#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 4.60 -0.02 3.23 2.20 -1.26 -4.84 119.74 123.64 3k4w s LYS 2 Ca 0.00 1.42 0.04 0.00 -0.36 0.00 0.00 55.97 57.08 3k4w s LYS 2 Cb 0.00 -3.44 -0.01 0.00 -1.51 0.00 0.00 37.83 32.88 3k4w s LYS 2 CO 0.00 0.02 -0.15 0.42 -0.36 0.00 0.00 175.35 175.28 3k4w s ILE 3 N 0.73 1.23 -0.23 5.43 1.01 -1.12 -4.28 121.20 123.97 3k4w s ILE 3 Ca 0.50 -0.64 -0.02 0.00 0.00 0.00 0.00 60.65 60.49 3k4w s ILE 3 Cb -0.22 -1.04 0.02 0.00 0.01 0.00 0.00 42.46 41.23 3k4w s ILE 3 CO 0.28 0.35 -0.07 -0.63 0.00 0.00 0.00 174.94 174.88 3k4w s ILE 4 N -0.17 2.95 -0.18 2.92 1.01 -0.42 -0.92 121.20 126.39 3k4w s ILE 4 Ca 0.02 -0.86 -0.25 0.00 0.00 0.00 0.00 60.65 59.56 3k4w s ILE 4 Cb -0.08 -2.43 -0.01 0.00 0.01 0.00 0.00 42.46 39.95 3k4w s ILE 4 CO 0.00 0.30 0.82 -0.62 0.00 0.00 0.00 174.94 175.44 3k4w s ASP 5 N 1.37 6.92 0.00 3.58 -1.08 0.39 -4.65 116.67 123.20 3k4w s ASP 5 Ca 0.02 1.14 0.31 0.00 -0.52 0.00 0.00 52.55 53.50 3k4w s ASP 5 Cb -0.16 -2.45 1.67 0.00 -1.46 0.00 0.00 42.92 40.53 3k4w s ASP 5 CO -0.05 -0.41 2.11 0.33 0.52 0.00 0.00 175.17 177.66 3k4w n PHE 6 N 5.35 0.00 -3.31 -5.34 7.35 -0.20 -0.65 117.46 120.67 3k4w n PHE 6 Ca 0.04 0.00 -0.11 0.00 -0.76 0.00 0.00 57.45 56.62 3k4w n PHE 6 Cb 0.49 -0.07 -0.05 0.00 0.35 0.00 0.00 39.48 40.19 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 -2.15 0.71 -0.10 -4.13 3.52 -1.25 -4.51 118.95 111.04 3k4w s ARG 7 Ca 0.41 -0.69 -0.02 0.00 -0.13 0.00 0.00 55.73 55.30 3k4w s ARG 7 Cb 0.21 -0.46 0.04 0.00 -1.56 0.00 0.00 34.95 33.18 3k4w s ARG 7 CO 0.39 -1.20 0.02 -1.17 -0.81 0.00 0.00 175.30 172.53 3k4w s LEU 8 N 1.53 0.64 -0.47 -0.88 0.20 -0.74 -1.25 118.68 117.70 3k4w s LEU 8 Ca 0.17 -0.24 -0.05 0.00 0.69 0.00 0.00 54.13 54.69 3k4w s LEU 8 Cb -0.12 -0.43 0.12 0.00 -0.43 0.00 0.00 46.19 45.34 3k4w s LEU 8 CO -0.04 -0.23 0.30 -0.13 -0.29 0.00 0.00 176.35 175.97 3k4w s ARG 9 N 1.98 2.29 0.50 1.98 3.00 -0.05 -3.73 118.95 124.93 3k4w s ARG 9 Ca 0.04 -1.92 -0.20 0.00 0.00 0.00 0.00 55.73 53.65 3k4w s ARG 9 Cb -0.13 -3.75 -0.08 0.00 0.00 0.00 0.00 34.95 30.99 3k4w s ARG 9 CO -0.06 -1.14 1.06 -1.25 0.00 0.00 0.00 175.30 173.91 3k4w s PRO 10 N 1.03 3.68 -1.40 3.54 0.04 -1.26 -4.14 135.00 136.49 3k4w s PRO 10 Ca 0.09 1.41 -0.15 0.00 0.04 0.00 0.00 61.00 62.39 3k4w s PRO 10 Cb -0.23 -2.07 0.02 0.00 0.04 0.00 0.00 34.50 32.25 3k4w s PRO 10 CO -0.03 -0.54 2.21 -0.35 0.04 0.00 0.00 177.00 178.34 3k4w n PRO 11 N -1.09 2.74 -3.89 0.56 -0.04 -1.26 -4.72 135.00 127.30 3k4w n PRO 11 Ca 0.10 -2.52 -0.11 0.00 -0.04 0.00 0.00 63.50 60.93 3k4w n PRO 11 Cb 0.52 -3.25 -0.11 0.00 -0.04 0.00 0.00 33.50 30.62 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 3.35 -0.15 0.00 0.55 0.00 -1.26 -4.22 121.76 120.03 3k4w s ALA 12 Ca 0.48 -0.12 0.00 0.00 0.00 0.00 0.00 51.96 52.32 3k4w s ALA 12 Cb 0.14 0.02 0.00 0.00 0.00 0.00 0.00 23.12 23.29 3k4w s ALA 12 CO -0.07 -0.13 0.00 -1.33 0.00 0.00 0.00 175.76 174.23 3k4w n MET 13 N 