.00 38.32 39.57 3k4w h ASN 77 CO 0.52 0.40 0.38 0.00 -1.65 0.00 0.00 177.43 177.08 3k4w h ALA 78 N 1.62 0.83 -0.33 -0.83 0.00 -1.97 -0.03 119.26 118.55 3k4w h ALA 78 Ca 0.02 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.89 3k4w h ALA 78 Cb 0.55 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 3k4w h ALA 78 CO 0.04 0.10 0.09 -0.44 0.00 0.00 0.00 179.25 179.04 3k4w h ASP 79 N 0.73 0.50 -0.47 0.00 3.32 -1.81 -0.06 116.42 118.62 3k4w h ASP 79 Ca 0.26 -0.22 0.09 0.00 0.02 0.00 0.00 57.03 57.18 3k4w h ASP 79 Cb 0.07 -0.13 -0.08 0.00 0.22 0.00 0.00 39.33 39.42 3k4w h ASP 79 CO -0.13 0.59 0.01 0.58 -1.72 0.00 0.00 179.24 178.57 3k4w h VAL 80 N 0.38 0.65 -0.76 -1.35 2.07 -1.22 0.15 116.25 116.17 3k4w h VAL 80 Ca 0.11 -0.04 -0.01 0.00 0.82 0.00 0.00 66.70 67.57 3k4w h VAL 80 Cb 0.28 0.51 -0.04 0.00 -1.52 0.00 0.00 31.29 30.52 3k4w h VAL 80 CO -0.00 0.02 0.43 0.00 0.02 0.00 0.00 177.57 178.04 3k4w h ALA 81 N 1.41 1.33 -0.31 1.67 0.00 -0.87 -2.41 119.26 120.07 3k4w h ALA 81 Ca 0.23 -0.10 -0.17 0.00 0.00 0.00 0.00 54.91 54.87 3k4w h ALA 81 Cb 0.34 -0.31 -0.00 0.00 0.00 0.00 0.00 17.79 17.83 3k4w h ALA 81 CO -0.38 0.56 -0.47 0.00 0.00 0.00 0.00 179.25 178.96 3k4w h ALA 82 N 1.42 0.48 -0.87 0.00 0.00 -0.17 -0.65 119.26 119.47 3k4w h ALA 82 Ca 0.27 -0.48 -0.02 0.00 0.00 0.00 0.00 54.91 54.68 3k4w h ALA 82 Cb 0.00 -0.09 -0.04 0.00 0.00 0.00 0.00 17.79 17.66 3k4w h ALA 82 CO -0.05 0.64 0.48 0.28 0.00 0.00 0.00 179.25 180.60 3k4w h VAL 83 N 0.65 1.25 -0.14 0.00 2.07 -0.67 -1.61 116.25 117.81 3k4w h VAL 83 Ca 0.03 -0.62 -0.21 0.00 0.82 0.00 0.00 66.70 66.73 3k4w h VAL 83 Cb 1.07 0.06 0.00 0.00 -1.52 0.00 0.00 31.29 30.91 3k4w h VAL 83 CO 0.11 0.28 -0.74 0.00 0.02 0.00 0.00 177.57 177.24 3k4w h ALA 84 N 1.31 0.42 0.00 1.67 0.00 -1.34 -2.70 119.26 118.63 3k4w h ALA 84 Ca 0.31 -0.59 -0.01 0.00 0.00 0.00 0.00 54.91 54.62 3k4w h ALA 84 Cb 0.02 -0.03 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 3k4w h ALA 84 CO -0.05 0.71 -0.03 1.57 0.00 0.00 0.00 179.25 181.44 3k4w h LYS 85 N 0.46 0.00 0.00 0.00 2.10 -0.89 -2.18 116.57 116.06 3k4w h LYS 85 Ca -0.04 0.00 -0.12 0.00 -2.00 0.00 0.00 60.65 58.49 3k4w h LYS 85 Cb 1.35 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 32.66 3k4w h LYS 85 CO 0.15 0.03 -0.56 0.00 -2.00 0.00 0.00 179.45 177.07 3k4w h ALA 86 N 1.97 0.81 -2.09 0.07 0.00 -1.11 -3.36 119.26 115.55 3k4w h ALA 86 Ca -0.00 -0.51 -0.53 0.00 0.00 0.00 0.00 54.91 53.87 3k4w h ALA 86 Cb 0.84 -0.09 -0.40 0.00 0.00 0.00 0.00 17.79 18.14 3k4w h ALA 86 CO 0.00 0.70 -0.98 0.66 0.00 0.00 0.00 179.25 179.63 3k4w n TYR 87 N -3.49 1.37 0.34 0.00 4.01 -1.03 -4.97 117.16 113.39 3k4w n TYR 87 Ca 0.00 -3.85 0.11 0.00 -0.16 0.00 0.00 57.90 54.01 3k4w n TYR 87 Cb 0.65 -0.44 0.50 0.00 -0.31 0.00 0.00 39.34 39.74 3k4w n TYR 87 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 3k4w n PRO 88 N 0.42 0.17 0.06 -0.72 -0.04 -0.84 -0.96 135.00 133.09 3k4w n PRO 88 Ca 0.26 0.46 0.12 0.00 -0.04 0.00 0.00 63.50 64.30 3k4w n PRO 88 Cb 0.54 -1.87 0.10 0.00 -0.04 0.00 0.00 33.50 32.23 3k4w n PRO 88 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 3k4w n ASP 89 N -2.21 0.70 -0.04 3.54 5.75 -1.26 -4.44 116.55 118.59 3k4w n ASP 89 Ca 0.01 0.07 -0.02 0.00 -0.01 0.00 0.00 54.79 54.84 3k4w n ASP 89 Cb 0.18 0.40 -0.08 0.00 -1.03 0.00 0.00 41.12 40.60 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 -2.17 1.83 -4.40 0.11 4.76 -0.14 -4.77 118.16 113.38 3k4w n LYS 90 Ca 0.02 -0.03 -0.22 0.00 -2.87 0.00 0.00 58.31 55.21 3k4w n LYS 90 Cb 0.46 -1.25 -0.16 0.00 -1.84 0.00 0.00 35.03 32.24 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 -2.37 1.08 -0.21 2.13 0.08 -0.82 -0.34 117.98 117.52 3k4w s PHE 91 Ca -0.05 -0.33 -0.03 0.00 0.12 0.00 0.00 56.93 56.64 3k4w s PHE 91 Cb 0.04 -0.82 -0.01 0.00 -0.57 0.00 0.00 43.02 41.66 3k4w s PHE 91 CO 0.41 -0.19 -0.05 -1.01 -0.10 0.00 0.00 175.22 174.28 3k4w s HIS 92 N 0.56 2.94 0.18 0.36 3.76 -0.28 -4.76 115.29 118.06 3k4w s HIS 92 Ca -0.10 -0.90 -0.28 0.00 -0.15 0.00 0.00 55.06 53.64 3k4w s HIS 92 Cb -0.13 -2.07 -0.08 0.00 1.11 0.00 0.00 32.58 31.41 3k4w s HIS 92 CO 0.02 -0.50 0.86 -1.25 -0.85 0.00 0.00 174.74 173.01 3k4w s PRO 93 N 1.33 4.69 -0.14 8.40 0.04 -1.26 -1.13 135.00 146.93 3k4w s PRO 93 Ca 0.04 1.32 0.02 0.00 0.04 0.00 0.00 61.00 62.41 3k4w s PRO 93 Cb -0.14 -3.29 0.01 0.00 0.04 0.00 0.00 34.50 31.11 3k4w s PRO 93 CO -0.03 0.48 -0.20 0.08 0.04 0.00 0.00 177.00 177.38 3k4w s VAL 94 N -0.92 2.28 0.65 -0.36 1.01 -0.75 -4.47 120.40 117.84 3k4w s VAL 94 Ca 0.39 -0.90 -0.11 0.00 0.00 0.00 0.00 61.98 61.36 3k4w s VAL 94 Cb -0.24 -1.93 -0.02 0.00 0.00 0.00 0.00 36.38 34.19 3k4w s VAL 94 CO 0.29 0.54 1.05 -0.83 0.00 0.00 0.00 175.10 176.14 3k4w s GLY 95 N 0.81 1.65 0.21 4.51 0.00 -0.74 -1.70 107.32 112.06 3k4w s GLY 95 Ca -0.07 -0.13 0.04 0.00 0.00 0.00 0.00 44.72 44.57 3k4w s GLY 95 CO -0.01 0.17 -0.04 -1.35 0.00 0.00 0.00 173.10 171.87 3k4w s SER 96 N -4.16 1.89 0.00 1.64 1.04 -1.26 0.35 113.70 113.19 3k4w s SER 96 Ca 0.56 -1.15 0.08 0.00 0.48 0.00 0.00 55.95 55.92 3k4w s SER 96 Cb -0.11 -0.01 -0.02 0.00 0.10 0.00 0.00 66.02 65.97 3k4w s SER 96 CO 0.54 -0.44 -0.24 -0.63 0.98 0.00 0.00 173.24 173.45 3k4w s ILE 97 N -3.36 1.88 -0.23 -1.02 1.01 -1.13 -4.85 121.20 113.50 3k4w s ILE 97 Ca 0.25 -1.11 -0.01 0.00 0.00 0.00 0.00 60.65 59.78 3k4w s ILE 97 Cb 0.04 -1.58 0.06 0.00 0.01 0.00 0.00 42.46 41.00 3k4w s ILE 97 CO 0.06 0.44 -0.01 -0.70 0.00 0.00 0.00 174.94 174.74 3k4w s GLU 98 N -0.78 1.18 0.01 2.79 2.12 -1.26 -4.65 118.70 118.10 3k4w s GLU 98 Ca 0.09 -0.80 -0.01 0.00 0.36 0.00 0.00 54.97 54.61 3k4w s GLU 98 Cb -0.09 -2.38 -0.01 0.00 0.26 0.00 0.00 34.13 31.91 3k4w s GLU 98 CO 0.00 -0.65 0.00 0.00 -0.54 0.00 0.00 175.26 174.07 3k4w s ALA 99 N 1.58 0.02 -0.19 6.30 0.00 -1.26 -4.91 121.76 123.30 3k4w s ALA 99 Ca -0.02 -0.29 0.22 0.00 0.00 0.00 0.00 51.96 51.87 3k4w s ALA 99 Cb -0.18 0.07 -0.23 0.00 0.00 0.00 0.00 23.12 22.78 3k4w s ALA 99 CO -0.08 -0.10 0.67 0.00 0.00 0.00 0.00 175.76 176.25 3k4w n ALA 100 N 2.20 2.93 -2.23 0.00 0.00 -1.26 -4.93 120.51 117.23 3k4w n ALA 100 Ca -0.19 -0.46 -0.13 0.00 0.00 0.00 0.00 53.44 52.66 3k4w n ALA 100 Cb 0.57 -0.85 -0.10 0.00 0.00 0.00 0.00 19.45 19.07 3k4w n ALA 100 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 3k4w s THR 101 N -3.42 1.00 0.25 0.00 -4.23 -1.26 -5.08 115.64 102.89 3k4w s THR 101 Ca -0.04 -2.02 -0.05 0.00 -1.18 0.00 0.00 61.69 58.40 3k4w s THR 101 Cb 0.13 -1.83 0.19 0.00 1.34 0.00 0.00 72.50 72.33 3k4w s THR 101 CO 0.87 -0.76 1.84 0.08 -0.54 0.00 0.00 174.62 176.11 3k4w h ARG 102 N 2.82 1.10 -0.32 3.99 -0.00 -1.94 -1.44 114.38 118.58 3k4w h ARG 102 Ca -0.36 -0.17 -0.09 0.00 -0.00 0.00 0.00 59.98 59.36 3k4w h ARG 102 Cb 1.18 -0.20 -0.02 0.00 -0.00 0.00 0.00 29.97 30.94 3k4w h ARG 102 CO 0.64 0.86 -0.17 0.87 -0.00 0.00 0.00 179.97 182.16 3k4w h LYS 103 N 1.08 0.58 -0.21 0.08 1.57 -1.98 -1.29 116.57 116.41 3k4w h LYS 103 Ca 0.26 -0.20 -0.01 0.00 -1.87 0.00 0.00 60.65 58.83 3k4w h LYS 103 Cb 0.14 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.39 3k4w h LYS 103 CO -0.03 0.73 0.09 1.49 -0.57 0.00 0.00 179.45 181.16 3k4w h GLU 104 N 0.53 0.31 -0.55 3.15 4.81 -1.90 -1.97 114.58 118.96 3k4w h GLU 104 Ca 0.09 -0.05 0.01 0.00 -0.13 0.00 0.00 59.36 59.28 3k4w h GLU 104 Cb 0.60 -0.05 -0.03 0.00 0.63 0.00 0.00 28.75 29.90 3k4w h GLU 104 CO 0.04 0.36 0.35 0.00 -0.73 0.00 0.00 179.01 179.03 3k4w h ALA 105 N 0.94 0.70 -0.11 2.92 0.00 -1.11 -2.72 119.26 119.87 3k4w h ALA 105 Ca 0.07 -0.03 -0.14 0.00 0.00 0.00 0.00 54.91 54.81 3k4w h ALA 105 Cb 0.16 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 3k4w h ALA 105 CO -0.01 0.10 -0.55 1.98 0.00 0.00 0.00 179.25 180.78 3k4w h MET 106 N 0.71 0.31 -0.62 0.00 1.85 -1.10 -1.15 114.93 114.93 3k4w h MET 106 Ca 0.21 -0.19 -0.04 0.00 -0.61 0.00 0.00 59.70 59.07 3k4w h MET 106 Cb -0.04 0.02 -0.03 0.00 0.43 0.00 0.00 31.60 31.98 3k4w h MET 106 CO -0.06 0.78 0.23 0.00 -0.40 0.00 0.00 176.91 177.45 3k4w h ALA 107 N 1.19 0.80 -0.22 0.39 0.00 -1.28 -1.45 119.26 118.68 3k4w h ALA 107 Ca 0.00 -0.18 -0.08 0.00 0.00 0.00 0.00 54.91 54.66 3k4w h ALA 107 Cb 1.04 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 18.58 3k4w h ALA 107 CO 0.09 0.44 -0.16 1.96 0.00 0.00 0.00 179.25 181.58 3k4w h GLN 108 N 0.87 0.50 -0.87 0.00 4.20 -1.28 -1.10 115.11 117.42 3k4w h GLN 108 Ca 0.20 -0.24 0.18 0.00 0.06 0.00 0.00 58.65 58.85 3k4w h GLN 108 Cb 0.23 -0.00 -0.11 0.00 0.30 0.00 0.00 27.48 27.90 3k4w h GLN 108 CO -0.01 0.80 0.42 1.98 -0.67 0.00 0.00 178.83 181.35 3k4w h MET 109 N 0.19 0.51 -0.35 1.46 4.05 -1.18 -1.53 114.93 118.08 3k4w h MET 109 Ca 0.04 -0.03 -0.16 0.00 -0.28 0.00 0.00 59.70 59.27 3k4w h MET 109 Cb 0.68 -0.12 -0.01 0.00 -0.80 0.00 0.00 31.60 31.36 3k4w h MET 109 CO 0.04 0.34 -0.42 0.37 0.23 0.00 0.00 176.91 177.47 3k4w h GLN 110 N 0.53 0.89 -0.19 0.39 5.75 -0.86 -1.69 115.11 119.92 3k4w h GLN 110 Ca 0.51 -0.48 0.05 0.00 -0.15 0.00 0.00 58.65 58.57 3k4w h GLN 110 Cb 0.84 0.03 -0.05 0.00 1.07 0.00 0.00 27.48 29.36 3k4w h GLN 110 CO -0.43 1.13 -0.15 1.49 -2.65 0.00 0.00 178.83 178.21 3k4w h GLU 111 N 0.71 -0.16 -0.09 1.69 4.81 -0.82 -0.67 114.58 120.06 3k4w h GLU 111 Ca 0.05 0.01 0.04 0.00 -0.13 0.00 0.00 59.36 59.33 3k4w h GLU 111 Cb 1.01 0.04 -0.04 0.00 0.63 0.00 0.00 28.75 30.38 3k4w h GLU 111 CO 0.10 -0.10 -0.16 0.82 -0.73 0.00 0.00 179.01 178.94 3k4w h ILE 112 N -0.16 0.59 -0.70 2.32 2.04 -1.18 -0.98 117.51 119.44 3k4w h ILE 112 Ca 0.12 0.00 0.10 0.00 1.00 0.00 0.00 64.86 66.08 3k4w h ILE 112 Cb 0.33 0.59 -0.08 0.00 -0.74 0.00 0.00 36.82 36.93 3k4w h ILE 112 CO -0.29 0.00 0.32 -0.07 0.00 0.00 0.00 178.15 178.11 3k4w h LEU 113 N -0.21 0.37 -1.45 1.44 3.38 -1.21 -2.55 115.31 115.08 3k4w h LEU 113 Ca 0.08 0.08 -0.06 0.00 0.09 0.00 0.00 57.88 58.07 3k4w h LEU 113 Cb 0.33 0.02 -0.01 0.00 0.09 0.00 0.00 40.66 41.09 3k4w h LEU 113 CO -0.22 0.20 -0.28 0.44 0.09 0.00 0.00 178.44 178.68 3k4w h ASP 114 N 0.53 0.00 0.20 -0.43 3.32 -0.44 -1.96 116.42 117.63 3k4w h ASP 114 Ca 0.36 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.41 3k4w h ASP 114 Cb 0.43 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.98 3k4w h ASP 114 CO -0.31 0.28 0.00 0.18 -1.72 0.00 0.00 179.24 177.67 3k4w n LEU 115 N -4.00 0.00 0.00 1.55 4.77 -0.43 -4.88 117.00 114.00 3k4w n LEU 115 Ca -0.02 0.12 0.00 0.00 -0.03 0.00 0.00 56.01 56.08 3k4w n LEU 115 Cb 0.34 -0.12 0.00 0.00 -2.33 0.00 0.00 43.42 41.31 3k4w n LEU 115 CO 0.36 -0.02 0.00 0.61 -1.33 0.00 0.00 177.39 177.01 3k4w n GLY 116 N 0.71 0.62 3.78 -0.72 0.00 -0.74 -4.95 105.19 103.90 3k4w n GLY 116 Ca 0.16 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.79 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 -2.37 4.42 0.00 -0.61 1.01 -1.00 -4.97 121.20 117.66 3k4w s ILE 117 Ca 0.00 1.61 0.00 0.00 0.00 0.00 0.00 60.65 62.26 3k4w s ILE 117 Cb 0.00 -4.08 0.00 0.00 0.01 0.00 0.00 42.46 38.39 3k4w s ILE 117 CO 0.00 0.47 0.47 0.54 0.00 0.00 0.00 174.94 176.41 3k4w n ARG 118 N 1.44 -0.41 -4.12 2.79 5.12 -1.26 -3.91 116.66 116.30 3k4w n ARG 118 Ca -0.05 -0.52 -0.16 0.00 -1.93 0.00 0.00 57.85 55.19 3k4w n ARG 118 Cb 0.49 -0.90 -0.12 0.00 -1.16 0.00 0.00 32.46 30.77 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 0.82 -0.00 0.55 1.01 -1.26 -4.33 121.20 117.89 3k4w s ILE 119 Ca 0.00 -1.17 0.04 0.00 0.00 0.00 0.00 60.65 59.53 3k4w s ILE 119 Cb 0.00 -0.83 -0.01 0.00 0.01 0.00 0.00 42.46 41.63 3k4w s ILE 119 CO 0.00 -0.29 -0.14 0.54 0.00 0.00 0.00 174.94 175.05 3k4w s VAL 120 N -1.29 1.10 -0.14 2.92 0.11 -1.15 -1.79 120.40 120.16 3k4w s VAL 120 Ca -0.06 -0.67 -0.05 0.00 -2.93 0.00 0.00 61.98 58.27 3k4w s VAL 120 Cb -0.10 -0.94 -0.04 0.00 -1.53 0.00 0.00 36.38 33.78 3k4w s VAL 120 CO 0.01 0.26 0.04 0.21 -3.33 0.00 0.00 175.10 172.29 3k4w s ASN 121 N -0.47 5.48 -0.08 3.54 2.47 0.15 -0.93 114.94 125.10 3k4w s ASN 121 Ca 0.05 0.12 0.01 0.00 0.42 0.00 0.00 52.86 53.46 3k4w s ASN 121 Cb -0.06 -1.79 0.02 0.00 -1.45 0.00 0.00 41.25 37.97 3k4w s ASN 121 CO -0.00 0.27 -0.10 -0.76 -3.72 0.00 0.00 177.10 172.79 3k4w s LEU 122 N -0.23 1.44 -0.52 3.21 1.43 0.26 -2.85 118.68 121.42 3k4w s LEU 122 Ca 0.07 -0.29 0.07 0.00 -1.03 0.00 0.00 54.13 52.95 3k4w s LEU 122 Cb -0.12 -0.80 0.26 0.00 0.03 0.00 0.00 46.19 45.55 3k4w s LEU 122 CO 0.02 -0.03 0.66 -0.62 0.23 0.00 0.00 176.35 176.60 3k4w n GLU 123 N 4.28 1.75 0.23 1.70 1.02 -1.26 -1.35 120.64 127.01 3k4w n GLU 123 Ca -0.19 -4.03 0.12 0.00 -0.02 0.00 0.00 57.16 53.04 3k4w n GLU 123 Cb 0.51 -1.80 0.48 0.00 -0.02 0.00 0.00 31.44 30.61 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 4.01 0.00 0.00 3.49 0.13 -1.86 -1.95 132.00 135.82 3k4w h PRO 124 Ca 0.14 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.27 3k4w h PRO 124 Cb 0.76 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.89 3k4w h PRO 124 CO 0.67 0.15 0.00 0.41 -0.23 0.00 0.00 178.00 179.00 3k4w n GLY 125 N 0.24 -1.00 0.69 1.56 0.00 -0.97 -0.85 105.19 104.87 3k4w n GLY 125 Ca 0.01 0.07 0.08 0.00 0.00 0.00 0.00 46.02 46.17 3k4w n GLY 125 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3k4w n VAL 126 N -1.97 1.85 -1.64 1.61 0.24 -0.74 -4.02 118.33 113.66 3k4w n VAL 126 Ca 0.01 -1.65 -0.32 0.00 -2.04 0.00 0.00 64.34 60.34 3k4w n VAL 126 Cb 0.13 -0.02 0.05 0.00 -1.47 0.00 0.00 33.84 32.54 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 -2.27 2.81 0.13 6.34 0.51 -0.93 -4.21 118.94 121.32 3k4w s TRP 127 Ca 0.34 1.51 -0.24 0.00 -2.12 0.00 0.00 56.10 55.59 3k4w s TRP 127 Cb 0.26 -3.03 -0.05 0.00 -0.81 0.00 0.00 33.47 29.84 3k4w s TRP 