2.12 0.00 0.27 0.00 2.81 -1.26 -1.64 117.12 119.41 3k4w n MET 13 Ca -0.19 0.00 0.10 0.00 -1.81 0.00 0.00 57.70 55.80 3k4w n MET 13 Cb 0.57 0.00 0.71 0.00 -0.71 0.00 0.00 33.22 33.79 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 2.00 3.03 0.00 -1.97 -2.07 103.07 104.06 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 0.00 0.74 0.00 0.00 0.00 176.54 177.28 3k4w h PHE 15 N 0.00 0.00 0.00 5.60 0.04 -1.60 -2.10 116.94 118.88 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 0.07 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.22 3k4w h PHE 15 CO 0.00 0.00 0.00 -0.07 -0.60 0.00 0.00 178.31 177.64 3k4w h LEU 16 N 0.00 0.00 -0.17 1.54 3.38 -1.45 -2.64 115.31 115.97 3k4w h LEU 16 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3k4w h LEU 16 Cb 0.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.96 3k4w h LEU 16 CO 0.00 0.00 -0.27 0.59 0.09 0.00 0.00 178.44 178.85 3k4w n ASN 17 N -2.80 0.53 -4.79 -0.43 3.02 -0.79 -4.31 115.26 105.69 3k4w n ASN 17 Ca 0.00 -0.36 -0.34 0.00 -0.03 0.00 0.00 54.58 53.85 3k4w n ASN 17 Cb 0.24 0.02 -0.03 0.00 -0.61 0.00 0.00 39.78 39.40 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 -2.75 2.88 0.53 5.41 0.00 -1.00 -3.99 121.76 122.84 3k4w s ALA 18 Ca 0.19 0.63 0.21 0.00 0.00 0.00 0.00 51.96 52.99 3k4w s ALA 18 Cb 0.19 -3.26 1.35 0.00 0.00 0.00 0.00 23.12 21.40 3k4w s ALA 18 CO 0.57 -0.33 2.08 -0.09 0.00 0.00 0.00 175.76 177.99 3k4w h ARG 19 N 1.61 0.00 -0.01 0.00 2.43 -1.90 0.18 114.38 116.70 3k4w h ARG 19 Ca -0.49 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.68 3k4w h ARG 19 Cb 1.22 0.00 -0.00 0.00 -0.42 0.00 0.00 29.97 30.77 3k4w h ARG 19 CO 0.59 0.00 0.13 -0.84 -1.51 0.00 0.00 179.97 178.34 3k4w h ILE 20 N 0.00 0.02 0.00 1.20 3.07 -1.92 0.06 117.51 119.94 3k4w h ILE 20 Ca 0.12 0.00 -0.08 0.00 1.55 0.00 0.00 64.86 66.45 3k4w h ILE 20 Cb 0.49 0.87 -0.02 0.00 -0.27 0.00 0.00 36.82 37.89 3k4w h ILE 20 CO -0.00 0.00 -1.33 -1.22 -1.05 0.00 0.00 178.15 174.55 3k4w n TYR 21 N -3.04 0.00 0.13 0.16 4.01 0.23 -4.60 117.16 114.04 3k4w n TYR 21 Ca -0.02 0.00 0.09 0.00 -0.16 0.00 0.00 57.90 57.81 3k4w n TYR 21 Cb 0.20 -0.23 0.03 0.00 -0.31 0.00 0.00 39.34 39.03 3k4w n TYR 21 CO 0.00 0.00 0.00 1.79 -0.46 0.00 0.00 176.86 178.19 3k4w h THR 22 N 0.00 0.13 -2.23 -0.72 1.35 -0.68 -3.35 112.91 107.40 3k4w h THR 22 Ca -0.12 -1.22 -0.60 0.00 -0.55 0.00 0.00 66.41 63.92 3k4w h THR 22 Cb 1.20 1.76 -0.42 0.00 -1.73 0.00 0.00 68.15 68.96 3k4w h THR 22 CO 0.01 0.07 -0.60 0.54 -0.25 0.00 0.00 175.52 175.29 3k4w n ARG 23 N -2.85 2.46 0.25 4.72 5.12 -0.00 -4.88 116.66 121.47 3k4w n ARG 23 Ca -0.00 -4.63 0.16 0.00 -1.93 0.00 0.00 57.85 51.45 3k4w n ARG 23 Cb 0.60 -2.24 0.68 0.00 -1.16 0.00 0.00 32.46 30.34 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 4.23 0.00 -0.06 5.56 0.13 -1.77 -2.56 132.00 137.54 3k4w h PRO 24 Ca 0.19 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.32 3k4w h PRO 24 Cb 0.67 