127 CO 0.09 -1.48 1.22 0.00 -0.51 0.00 0.00 176.95 176.27 3k4w n ALA 128 N -2.81 -0.50 -3.10 0.98 0.00 -1.26 -2.68 120.51 111.15 3k4w n ALA 128 Ca 0.09 0.68 -0.45 0.00 0.00 0.00 0.00 53.44 53.76 3k4w n ALA 128 Cb 0.53 -0.12 -0.04 0.00 0.00 0.00 0.00 19.45 19.82 3k4w n ALA 128 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3k4w s THR 129 N -5.40 4.79 0.23 0.00 2.01 -1.26 -5.06 115.64 110.95 3k4w s THR 129 Ca -0.10 -0.98 -0.31 0.00 0.31 0.00 0.00 61.69 60.62 3k4w s THR 129 Cb 0.09 -4.51 -0.11 0.00 0.01 0.00 0.00 72.50 67.98 3k4w s THR 129 CO 0.49 -1.15 1.61 -2.84 -0.69 0.00 0.00 174.62 172.04 3k4w s PRO 130 N 2.75 4.17 0.08 4.92 0.02 -1.09 -4.95 135.00 140.89 3k4w s PRO 130 Ca 0.12 2.49 0.02 0.00 0.02 0.00 0.00 61.00 63.66 3k4w s PRO 130 Cb -0.24 -3.08 -0.04 0.00 0.02 0.00 0.00 34.50 31.16 3k4w s PRO 130 CO 0.06 -0.63 -0.08 0.00 -0.33 0.00 0.00 177.00 176.02 3k4w s MET 131 N 0.45 0.75 0.51 5.54 0.23 -0.03 -4.95 119.30 121.81 3k4w s MET 131 Ca 0.68 -1.14 -0.20 0.00 -1.03 0.00 0.00 55.69 54.00 3k4w s MET 131 Cb -0.47 -0.28 -0.07 0.00 -1.53 0.00 0.00 34.83 32.48 3k4w s MET 131 CO 0.38 0.02 1.10 -1.01 -2.03 0.00 0.00 175.02 173.48 3k4w s HIS 132 N -2.77 2.82 0.65 3.16 3.76 -1.26 -2.28 115.29 119.36 3k4w s HIS 132 Ca 0.04 1.56 0.42 0.00 -0.15 0.00 0.00 55.06 56.93 3k4w s HIS 132 Cb -0.01 -3.22 2.32 0.00 1.11 0.00 0.00 32.58 32.79 3k4w s HIS 132 CO -0.02 -1.29 2.35 -0.39 -0.85 0.00 0.00 174.74 174.54 3k4w h VAL 133 N 1.41 0.09 -0.62 -0.90 -1.51 -1.91 -2.43 116.25 110.37 3k4w h VAL 133 Ca -0.50 -0.01 -0.06 0.00 -1.23 0.00 0.00 66.70 64.90 3k4w h VAL 133 Cb 1.25 1.01 -0.03 0.00 -2.13 0.00 0.00 31.29 31.38 3k4w h VAL 133 CO 0.58 0.00 0.07 -0.90 -1.23 0.00 0.00 177.57 176.09 3k4w n ASP 134 N -3.21 5.54 -4.71 4.19 5.75 -1.26 -4.91 116.55 117.94 3k4w n ASP 134 Ca -0.03 -3.01 -0.43 0.00 -0.01 0.00 0.00 54.79 51.31 3k4w n ASP 134 Cb 0.08 -0.70 -0.03 0.00 -1.03 0.00 0.00 41.12 39.44 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 0.42 3.54 -0.35 -1.12 -0.08 -0.92 -4.86 116.55 113.17 3k4w n ASP 135 Ca 0.31 1.12 0.25 0.00 -1.51 0.00 0.00 54.79 54.96 3k4w n ASP 135 Cb 1.25 -1.53 0.51 0.00 2.34 0.00 0.00 41.12 43.70 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 5.31 0.34 0.00 -0.67 0.11 -1.93 -0.21 114.38 117.33 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 1.23 -0.08 0.00 0.00 1.11 0.00 0.00 29.97 32.24 3k4w h ARG 136 CO 0.84 0.22 0.00 0.00 0.10 0.00 0.00 179.97 181.13 3k4w h ARG 137 N 0.35 0.00 0.00 0.08 3.08 -1.96 -1.70 114.38 114.23 3k4w h ARG 137 Ca 0.67 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.72 3k4w h ARG 137 Cb 1.71 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.76 3k4w h ARG 137 CO -0.41 0.00 -0.70 1.28 -1.07 0.00 0.00 179.97 179.08 3k4w n LEU 138 N -2.70 0.65 -0.28 3.04 4.77 -0.09 -4.39 117.00 118.00 3k4w n LEU 138 Ca 0.01 0.15 0.00 0.00 -0.03 0.00 0.00 56.01 56.14 3k4w n LEU 138 Cb 0.25 -0.17 0.20 0.00 -2.33 0.00 0.00 43.42 41.37 3k4w n LEU 138 CO 0.23 -0.01 1.26 1.88 -1.33 0.00 0.00 177.39 179.42 3k4w h TYR 139 N 0.00 1.06 0.00 -1.77 -1.99 -1.32 -1.09 116.97 111.86 3k4w h TYR 139 Ca 0.00 0.03 -0.04 0.00 2.00 0.00 0.00 58.73 60.71 3k4w h TYR 139 Cb 0.71 -0.36 -0.01 0.00 2.00 0.00 0.00 36.73 39.08 3k4w h TYR 139 CO 0.00 0.66 -0.19 -1.35 -0.00 0.00 0.00 178.16 177.27 3k4w h PRO 140 N 1.13 0.00 -0.10 4.88 0.11 -1.77 -1.65 132.00 134.59 3k4w h PRO 140 Ca 0.32 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 66.35 3k4w h PRO 140 Cb -0.09 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.02 3k4w h PRO 140 CO -0.08 0.19 -0.23 1.25 -0.21 0.00 0.00 178.00 178.92 3k4w h LEU 141 N 0.00 0.38 -1.05 2.35 5.85 -1.52 -2.30 115.31 119.02 3k4w h LEU 141 Ca -0.00 -0.57 0.05 0.00 0.84 0.00 0.00 57.88 58.19 3k4w h LEU 141 Cb 0.56 -0.11 -0.06 0.00 0.37 0.00 0.00 40.66 41.42 3k4w h LEU 141 CO 0.03 0.89 0.63 1.88 -0.34 0.00 0.00 178.44 181.53 3k4w h TYR 142 N -0.10 1.17 -0.50 1.25 0.05 -0.96 -0.96 116.97 116.91 3k4w h TYR 142 Ca -0.00 0.03 -0.04 0.00 0.05 0.00 0.00 58.73 58.77 3k4w h TYR 142 Cb 0.83 -0.39 -0.02 0.00 1.01 0.00 0.00 36.73 38.16 3k4w h TYR 142 CO 0.11 0.64 0.15 0.00 -1.05 0.00 0.00 178.16 178.01 3k4w h ALA 143 N 1.45 0.66 -0.25 3.88 0.00 -1.29 0.23 119.26 123.93 3k4w h ALA 143 Ca 0.40 -0.19 0.01 0.00 0.00 0.00 0.00 54.91 55.13 3k4w h ALA 143 Cb 0.09 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 17.67 3k4w h ALA 143 CO -0.14 0.32 0.14 0.35 0.00 0.00 0.00 179.25 179.92 3k4w h PHE 144 N 0.68 0.27 -0.52 0.00 3.57 -0.93 -0.88 116.94 119.13 3k4w h PHE 144 Ca 0.16 0.01 -0.10 0.00 3.53 0.00 0.00 57.97 61.57 3k4w h PHE 144 Cb 0.29 -0.09 -0.02 0.00 2.79 0.00 0.00 35.95 38.92 3k4w h PHE 144 CO 0.02 0.16 -0.08 0.00 -2.23 0.00 0.00 178.31 176.18 3k4w h GLU 146 N 0.86 0.17 -0.38 0.00 4.81 -0.54 0.14 114.58 119.64 3k4w h GLU 146 Ca 0.14 -0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.33 3k4w h GLU 146 Cb 0.61 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.94 3k4w h GLU 146 CO 0.04 0.24 0.16 -0.44 -0.73 0.00 0.00 179.01 178.28 3k4w h ASP 147 N 0.06 0.47 -0.70 1.04 3.32 -0.97 -2.54 116.42 117.10 3k4w h ASP 147 Ca 0.04 -0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3k4w h ASP 147 Cb 0.13 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.56 3k4w h ASP 147 CO -0.00 0.42 0.00 0.59 -1.72 0.00 0.00 179.24 178.52 3k4w n ASN 148 N -4.40 4.47 -3.75 6.45 3.02 -0.68 -4.97 115.26 115.40 3k4w n ASN 148 Ca 0.02 -2.25 -0.26 0.00 -0.03 0.00 0.00 54.58 52.07 3k4w n ASN 148 Cb 0.13 -0.55 0.05 0.00 -0.61 0.00 0.00 39.78 38.80 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 1.41 -0.46 3.57 7.41 0.00 -0.82 -4.98 105.19 111.32 3k4w n GLY 149 Ca 0.26 0.19 -0.40 0.00 0.00 0.00 0.00 46.02 46.07 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 -3.37 5.22 0.49 -0.61 1.01 0.41 -4.62 121.20 119.72 3k4w s ILE 150 Ca 0.48 0.18 -0.22 0.00 0.00 0.00 0.00 60.65 61.09 3k4w s ILE 150 Cb -0.23 -3.71 -0.07 0.00 0.01 0.00 0.00 42.46 38.46 3k4w s ILE 150 CO 0.79 0.06 1.19 -2.84 0.00 0.00 0.00 174.94 174.14 3k4w s PRO 151 N 1.94 3.59 -0.13 2.79 0.02 -1.26 -4.62 135.00 137.32 3k4w s PRO 151 Ca 0.11 1.83 -0.00 0.00 0.02 0.00 0.00 61.00 62.96 3k4w s PRO 151 Cb -0.16 -2.32 0.03 0.00 0.02 0.00 0.00 34.50 32.07 3k4w s PRO 151 CO 0.11 -0.71 -0.07 0.08 -0.33 0.00 0.00 177.00 176.08 3k4w s VAL 152 N -1.53 1.07 -0.01 3.83 1.01 -0.23 -2.96 120.40 121.58 3k4w s VAL 152 Ca 0.66 -0.40 -0.25 0.00 0.00 0.00 0.00 61.98 61.99 3k4w s VAL 152 Cb -0.30 -1.13 -0.04 0.00 0.00 0.00 0.00 36.38 34.91 3k4w s VAL 152 CO 0.36 0.30 0.78 -0.63 0.00 0.00 0.00 175.10 175.91 3k4w s ILE 153 N 1.68 4.89 -0.01 2.22 1.01 -0.11 -0.50 121.20 130.38 3k4w s ILE 153 Ca 0.04 1.64 0.03 0.00 0.00 0.00 0.00 60.65 62.35 3k4w s ILE 153 Cb -0.13 -4.12 -0.00 0.00 0.01 0.00 0.00 42.46 38.21 3k4w s ILE 153 CO -0.08 0.28 -0.09 0.00 0.00 0.00 0.00 174.94 175.05 3k4w s MET 154 N 0.50 0.77 -0.55 2.79 0.23 0.19 -0.57 119.30 122.66 3k4w s MET 154 Ca 0.41 -0.30 -0.24 0.00 -1.03 0.00 0.00 55.69 54.53 3k4w s MET 154 Cb -0.19 -0.74 0.04 0.00 -1.53 0.00 0.00 34.83 32.40 3k4w s MET 154 CO 0.22 0.16 0.94 1.41 -2.03 0.00 0.00 175.02 175.71 3k4w s MET 155 N -0.05 3.33 -0.04 3.16 1.75 -0.46 -1.16 119.30 125.83 3k4w s MET 155 Ca 0.01 -0.28 0.07 0.00 -1.25 0.00 0.00 55.69 54.24 3k4w s MET 155 Cb -0.05 -4.06 0.12 0.00 2.84 0.00 0.00 34.83 33.68 3k4w s MET 155 CO -0.00 -1.49 1.06 0.25 -0.65 0.00 0.00 175.02 174.19 3k4w n THR 156 N 6.18 0.56 -4.42 10.11 -2.24 -1.20 -4.79 114.28 118.48 3k4w n THR 156 Ca 0.02 -0.77 -0.21 0.00 -2.27 0.00 0.00 64.05 60.82 3k4w n THR 156 Cb 0.47 0.32 -0.10 0.00 -2.10 0.00 0.00 70.33 68.92 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 -1.64 1.90 0.00 3.38 0.00 -1.20 -3.78 107.32 105.99 3k4w s GLY 157 Ca 0.12 -1.96 0.00 0.00 0.00 0.00 0.00 44.72 42.88 3k4w s GLY 157 CO -0.01 -1.80 0.00 0.61 0.00 0.00 0.00 173.10 171.90 3k4w n GLY 158 N -0.61 1.72 2.59 0.20 0.00 0.12 -3.58 105.19 105.62 3k4w n GLY 158 Ca -0.04 -0.60 -0.41 0.00 0.00 0.00 0.00 46.02 44.97 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 0.77 6.97 0.06 1.61 3.02 -1.26 -4.70 115.26 121.73 3k4w n ASN 159 Ca 0.00 -3.02 0.12 0.00 -0.03 0.00 0.00 54.58 51.66 3k4w n ASN 159 Cb 0.00 -1.45 0.47 0.00 -0.61 0.00 0.00 39.78 38.19 3k4w n ASN 159 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3k4w n ALA 160 N 2.99 2.12 -3.90 5.41 0.00 -1.24 -4.90 120.51 120.99 3k4w n ALA 160 Ca 0.58 -0.03 -0.03 0.00 0.00 0.00 0.00 53.44 53.95 3k4w n ALA 160 Cb 0.29 -1.43 0.02 0.00 0.00 0.00 0.00 19.45 18.33 3k4w n ALA 160 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 3k4w s GLY 161 N -3.33 0.16 0.51 0.00 0.00 -1.26 -3.36 107.32 100.05 3k4w s GLY 161 Ca 0.10 -0.40 0.24 0.00 0.00 0.00 0.00 44.72 44.66 3k4w s GLY 161 CO 0.50 2.71 1.98 -2.55 0.00 0.00 0.00 173.10 175.74 3k4w h PRO 162 N 2.00 0.07 0.00 2.90 0.11 -1.91 -3.45 132.00 131.72 3k4w h PRO 162 Ca -0.28 -0.00 -0.15 0.00 0.11 0.00 0.00 66.00 65.68 3k4w h PRO 162 Cb 1.22 -0.01 -0.04 0.00 0.11 0.00 0.00 31.00 32.28 3k4w h PRO 162 CO 0.37 0.04 -0.08 -0.40 -0.21 0.00 0.00 178.00 177.73 3k4w n ASP 163 N -4.39 -0.72 0.00 -2.05 5.68 -1.26 -5.05 116.55 108.77 3k4w n ASP 163 Ca 0.11 -2.00 0.11 0.00 -0.50 0.00 0.00 54.79 52.51 3k4w n ASP 163 Cb 0.62 1.34 0.48 0.00 -1.14 0.00 0.00 41.12 42.42 3k4w n ASP 163 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 3k4w n ILE 164 N -0.30 0.46 0.25 2.12 3.06 -1.26 -2.55 119.36 121.14 3k4w n ILE 164 Ca 0.00 0.12 0.13 0.00 -2.50 0.00 0.00 62.75 60.50 3k4w n ILE 164 Cb 0.31 -0.74 0.61 0.00 0.54 0.00 0.00 39.64 40.36 3k4w n ILE 164 CO 0.00 0.00 0.00 0.71 -2.50 0.00 0.00 176.55 174.76 3k4w h THR 165 N 0.00 0.37 0.00 9.51 1.35 -1.96 -1.58 112.91 120.60 3k4w h THR 165 Ca 0.00 -0.78 0.00 0.00 -0.55 0.00 0.00 66.41 65.08 3k4w h THR 165 Cb 0.35 1.57 0.00 0.00 -1.73 0.00 0.00 68.15 68.34 3k4w h THR 165 CO 0.00 0.13 0.00 -1.22 -0.25 0.00 0.00 175.52 174.18 3k4w n TYR 166 N -3.34 0.00 0.66 4.73 4.01 -1.06 -2.14 117.16 120.03 3k4w n TYR 166 Ca -0.00 0.00 0.07 0.00 -0.16 0.00 0.00 57.90 57.81 3k4w n TYR 166 Cb 0.34 -0.36 -0.02 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 -1.36 0.00 -1.64 -0.72 -2.24 -0.61 -4.79 114.28 102.93 3k4w n THR 167 Ca 0.11 -0.30 -0.49 0.00 -2.27 0.00 0.00 64.05 61.10 3k4w n THR 167 Cb 0.25 1.12 -0.05 0.00 -2.10 0.00 0.00 70.33 69.56 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 -0.49 2.44 0.05 3.42 2.85 -0.91 -4.81 115.26 117.81 3k4w n ASN 168 Ca 0.05 1.09 0.08 0.00 -0.11 0.00 0.00 54.58 55.70 3k4w n ASN 168 Cb 0.28 -1.31 0.36 0.00 1.24 0.00 0.00 39.78 40.36 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 3.24 0.07 -0.22 1.20 -0.04 -1.26 -2.58 135.00 135.41 3k4w n PRO 169 Ca 0.18 0.32 0.15 0.00 -0.04 0.00 0.00 63.50 64.12 3k4w n PRO 169 Cb 0.24 -1.63 0.47 0.00 -0.04 0.00 0.00 33.50 32.53 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 0.48 -0.04 0.54 4.11 -1.95 -0.36 114.58 117.37 3k4w h GLU 170 Ca 0.00 -0.03 -0.03 0.00 0.07 0.00 0.00 59.36 59.37 3k4w h GLU 170 Cb 0.28 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 29.42 3k4w h GLU 170 CO 0.00 0.32 -0.09 0.45 0.07 0.00 0.00 179.01 179.76 3k4w h HIS 171 N 0.50 0.16 -0.19 2.06 3.86 -1.86 -2.20 115.15 117.48 3k4w h HIS 171 Ca 0.43 -0.06 -0.13 0.00 -1.16 0.00 0.00 60.37 59.45 3k4w h HIS 171 Cb 0.91 -0.03 -0.01 0.00 1.06 0.00 0.00 27.41 29.34 3k4w h HIS 171 CO -0.00 0.70 -0.42 0.97 0.86 0.00 0.00 177.93 180.04 3k4w h ILE 172 N -0.42 1.31 -0.53 2.45 2.10 -1.74 -2.97 117.51 117.71 3k4w h ILE 172 Ca -0.00 -1.58 -0.03 0.00 1.08 0.00 0.00 64.86 64.33 3k4w h ILE 172 Cb 0.70 1.62 -0.03 0.00 -1.09 0.00 0.00 36.82 38.02 3k4w h ILE 172 CO 0.02 0.49 0.20 -0.78 -1.08 0.00 0.00 178.15 177.00 3k4w h ASP 173 N 0.37 0.70 -0.27 2.19 3.58 -0.95 -1.88 116.42 120.15 3k4w h ASP 173 Ca 0.03 -0.09 -0.04 0.00 0.42 0.00 0.00 57.03 57.35 3k4w h ASP 173 Cb 0.89 -0.18 -0.01 0.00 1.72 0.00 0.00 39.33 41.75 3k4w h ASP 173 CO 0.08 0.64 0.02 0.03 -2.88 0.00 0.00 179.24 177.12 3k4w h ARG 174 N 0.75 0.47 -0.47 0.28 3.08 -1.32 0.62 114.38 117.80 3k4w h ARG 174 Ca 0.18 -0.14 0.07 0.00 0.07 0.00 0.00 59.98 60.16 3k4w h ARG 174 Cb 0.16 -0.05 -0.06 0.00 0.08 0.00 0.00 29.97 30.11 3k4w h ARG 174 CO -0.02 0.61 0.10 0.28 -1.07 0.00 0.00 179.97 179.88 3k4w h VAL 175 N 0.26 0.76 -0.47 2.04 2.07 -1.32 0.46 116.25 120.06 3k4w h VAL 175 Ca 0.08 -0.08 -0.12 0.00 0.82 0.00 0.00 66.70 67.39 3k4w h VAL 175 Cb 0.39 0.50 -0.01 0.00 -1.52 0.00 0.00 31.29 30.64 3k4w h VAL 175 CO 0.01 0.04 -0.19 -0.07 0.02 0.00 0.00 177.57 177.38 3k4w h LEU 176 N 0.24 0.95 -0.85 2.57 3.38 -1.18 0.61 115.31 121.03 3k4w h LEU 176 Ca 0.23 -0.34 -0.05 0.00 0.09 0.00 0.00 57.88 57.81 3k4w h LEU 176 Cb 0.29 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 40.75 3k4w h LEU 176 CO -0.29 1.11 0.28 1.23 0.09 0.00 0.00 178.44 180.86 3k4w h GLY 177 N 0.92 1.21 1.98 0.83 0.00 -0.12 -3.06 103.07 104.83 3k4w h GLY 177 Ca 0.11 -0.67 -0.01 0.00 0.00 0.00 0.00 47.33 46.77 3k4w h GLY 177 CO 0.06 0.63 -0.05 -0.55 0.00 0.00 0.00 176.54 176.63 3k4w h ASP 178 N 1.10 0.00 -2.20 0.19 3.32 0.51 -3.37 116.42 115.98 3k4w h ASP 178 Ca 0.25 0.00 -0.58 0.00 0.02 0.00 0.00 57.03 56.72 3k4w h ASP 178 Cb 0.23 0.00 -0.40 0.00 0.22 0.00 0.00 39.33 39.38 3k4w h ASP 178 CO -0.02 0.03 -0.87 0.49 -1.72 0.00 0.00 179.24 177.15 3k4w n PHE 179 N -3.10 1.26 0.35 4.55 3.72 0.15 -4.98 117.46 119.41 3k4w n PHE 179 Ca 0.04 -3.80 0.09 0.00 -0.05 0.00 0.00 57.45 53.72 3k4w n PHE 179 Cb 0.54 -0.37 0.39 0.00 -0.94 0.00 0.00 39.48 39.10 3k4w n PHE 179 CO 0.00 0.00 0.00 -0.35 -0.05 0.00 0.00 176.76 176.36 3k4w n PRO 180 N 1.43 0.10 -0.24 -1.08 -0.04 -1.16 -2.06 135.00 131.95 3k4w n PRO 180 Ca 0.25 0.41 0.06 0.00 -0.04 0.00 0.00 63.50 64.18 3k4w n PRO 180 Cb 0.47 -1.72 0.17 0.00 -0.04 0.00 0.00 33.50 32.38 3k4w n PRO 180 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 3k4w n ASP 181 N -1.92 3.13 -4.72 3.54 8.00 -1.26 -4.75 116.55 118.57 3k4w n ASP 181 Ca 0.02 -2.28 -0.37 0.00 0.71 0.00 0.00 54.79 52.86 3k4w n ASP 181 Cb 0.15 -0.31 -0.06 0.00 -0.02 0.00 0.00 41.12 40.89 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 -1.50 4.26 -0.14 0.64 2.96 -0.87 -4.91 118.68 119.12 3k4w s LEU 182 Ca 0.27 0.72 -0.29 0.00 -0.22 0.00 0.00 54.13 54.61 3k4w s LEU 182 Cb 0.17 -2.60 -0.01 0.00 0.50 0.00 0.00 46.19 44.25 3k4w s LEU 182 CO 0.13 0.02 1.12 -0.89 -1.32 0.00 0.00 176.35 175.41 3k4w s THR 183 N 0.63 4.51 -0.05 3.68 2.01 -1.26 -4.73 115.64 120.44 3k4w s THR 183 Ca 0.23 1.81 0.03 0.00 0.31 0.00 0.00 61.69 64.08 3k4w s THR 183 Cb -0.14 -4.17 0.00 0.00 0.01 0.00 0.00 72.50 68.20 3k4w s THR 183 CO 0.08 -0.07 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.10 3k4w s VAL 184 N 2.68 1.29 -0.23 3.82 1.01 -0.90 -1.06 120.40 127.01 3k4w s VAL 184 Ca 0.51 -0.62 -0.08 0.00 0.00 0.00 0.00 61.98 61.79 3k4w s VAL 184 Cb -0.20 -1.13 -0.04 0.00 0.00 0.00 0.00 36.38 35.02 3k4w s VAL 184 CO 0.15 0.38 0.09 -0.69 0.00 0.00 0.00 175.10 175.03 3k4w s VAL 185 N 0.24 4.61 -0.61 2.92 1.01 0.34 -0.26 120.40 128.66 3k4w s VAL 185 Ca -0.07 -0.08 -0.27 0.00 0.00 0.00 0.00 61.98 61.56 3k4w s VAL 185 Cb -0.13 -3.14 0.04 0.00 0.00 0.00 0.00 36.38 33.15 3k4w s VAL 185 CO 0.03 0.36 1.13 -0.55 0.00 0.00 0.00 175.10 176.07 3k4w s SER 186 N 1.25 6.34 0.30 3.32 0.15 -0.13 -0.64 113.70 124.30 3k4w s SER 186 Ca 0.05 -0.19 -0.28 0.00 0.70 0.00 0.00 55.95 56.23 3k4w s SER 186 Cb -0.14 -2.52 -0.09 0.00 -1.71 0.00 0.00 66.02 61.55 3k4w s SER 186 CO 0.04 -1.49 1.00 -0.94 1.20 0.00 0.00 173.24 173.05 3k4w s SER 187 N 3.14 7.32 0.00 5.45 1.04 -0.31 -0.91 113.70 129.42 3k4w s SER 187 Ca 0.37 2.01 0.00 0.00 0.48 0.00 0.00 55.95 58.81 3k4w s SER 187 Cb -0.09 -2.60 0.00 0.00 0.10 0.00 0.00 66.02 63.42 3k4w s SER 187 CO 0.21 -0.09 0.00 1.41 0.98 0.00 0.00 173.24 175.75 3k4w n HIS 188 N 0.88 0.00 -2.02 5.02 8.25 -0.57 -3.21 115.22 123.58 3k4w n HIS 188 Ca 0.01 0.00 -0.20 0.00 -0.26 0.00 0.00 57.72 57.27 3k4w n HIS 188 Cb 0.48 -1.01 -0.05 0.00 1.12 0.00 0.00 29.99 30.53 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 -1.36 0.62 2.45 -1.41 0.00 -0.09 -1.60 105.19 103.81 3k4w n GLY 189 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.83 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 -1.65 -5.33 -4.77 1.61 5.15 -1.25 -4.91 115.26 104.11 3k4w n ASN 190 Ca -0.22 0.27 -0.41 0.00 -0.60 0.00 0.00 54.58 53.62 3k4w n ASN 190 Cb 0.67 -4.61 -0.01 0.00 -0.53 0.00 0.00 39.78 35.30 3k4w n ASN 190 CO 0.00 0.00 0.00 0.86 1.40 0.00 0.00 177.26 179.52 3k4w s TRP 191 N -2.79 2.81 -2.45 1.20 -0.00 -0.63 -1.74 118.94 115.34 3k4w s TRP 191 Ca 0.00 1.24 0.26 0.00 -0.00 0.00 0.00 56.10 57.60 3k4w s TRP 191 Cb 0.00 -3.88 0.94 0.00 -0.00 0.00 0.00 33.47 30.53 3k4w s TRP 191 CO 0.00 -2.55 1.68 -0.35 -0.00 0.00 0.00 176.95 175.72 3k4w n PRO 192 N 0.81 1.71 -1.65 5.86 -0.04 -1.26 0.11 135.00 140.54 3k4w n PRO 192 Ca 0.01 -1.04 -0.41 0.00 -0.04 0.00 0.00 63.50 62.02 3k4w n PRO 192 Cb 0.40 -1.46 -0.01 0.00 -0.04 0.00 0.00 33.50 32.40 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 0.26 3.03 0.09 0.54 7.02 -0.71 -4.66 117.44 123.00 3k4w n TRP 193 Ca 0.18 -2.99 -0.21 0.00 -1.02 0.00 0.00 57.50 53.45 3k4w n TRP 193 Cb 0.36 -2.44 -0.15 0.00 -2.42 0.00 0.00 31.31 26.66 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 3.54 1.09 -0.88 -0.99 2.07 -1.91 -0.74 116.25 118.42 3k4w h VAL 194 Ca 0.67 -2.65 0.10 0.00 0.82 0.00 0.00 66.70 65.64 3k4w h VAL 194 Cb 0.49 2.83 -0.08 0.00 -1.52 0.00 0.00 31.29 33.01 3k4w h VAL 194 CO 1.81 0.84 0.52 1.56 0.02 0.00 0.00 177.57 182.32 3k4w h GLN 195 N 0.10 0.84 -0.10 1.57 4.20 -1.96 -2.93 115.11 116.83 3k4w h GLN 195 Ca -0.29 -0.05 -0.14 0.00 0.06 0.00 0.00 58.65 58.23 3k4w h GLN 195 Cb 2.09 -0.19 0.01 0.00 0.30 0.00 0.00 27.48 29.69 3k4w h GLN 195 CO 0.20 0.55 -0.49 0.93 -0.67 0.00 0.00 178.83 179.35 3k4w h GLU 196 N 0.86 0.51 0.00 1.46 3.07 -1.92 -3.20 114.58 115.36 3k4w h GLU 196 Ca 0.43 -0.42 -0.03 0.00 -0.50 0.00 0.00 59.36 58.84 3k4w h GLU 196 Cb 0.40 0.09 -0.00 0.00 -0.84 0.00 0.00 28.75 28.39 3k4w h GLU 196 CO -0.25 1.04 -0.14 0.97 -1.40 0.00 0.00 179.01 179.23 3k4w h ILE 197 N 0.10 1.02 -0.50 3.13 6.09 -1.02 -1.40 117.51 124.94 3k4w h ILE 197 Ca -0.03 -0.51 -0.06 0.00 -1.37 0.00 0.00 64.86 62.89 3k4w h ILE 197 Cb 1.14 1.28 -0.02 0.00 0.47 0.00 0.00 36.82 39.69 3k4w h ILE 197 CO 0.10 0.14 0.07 0.40 -3.07 0.00 0.00 178.15 175.79 3k4w h ILE 198 N 0.00 1.25 -0.80 2.19 1.08 -1.53 -1.28 117.51 118.43 3k4w h ILE 198 Ca -0.00 -0.95 0.03 0.00 -0.39 0.00 0.00 64.86 63.55 3k4w h ILE 198 Cb 0.27 0.91 -0.05 0.00 -3.07 0.00 0.00 36.82 34.88 3k4w h ILE 198 CO 0.02 0.34 0.51 -0.74 -0.69 0.00 0.00 178.15 177.59 3k4w h HIS 199 N 0.70 0.96 -0.06 1.37 -0.00 -1.34 -0.30 115.15 116.47 3k4w h HIS 199 Ca 0.15 0.03 0.02 0.00 -0.00 0.00 0.00 60.37 60.57 3k4w h HIS 199 Cb 0.42 -0.32 -0.02 0.00 -0.00 0.00 0.00 27.41 27.49 3k4w h HIS 199 CO 0.03 0.55 -0.08 0.28 -0.00 0.00 0.00 177.93 178.71 3k4w h VAL 200 N 0.99 0.79 -0.98 5.26 2.07 -0.87 -1.27 116.25 122.24 3k4w h VAL 200 Ca 0.32 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.90 3k4w h VAL 200 Cb 0.02 0.79 -0.06 0.00 -1.52 0.00 0.00 31.29 30.51 3k4w h VAL 200 CO -0.11 0.00 0.64 0.00 0.02 0.00 0.00 177.57 178.11 3k4w h ALA 201 N 0.94 1.41 -0.70 1.67 0.00 -1.16 0.34 119.26 121.75 3k4w h ALA 201 Ca 0.05 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 54.97 3k4w h ALA 201 Cb 0.18 -0.31 -0.05 0.00 0.00 0.00 0.00 17.79 17.60 3k4w h ALA 201 CO -0.12 0.45 0.42 0.35 0.00 0.00 0.00 179.25 180.36 3k4w h PHE 202 N 1.17 0.79 0.20 0.00 3.57 -0.46 -3.25 116.94 118.97 3k4w h PHE 202 Ca 0.42 0.02 -0.31 0.00 3.53 0.00 0.00 57.97 61.63 3k4w h PHE 202 Cb 0.13 -0.25 0.03 0.00 2.79 0.00 0.00 35.95 38.65 3k4w h PHE 202 CO -0.00 0.42 -1.32 -0.09 -2.23 0.00 0.00 178.31 175.09 3k4w h ARG 203 N 0.81 0.54 -4.34 1.11 2.43 -0.74 -3.43 114.38 110.76 3k4w h ARG 203 Ca 0.30 -0.85 -0.72 0.00 -0.81 0.00 0.00 59.98 57.89 3k4w h ARG 203 Cb 0.09 0.31 -0.29 0.00 -0.42 0.00 0.00 29.97 29.66 3k4w h ARG 203 CO -0.14 1.40 -0.41 1.03 -1.51 0.00 0.00 179.97 180.34 3k4w s ARG 204 N -2.70 2.52 0.09 0.20 1.81 0.11 -4.96 118.95 116.03 3k4w s ARG 204 Ca -0.10 -1.67 0.16 0.00 -1.72 0.00 0.00 55.73 52.40 3k4w s ARG 204 Cb 0.04 -3.89 0.68 0.00 -0.45 0.00 0.00 34.95 31.33 3k4w s ARG 204 CO 0.93 -1.13 1.49 -0.35 -0.68 0.00 0.00 175.30 175.56 3k4w n PRO 205 N 4.92 0.06 0.02 3.54 -0.04 -1.26 -2.28 135.00 139.96 3k4w n PRO 205 Ca -0.09 0.34 0.12 0.00 -0.04 0.00 0.00 63.50 63.84 3k4w n PRO 205 Cb 0.41 -1.63 0.22 0.00 -0.04 0.00 0.00 33.50 32.47 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 -1.74 0.55 -4.67 3.54 6.94 -1.26 -4.93 115.26 113.69 3k4w n ASN 206 Ca 0.02 -0.12 -0.42 0.00 -0.02 0.00 0.00 54.58 54.04 3k4w n ASN 206 Cb 0.16 0.25 -0.03 0.00 -2.36 0.00 0.00 39.78 37.80 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 -3.41 4.18 0.01 -4.53 2.96 -0.96 -2.11 118.68 114.81 3k4w s LEU 207 Ca 0.09 1.31 -0.00 0.00 -0.22 0.00 0.00 54.13 55.31 3k4w s LEU 207 Cb 0.16 -3.39 -0.04 0.00 0.50 0.00 0.00 46.19 43.43 3k4w s LEU 207 CO 0.71 -0.47 0.10 -0.31 -1.32 0.00 0.00 176.35 175.06 3k4w s TYR 208 N 2.35 3.31 -0.12 5.38 2.02 0.64 -4.90 117.35 126.03 3k4w s TYR 208 Ca 0.42 0.21 0.01 0.00 -0.37 0.00 0.00 57.07 57.33 3k4w s TYR 208 Cb -0.17 -1.73 -0.01 0.00 -0.40 0.00 0.00 41.96 39.65 3k4w s TYR 208 CO 0.13 0.56 -0.14 -0.51 -1.57 0.00 0.00 175.55 174.01 3k4w s LEU 209 N -1.91 2.65 -0.49 -1.29 1.43 -0.37 -0.95 118.68 117.75 3k4w s LEU 209 Ca 0.25 -0.34 0.03 0.00 -1.03 0.00 0.00 54.13 53.04 3k4w s LEU 209 Cb -0.12 -1.58 0.15 0.00 0.03 0.00 0.00 46.19 44.66 3k4w s LEU 209 CO 0.17 0.18 0.30 -0.55 0.23 0.00 0.00 176.35 176.67 3k4w s SER 210 N 0.27 3.55 0.60 2.29 0.15 -0.81 -1.07 113.70 118.69 3k4w s SER 210 Ca -0.10 -2.92 0.39 0.00 0.70 0.00 0.00 55.95 54.01 3k4w s SER 210 Cb -0.16 -1.07 1.86 0.00 -1.71 0.00 0.00 66.02 64.94 3k4w s SER 210 CO 0.06 -0.22 2.16 1.55 1.20 0.00 0.00 173.24 177.99 3k4w h PRO 211 N 6.32 0.00 0.00 5.44 0.13 -1.80 -1.46 132.00 140.63 3k4w h PRO 211 Ca 0.06 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.19 3k4w h PRO 211 Cb 0.89 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.02 3k4w h PRO 211 CO 0.52 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 177.89 3k4w n ASP 212 N -3.08 0.00 0.24 1.44 5.68 -1.26 -1.60 116.55 117.97 3k4w n ASP 212 Ca -0.01 0.00 0.09 0.00 -0.50 0.00 0.00 54.79 54.37 3k4w n ASP 212 Cb 0.20 0.00 0.58 0.00 -1.14 0.00 0.00 41.12 40.76 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 0.00 0.00 0.11 -0.00 -1.77 -2.77 114.93 110.50 3k4w h MET 213 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 3k4w h MET 213 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 31.60 3k4w h MET 213 CO 0.00 0.19 0.00 0.66 -0.00 0.00 0.00 176.91 177.76 3k4w n TYR 214 N -3.88 0.00 0.24 -0.10 4.01 -0.63 -1.86 117.16 114.95 3k4w n TYR 214 Ca -0.02 0.00 0.10 0.00 -0.16 0.00 0.00 57.90 57.83 3k4w n TYR 214 Cb 0.29 -0.41 0.63 0.00 -0.31 0.00 0.00 39.34 39.53 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 -8.44 7.72 5.85 -1.59 -3.40 115.31 115.44 3k4w h LEU 215 Ca 0.00 0.00 -0.56 0.00 0.84 0.00 0.00 57.88 58.16 3k4w h LEU 215 Cb 0.35 0.00 -0.09 0.00 0.37 0.00 0.00 40.66 41.29 3k4w h LEU 215 CO 0.00 0.17 0.92 -0.47 -0.34 0.00 0.00 178.44 178.72 3k4w s TYR 216 N -4.15 2.50 -1.37 1.25 5.04 -0.78 -4.18 117.35 115.66 3k4w s TYR 216 Ca -0.02 0.07 0.00 0.00 -2.44 0.00 0.00 57.07 54.68 3k4w s TYR 216 Cb 0.13 -4.49 0.00 0.00 0.35 0.00 0.00 41.96 37.95 3k4w s TYR 216 CO 0.62 -1.77 0.00 -1.71 -1.34 0.00 0.00 175.55 171.35 3k4w n ASN 217 N 8.64 -4.77 -4.42 4.32 5.15 -1.26 -4.99 115.26 117.93 3k4w n ASN 217 Ca 0.04 -0.01 -0.22 0.00 -0.60 0.00 0.00 54.58 53.79 3k4w n ASN 217 Cb 0.48 -3.89 -0.10 0.00 -0.53 0.00 0.00 39.78 35.74 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 -4.58 2.15 0.58 1.20 1.43 -1.26 -5.09 118.68 113.10 3k4w s LEU 218 Ca 0.00 -1.41 -0.20 0.00 -1.03 0.00 0.00 54.13 51.49 3k4w s LEU 218 Cb 0.00 -0.35 -0.04 0.00 0.03 0.00 0.00 46.19 45.83 3k4w s LEU 218 CO 0.00 -0.64 1.33 -2.84 0.23 0.00 0.00 176.35 174.42 3k4w s PRO 219 N -3.88 2.97 0.00 1.29 0.02 -1.26 -2.66 135.00 131.48 3k4w s PRO 219 Ca 0.35 2.15 0.00 0.00 0.02 0.00 0.00 61.00 63.52 3k4w s PRO 219 Cb 0.08 -2.12 0.00 0.00 0.02 0.00 0.00 34.50 32.48 3k4w s PRO 219 CO 0.15 -1.30 0.00 0.41 -0.33 0.00 0.00 177.00 175.93 3k4w n GLY 220 N 0.76 2.94 0.41 0.52 0.00 -1.26 -4.95 105.19 103.60 3k4w n GLY 220 Ca 0.12 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 46.03 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 -1.35 -0.96 1.61 6.17 -1.78 -0.20 115.15 118.63 3k4w h HIS 221 Ca 0.00 0.07 0.11 0.00 0.71 0.00 0.00 60.37 61.26 3k4w h HIS 221 Cb 0.00 0.64 -0.08 0.00 2.52 0.00 0.00 27.41 30.49 3k4w h HIS 221 CO 0.00 -0.46 0.59 0.00 0.71 0.00 0.00 177.93 178.77 3k4w h ALA 222 N 0.29 1.43 -0.75 5.26 0.00 -1.93 -0.91 119.26 122.65 3k4w h ALA 222 Ca 0.12 0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 3k4w h ALA 222 Cb 0.59 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 3k4w h ALA 222 CO -0.56 0.20 0.25 -0.44 0.00 0.00 0.00 179.25 178.70 3k4w h ASP 223 N 0.94 1.08 -0.12 0.00 3.32 -1.53 0.34 116.42 120.46 3k4w h ASP 223 Ca 0.47 -0.20 -0.04 0.00 0.02 0.00 0.00 57.03 57.29 3k4w h ASP 223 Cb 0.46 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 39.72 3k4w h ASP 223 CO -0.26 0.99 -0.07 -0.26 -1.72 0.00 0.00 179.24 177.92 3k4w h PHE 224 N 1.11 0.29 -0.68 4.55 0.04 -0.42 -2.43 116.94 119.40 3k4w h PHE 224 Ca 0.24 -0.08 -0.04 0.00 2.80 0.00 0.00 57.97 60.90 3k4w h PHE 224 Cb 0.28 -0.07 -0.03 0.00 2.20 0.00 0.00 35.95 38.33 3k4w h PHE 224 CO 0.02 0.61 0.26 0.82 -0.60 0.00 0.00 178.31 179.42 3k4w h ILE 225 N -0.11 1.24 -0.55 -0.55 1.08 -1.08 0.15 117.51 117.68 3k4w h ILE 225 Ca 0.02 -0.76 -0.07 0.00 -0.39 0.00 0.00 64.86 63.67 3k4w h ILE 225 Cb 0.54 0.44 -0.02 0.00 -3.07 0.00 0.00 36.82 34.71 3k4w h ILE 225 CO 0.02 0.30 0.06 -0.61 -0.69 0.00 0.00 178.15 177.24 3k4w h GLN 226 N 0.98 0.93 -0.30 2.37 4.15 -0.88 -1.56 115.11 120.80 3k4w h GLN 226 Ca 0.23 -0.26 -0.08 0.00 0.77 0.00 0.00 58.65 59.30 3k4w h GLN 226 Cb 0.21 -0.10 -0.01 0.00 0.21 0.00 0.00 27.48 27.79 3k4w h GLN 226 CO -0.02 0.91 -0.13 0.00 -1.93 0.00 0.00 178.83 177.66 3k4w h ALA 227 N 0.98 0.42 -0.99 3.38 0.00 -1.10 -2.81 119.26 119.15 3k4w h ALA 227 Ca 0.16 -0.32 0.20 0.00 0.00 0.00 0.00 54.91 54.95 3k4w h ALA 227 Cb 0.45 -0.10 -0.10 0.00 0.00 0.00 0.00 17.79 18.04 3k4w h ALA 227 CO 0.02 0.30 0.62 0.00 0.00 0.00 0.00 179.25 180.18 3k4w h ALA 228 N 0.76 1.84 0.00 0.00 0.00 -0.55 0.27 119.26 121.58 3k4w h ALA 228 Ca 0.07 0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.04 3k4w h ALA 228 Cb 0.65 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.37 3k4w h ALA 228 CO 0.04 -0.20 0.00 0.09 0.00 0.00 0.00 179.25 179.18 3k4w n ASN 229 N -4.70 0.00 0.00 0.00 3.02 -0.60 -3.38 115.26 109.60 3k4w n ASN 229 Ca 0.23 -0.96 0.00 0.00 -0.03 0.00 0.00 54.58 53.82 3k4w n ASN 229 Cb 0.63 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.80 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 -0.96 0.00 0.22 6.41 2.88 0.86 -4.97 113.62 118.07 3k4w n SER 230 Ca 0.19 0.00 0.07 0.00 -1.33 0.00 0.00 58.87 57.81 3k4w n SER 230 Cb 0.09 0.00 0.53 0.00 -0.75 0.00 0.00 64.21 64.08 3k4w n SER 230 CO 0.00 0.00 0.00 2.19 -1.23 0.00 0.00 175.04 176.00 3k4w h PHE 231 N 0.00 0.00 -0.00 0.66 -5.15 -1.86 -2.75 116.94 107.84 3k4w h PHE 231 Ca 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.77 3k4w h PHE 231 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.17 3k4w h PHE 231 CO 0.00 0.23 -0.01 -0.11 -2.00 0.00 0.00 178.31 176.43 3k4w n LEU 232 N -3.90 0.10 -0.36 2.10 7.94 -0.65 -3.93 117.00 118.29 3k4w n LEU 232 Ca -0.02 0.04 0.28 0.00 -1.11 0.00 0.00 56.01 55.20 3k4w n LEU 232 Cb 0.32 -0.07 0.56 0.00 0.53 0.00 0.00 43.42 44.76 3k4w n LEU 232 CO 0.35 0.02 1.23 0.00 -1.11 0.00 0.00 177.39 177.87 3k4w h ALA 233 N 3.88 2.43 -0.01 1.96 0.00 -1.49 0.15 119.26 126.17 3k4w h ALA 233 Ca 0.00 0.08 0.00 0.00 0.00 0.00 0.00 54.91 54.99 3k4w h ALA 233 Cb 0.10 0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.98 3k4w h ALA 233 CO 0.00 -0.91 -0.22 -0.25 0.00 0.00 0.00 179.25 177.87 3k4w n ASP 234 N -4.64 0.77 -0.88 0.00 8.00 -1.25 -4.28 116.55 114.27 3k4w n ASP 234 Ca 0.29 -0.69 0.01 0.00 0.71 0.00 0.00 54.79 55.12 3k4w n ASP 234 Cb 1.08 0.06 0.00 0.00 -0.02 0.00 0.00 41.12 42.24 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 -0.85 0.00 -4.34 -1.24 1.74 0.45 -4.84 116.66 107.58 3k4w n ARG 235 Ca 0.12 -1.28 -0.30 0.00 -0.77 0.00 0.00 57.85 55.62 3k4w n ARG 235 Cb 0.32 -0.24 -0.11 0.00 -1.02 0.00 0.00 32.46 31.41 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 0.00 1.91 -0.10 5.56 1.75 -0.74 -1.24 119.30 126.44 3k4w s MET 236 Ca 0.12 -1.11 0.02 0.00 -1.25 0.00 0.00 55.69 53.47 3k4w s MET 236 Cb 0.14 -2.17 0.01 0.00 2.84 0.00 0.00 34.83 35.65 3k4w s MET 236 CO -0.06 0.50 -0.16 -0.51 -0.65 0.00 0.00 175.02 174.14 3k4w s LEU 237 N -2.05 1.74 0.12 4.11 1.43 -0.23 -4.36 118.68 119.45 3k4w s LEU 237 Ca 0.18 -0.42 -0.31 0.00 -1.03 0.00 0.00 54.13 52.55 3k4w s LEU 237 Cb -0.11 -1.09 -0.09 0.00 0.03 0.00 0.00 46.19 44.94 3k4w s LEU 237 CO 0.10 0.03 1.47 0.12 0.23 0.00 0.00 176.35 178.30 3k4w s PHE 238 N 0.91 3.10 -0.04 0.29 5.36 -0.12 -4.46 117.98 123.02 3k4w s PHE 238 Ca -0.08 0.78 -0.20 0.00 -0.96 0.00 0.00 56.93 56.47 3k4w s PHE 238 Cb -0.15 -3.79 0.04 0.00 -0.34 0.00 0.00 43.02 38.78 3k4w s PHE 238 CO -0.00 -2.86 0.45 0.20 -1.46 0.00 0.00 175.22 171.54 3k4w s GLY 239 N 1.25 -0.32 -0.04 13.12 0.00 -1.26 -0.39 107.32 119.68 3k4w s GLY 239 Ca 0.67 0.77 0.16 0.00 0.00 0.00 0.00 44.72 46.32 3k4w s GLY 239 CO 0.30 0.51 0.32 -1.30 0.00 0.00 0.00 173.10 172.94 3k4w n THR 240 N 1.32 0.13 -1.70 0.90 -2.24 -1.25 -4.18 114.28 107.26 3k4w n THR 240 Ca -0.20 -0.41 -0.18 0.00 -2.27 0.00 0.00 64.05 61.00 3k4w n THR 240 Cb 0.56 0.04 -0.06 0.00 -2.10 0.00 0.00 70.33 68.77 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 -2.13 -0.33 -1.49 6.98 0.00 -0.36 -3.99 120.51 119.19 3k4w n ALA 241 Ca -0.06 0.26 -0.54 0.00 0.00 0.00 0.00 53.44 53.10 3k4w n ALA 241 Cb 0.50 -1.87 -0.06 0.00 0.00 0.00 0.00 19.45 18.02 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 -2.81 0.47 0.57 0.00 9.36 -1.20 -0.69 117.16 122.86 3k4w n TYR 242 Ca -0.19 0.95 0.06 0.00 3.32 0.00 0.00 57.90 62.05 3k4w n TYR 242 Cb 0.61 -2.09 0.18 0.00 -0.63 0.00 0.00 39.34 37.41 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 1.44 2.18 -0.13 2.98 -0.04 -1.26 -1.66 135.00 138.51 3k4w n PRO 243 Ca 0.19 -1.48 -0.02 0.00 -0.04 0.00 0.00 63.50 62.14 3k4w n PRO 243 Cb 0.16 -1.44 0.20 0.00 -0.04 0.00 0.00 33.50 32.38 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 2.28 0.83 -5.86 0.54 2.86 -1.21 -3.43 114.93 110.93 3k4w h MET 244 Ca 0.00 -0.16 -0.58 0.00 -2.06 0.00 0.00 59.70 56.90 3k4w h MET 244 Cb 0.70 -0.13 -0.29 0.00 0.06 0.00 0.00 31.60 31.94 3k4w h MET 244 CO 0.06 0.73 -0.85 0.00 1.06 0.00 0.00 176.91 177.92 3k4w n PRO 246 N 2.61 2.22 0.03 0.00 -0.04 -1.26 -3.82 135.00 134.73 3k4w n PRO 246 Ca -0.15 0.79 -0.11 0.00 -0.04 0.00 0.00 63.50 63.99 3k4w n PRO 246 Cb 0.53 -2.46 -0.05 0.00 -0.04 0.00 0.00 33.50 31.49 3k4w n PRO 246 CO 0.00 0.00 0.00 -0.07 -0.04 0.00 0.00 175.50 175.39 3k4w h LEU 247 N 3.96 -0.25 0.16 1.53 3.38 -1.96 -2.95 115.31 119.19 3k4w h LEU 247 Ca -0.46 0.04 -0.01 0.00 0.09 0.00 0.00 57.88 57.55 3k4w h LEU 247 Cb 1.27 0.12 0.00 0.00 0.09 0.00 0.00 40.66 42.13 3k4w h LEU 247 CO 0.73 -0.12 -0.08 0.50 0.09 0.00 0.00 178.44 179.57 3k4w h LYS 248 N -0.13 -0.21 -0.59 1.13 3.64 -1.93 -1.78 116.57 116.71 3k4w h LYS 248 Ca 0.05 0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.41 3k4w h LYS 248 Cb 0.19 0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.03 3k4w h LYS 248 CO -0.12 0.20 0.22 0.93 -2.27 0.00 0.00 179.45 178.42 3k4w h GLU 249 N -0.71 0.86 -0.02 1.90 3.07 -1.98 -1.39 114.58 116.31 3k4w h GLU 249 Ca -0.02 -0.14 -0.01 0.00 -0.50 0.00 0.00 59.36 58.69 3k4w h GLU 249 Cb 0.50 -0.15 -0.00 0.00 -0.84 0.00 0.00 28.75 28.27 3k4w h GLU 249 CO 0.04 0.71 -0.03 -0.92 -1.40 0.00 0.00 179.01 177.41 3k4w h TYR 250 N 0.84 0.07 -0.41 4.33 3.20 -1.49 -2.48 116.97 121.03 3k4w h TYR 250 Ca 0.20 -0.02 -0.05 0.00 3.14 0.00 0.00 58.73 62.00 3k4w h TYR 250 Cb 0.18 -0.01 -0.02 0.00 1.54 0.00 0.00 36.73 38.42 3k4w h TYR 250 CO 0.01 0.56 0.08 1.15 -1.64 0.00 0.00 178.16 178.32 3k4w h THR 251 N -0.44 1.24 -0.41 1.81 2.02 -1.18 0.73 112.91 116.68 3k4w h THR 251 Ca 0.00 -0.85 -0.02 0.00 0.77 0.00 0.00 66.41 66.32 3k4w h THR 251 Cb 0.55 1.00 -0.02 0.00 -1.74 0.00 0.00 68.15 67.94 3k4w h THR 251 CO 0.01 0.29 0.19 -0.33 0.37 0.00 0.00 175.52 176.05 3k4w h GLU 252 N 0.53 0.60 -0.01 6.66 5.08 -1.31 -0.30 114.58 125.83 3k4w h GLU 252 Ca 0.13 -0.10 0.03 0.00 -1.00 0.00 0.00 59.36 58.42 3k4w h GLU 252 Cb 0.35 -0.10 -0.04 0.00 0.50 0.00 0.00 28.75 29.46 3k4w h GLU 252 CO 0.01 0.54 -0.22 2.35 -1.00 0.00 0.00 179.01 180.69 3k4w h TRP 253 N 0.53 -0.57 -0.96 4.33 7.01 -1.30 -2.89 115.95 122.09 3k4w h TRP 253 Ca 0.14 0.02 0.14 0.00 2.11 0.00 0.00 58.89 61.30 3k4w h TRP 253 Cb 0.14 0.26 -0.08 0.00 -2.10 0.00 0.00 29.16 27.38 3k4w h TRP 253 CO -0.01 -0.30 0.61 0.35 -2.79 0.00 0.00 178.44 176.30 3k4w h PHE 254 N -0.34 1.02 0.00 2.65 3.57 -0.18 -1.37 116.94 122.29 3k4w h PHE 254 Ca 0.06 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.59 3k4w h PHE 254 Cb 0.42 -0.32 0.00 0.00 2.79 0.00 0.00 35.95 38.84 3k4w h PHE 254 CO -0.26 0.37 0.00 1.28 -2.23 0.00 0.00 178.31 177.47 3k4w n LEU 255 N -4.61 0.00 -0.49 0.59 4.77 -0.18 -1.68 117.00 115.39 3k4w n LEU 255 Ca 0.19 0.43 0.12 0.00 -0.03 0.00 0.00 56.01 56.72 3k4w n LEU 255 Cb 0.42 -0.43 0.12 0.00 -2.33 0.00 0.00 43.42 41.20 3k4w n LEU 255 CO 0.27 -0.15 0.45 0.35 -1.33 0.00 0.00 177.39 176.99 3k4w n THR 256 N -1.43 0.00 -2.03 -5.08 -2.24 -0.52 -4.98 114.28 98.00 3k4w n THR 256 Ca 0.06 -0.25 -0.41 0.00 -2.27 0.00 0.00 64.05 61.18 3k4w n THR 256 Cb 0.21 1.04 -0.02 0.00 -2.10 0.00 0.00 70.33 69.46 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 -2.41 4.40 -1.12 3.22 1.43 -0.68 -4.93 118.68 118.60 3k4w s LEU 257 Ca 0.22 2.79 -0.20 0.00 -1.03 0.00 0.00 54.13 55.91 3k4w s LEU 257 Cb 0.19 -3.65 -0.06 0.00 0.03 0.00 0.00 46.19 42.70 3k4w s LEU 257 CO 0.52 -0.63 1.96 -0.81 0.23 0.00 0.00 176.35 177.62 3k4w n PRO 258 N 0.72 2.12 -4.81 1.29 -0.04 -1.26 -4.86 135.00 128.15 3k4w n PRO 258 Ca 0.00 -2.43 -0.27 0.00 -0.04 0.00 0.00 63.50 60.76 3k4w n PRO 258 Cb 0.41 -3.31 -0.17 0.00 -0.04 0.00 0.00 33.50 30.39 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 6.07 1.48 0.35 0.52 1.01 -1.26 -4.95 121.20 124.42 3k4w s ILE 259 Ca 0.58 -0.68 -0.27 0.00 0.00 0.00 0.00 60.65 60.27 3k4w s ILE 259 Cb 0.09 -1.31 -0.12 0.00 0.01 0.00 0.00 42.46 41.12 3k4w s ILE 259 CO 0.07 0.43 1.23 2.29 0.00 0.00 0.00 174.94 178.96 3k4w n LYS 260 N 3.72 1.94 -0.35 2.79 2.85 -1.26 -4.57 118.16 123.28 3k4w n LYS 260 Ca -0.21 0.68 0.10 0.00 -1.05 0.00 0.00 58.31 57.83 3k4w n LYS 260 Cb 0.52 -2.24 0.29 0.00 -0.65 0.00 0.00 35.03 32.95 3k4w n LYS 260 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 177.40 176.00 3k4w h PRO 261 N 2.35 0.85 -0.40 -1.58 0.11 -1.98 0.24 132.00 131.59 3k4w h PRO 261 Ca -0.45 -0.05 -0.08 0.00 0.11 0.00 0.00 66.00 65.53 3k4w h PRO 261 Cb 1.30 -0.19 -0.02 0.00 0.11 0.00 0.00 31.00 32.20 3k4w h PRO 261 CO 0.62 0.56 -0.08 0.38 -0.21 0.00 0.00 178.00 179.27 3k4w h ASP 262 N 0.88 0.67 -0.36 -2.05 2.03 -2.01 -2.35 116.42 113.23 3k4w h ASP 262 Ca 0.52 -0.18 -0.13 0.00 -0.73 0.00 0.00 57.03 56.51 3k4w h ASP 262 Cb 0.66 -0.18 -0.01 0.00 -0.83 0.00 0.00 39.33 38.97 3k4w h ASP 262 CO -0.29 0.79 -0.25 0.00 -1.03 0.00 0.00 179.24 178.45 3k4w h ALA 263 N 1.28 0.77 -0.58 4.15 0.00 -1.55 -3.07 119.26 120.26 3k4w h ALA 263 Ca 0.12 -0.39 0.02 0.00 0.00 0.00 0.00 54.91 54.65 3k4w h ALA 263 Cb 0.51 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.11 3k4w h ALA 263 CO 0.03 0.66 0.36 1.98 0.00 0.00 0.00 179.25 182.28 3k4w h MET 264 N 0.74 0.70 -0.84 0.00 -1.53 -0.29 -0.67 114.93 113.04 3k4w h MET 264 Ca 0.09 -0.04 -0.03 0.00 -3.44 0.00 0.00 59.70 56.28 3k4w h MET 264 Cb 0.80 -0.16 -0.04 0.00 -0.55 0.00 0.00 31.60 31.65 3k4w h MET 264 CO 0.07 0.46 0.42 0.93 0.14 0.00 0.00 176.91 178.93 3k4w h GLU 265 N 0.72 1.20 -0.31 0.39 5.08 -1.45 -0.28 114.58 119.93 3k4w h GLU 265 Ca 0.23 -0.17 -0.04 0.00 -1.00 0.00 0.00 59.36 58.38 3k4w h GLU 265 Cb -0.01 -0.22 -0.01 0.00 0.50 0.00 0.00 28.75 29.01 3k4w h GLU 265 CO -0.09 0.92 0.05 0.87 -1.00 0.00 0.00 179.01 179.76 3k4w h LYS 266 N 1.19 0.52 -0.39 2.33 1.57 -1.36 -1.16 116.57 119.26 3k4w h LYS 266 Ca 0.29 -0.14 -0.09 0.00 -1.87 0.00 0.00 60.65 58.84 3k4w h LYS 266 Cb 0.10 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.33 3k4w h LYS 266 CO -0.04 0.62 -0.11 0.82 -0.57 0.00 0.00 179.45 180.16 3k4w h ILE 267 N 0.34 1.25 0.00 1.86 2.04 -0.86 0.24 117.51 122.38 3k4w h ILE 267 Ca 0.09 -1.13 -0.17 0.00 1.00 0.00 0.00 64.86 64.66 3k4w h ILE 267 Cb 0.35 1.07 -0.02 0.00 -0.74 0.00 0.00 36.82 37.48 3k4w h ILE 267 CO 0.01 0.38 -0.81 -0.07 0.00 0.00 0.00 178.15 177.66 3k4w h LEU 268 N 0.63 0.00 0.00 1.44 3.38 -1.04 -0.29 115.31 119.43 3k4w h LEU 268 Ca 0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 3k4w h LEU 268 Cb 0.56 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.31 3k4w h LEU 268 CO 0.04 0.81 0.00 0.00 0.09 0.00 0.00 178.44 179.37 3k4w n HIS 269 N -3.31 0.00 -0.16 1.13 1.44 -0.51 -1.09 115.22 112.72 3k4w n HIS 269 Ca 0.01 0.00 -0.07 0.00 -2.01 0.00 0.00 57.72 55.64 3k4w n HIS 269 Cb 0.86 0.00 0.01 0.00 0.12 0.00 0.00 29.99 30.98 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 0.67 0.99 -1.39 0.00 -0.57 -1.50 103.07 101.27 3k4w h GLY 270 Ca 0.00 -0.26 -0.11 0.00 0.00 0.00 0.00 47.33 46.96 3k4w h GLY 270 CO 0.00 0.25 -0.21 3.43 0.00 0.00 0.00 176.54 180.02 3k4w h ASN 271 N 0.64 0.79 -0.51 0.19 2.35 -0.83 -2.04 115.58 116.17 3k4w h ASN 271 Ca 0.17 -0.42 -0.05 0.00 -0.55 0.00 0.00 56.30 55.45 3k4w h ASN 271 Cb -0.05 -0.22 -0.03 0.00 0.05 0.00 0.00 38.32 38.07 3k4w h ASN 271 CO -0.04 1.04 0.16 0.00 -1.65 0.00 0.00 177.43 176.94 3k4w h ALA 272 N 0.77 1.23 -0.35 -0.83 0.00 -1.76 -2.52 119.26 115.80 3k4w h ALA 272 Ca 0.07 -0.19 -0.11 0.00 0.00 0.00 0.00 54.91 54.68 3k4w h ALA 272 Cb 0.76 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 3k4w h ALA 272 CO 0.06 0.54 -0.24 0.93 0.00 0.00 0.00 179.25 180.54 3k4w h GLU 273 N 0.82 0.70 -0.39 0.00 5.08 -0.94 0.38 114.58 120.23 3k4w h GLU 273 Ca 0.18 -0.28 -0.10 0.00 -1.00 0.00 0.00 59.36 58.16 3k4w h GLU 273 Cb 0.26 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.47 3k4w h GLU 273 CO -0.01 0.87 -0.16 -0.09 -1.00 0.00 0.00 179.01 178.62 3k4w h ARG 274 N 0.61 0.72 -0.25 2.33 2.43 -1.28 -0.47 114.38 118.46 3k4w h ARG 274 Ca 0.08 -0.26 -0.08 0.00 -0.81 0.00 0.00 59.98 58.92 3k4w h ARG 274 Cb 0.73 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.23 3k4w h ARG 274 CO 0.06 0.84 -0.16 -0.07 -1.51 0.00 0.00 179.97 179.12 3k4w h LEU 275 N 0.64 0.57 -1.04 3.80 3.38 -1.04 -1.74 115.31 119.88 3k4w h LEU 275 Ca 0.10 -0.44 -0.10 0.00 0.09 0.00 0.00 57.88 57.54 3k4w h LEU 275 Cb 0.64 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.22 3k4w h LEU 275 CO 0.04 0.88 -0.35 -0.07 0.09 0.00 0.00 178.44 179.03 3k4w h LEU 276 N 0.26 0.24 0.07 1.67 3.38 -0.86 -1.55 115.31 118.53 3k4w h LEU 276 Ca 0.05 -0.09 0.00 0.00 0.09 0.00 0.00 57.88 57.93 3k4w h LEU 276 Cb 0.69 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.37 3k4w h LEU 276 CO 0.04 0.58 -0.07 0.00 0.09 0.00 0.00 178.44 179.09 3k4w h ALA 277 N 1.43 -0.13 -0.34 1.53 0.00 -1.02 -1.56 119.26 119.16 3k4w h ALA 277 Ca 0.02 -0.02 0.05 0.00 0.00 0.00 0.00 54.91 54.97 3k4w h ALA 277 Cb 0.73 0.09 -0.05 0.00 0.00 0.00 0.00 17.79 18.56 3k4w h ALA 277 CO 0.06 -0.58 0.06 0.37 0.00 0.00 0.00 179.25 179.15 3k4w h GLN 278 N -0.15 0.17 -0.38 0.00 4.15 -0.89 -1.36 115.11 116.65 3k4w h GLN 278 Ca 0.00 -0.01 0.03 0.00 0.77 0.00 0.00 58.65 59.44 3k4w h GLN 278 Cb 0.14 -0.04 -0.02 0.00 0.21 0.00 0.00 27.48 27.78 3k4w h GLN 278 CO -0.02 0.11 0.25 0.00 -1.93 0.00 0.00 178.83 177.25 3k4w h ALA 279 N 1.26 1.87 0.00 3.38 0.00 -1.28 0.46 119.26 124.95 3k4w h ALA 279 Ca 0.16 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.06 3k4w h ALA 279 Cb 0.19 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.88 3k4w h ALA 279 CO -0.22 0.08 0.00 0.78 0.00 0.00 0.00 179.25 179.89 3k4w h GLY 280 N 0.39 0.00 0.00 0.00 0.00 -0.19 -3.46 103.07 99.80 3k4w h GLY 280 Ca 0.15 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.48 3k4w h GLY 280 CO -0.04 0.00 0.00 0.54 0.00 0.00 0.00 176.54 177.04