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.80 3k4w h PRO 24 CO 0.82 0.00 0.04 0.38 -0.23 0.00 0.00 178.00 179.01 3k4w h ASP 25 N 0.00 0.07 0.06 1.44 2.03 -1.94 0.27 116.42 118.36 3k4w h ASP 25 Ca 0.00 -0.04 -0.00 0.00 -0.73 0.00 0.00 57.03 56.26 3k4w h ASP 25 Cb 0.43 -0.02 -0.00 0.00 -0.83 0.00 0.00 39.33 38.91 3k4w h ASP 25 CO 0.00 0.09 -0.04 0.40 -1.03 0.00 0.00 179.24 178.66 3k4w h ILE 26 N 0.05 0.92 0.03 4.15 2.04 -1.89 -2.72 117.51 120.08 3k4w h ILE 26 Ca 0.02 0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.90 3k4w h ILE 26 Cb 0.03 0.92 -0.02 0.00 -0.74 0.00 0.00 36.82 37.00 3k4w h ILE 26 CO -0.00 0.00 -0.12 -0.09 0.00 0.00 0.00 178.15 177.93 3k4w h ARG 27 N -0.10 -0.21 -0.75 2.37 2.43 -1.28 -2.89 114.38 113.95 3k4w h ARG 27 Ca -0.00 0.01 0.05 0.00 -0.81 0.00 0.00 59.98 59.23 3k4w h ARG 27 Cb 0.08 0.05 -0.05 0.00 -0.42 0.00 0.00 29.97 29.64 3k4w h ARG 27 CO 0.00 -0.14 0.49 -0.91 -1.51 0.00 0.00 179.97 177.90 3k4w h ASN 28 N -0.22 0.73 -0.96 -3.80 2.35 -0.48 -0.87 115.58 112.33 3k4w h ASN 28 Ca 0.03 -0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.78 3k4w h ASN 28 Cb 0.26 -0.16 -0.05 0.00 0.05 0.00 0.00 38.32 38.43 3k4w h ASN 28 CO -0.10 0.48 0.60 -0.09 -1.65 0.00 0.00 177.43 176.67 3k4w h ARG 29 N 0.83 1.29 -0.04 0.81 2.43 -1.32 -0.62 114.38 117.76 3k4w h ARG 29 Ca 0.31 -0.10 -0.03 0.00 -0.81 0.00 0.00 59.98 59.35 3k4w h ARG 29 Cb 0.18 -0.28 0.00 0.00 -0.42 0.00 0.00 29.97 29.45 3k4w h ARG 29 CO -0.10 0.88 -0.09 0.35 -1.51 0.00 0.00 179.97 179.50 3k4w h PHE 30 N 1.31 0.17 -0.34 2.20 3.57 -1.17 -1.52 116.94 121.16 3k4w h PHE 30 Ca 0.35 -0.06 0.06 0.00 3.53 0.00 0.00 57.97 61.85 3k4w h PHE 30 Cb -0.09 -0.03 -0.06 0.00 2.79 0.00 0.00 35.95 38.56 3k4w h PHE 30 CO 0.00 0.70 -0.01 1.15 -2.23 0.00 0.00 178.31 177.92 3k4w h THR 31 N -0.41 0.73 -0.64 4.41 2.02 -1.06 -1.47 112.91 116.49 3k4w h THR 31 Ca -0.00 -0.03 -0.08 0.00 0.77 0.00 0.00 66.41 67.07 3k4w h THR 31 Cb 0.70 0.64 -0.02 0.00 -1.74 0.00 0.00 68.15 67.72 3k4w h THR 31 CO 0.02 0.01 0.10 0.03 0.37 0.00 0.00 175.52 176.05 3k4w h ARG 32 N 0.08 1.06 0.00 6.66 3.08 -1.14 -2.30 114.38 121.83 3k4w h ARG 32 Ca 0.17 -0.29 -0.02 0.00 0.07 0.00 0.00 59.98 59.91 3k4w h ARG 32 Cb 0.23 -0.12 -0.00 0.00 0.08 0.00 0.00 29.97 30.16 3k4w h ARG 32 CO -0.29 0.99 -0.08 0.37 -1.07 0.00 0.00 179.97 179.89 3k4w h GLN 33 N 0.97 0.00 0.00 0.04 4.15 -0.83 -1.90 115.11 117.54 3k4w h GLN 33 Ca 0.19 0.00 -0.13 0.00 0.77 0.00 0.00 58.65 59.48 3k4w h GLN 33 Cb 0.44 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.11 3k4w h GLN 33 CO 0.01 0.08 -0.61 1.25 -1.93 0.00 0.00 178.83 177.63 3k4w h LEU 34 N 0.00 0.00 0.00 -2.39 5.85 -0.77 -3.47 115.31 114.53 3k4w h LEU 34 Ca -0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 3k4w h LEU 34 Cb 0.14 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.17 3k4w h LEU 34 CO 0.01 0.61 0.00 0.61 -0.34 0.00 0.00 178.44 179.33 3k4w n GLY 35 N 0.45 1.16 3.92 3.75 0.00 -0.71 -4.91 105.19 108.85 3k4w n GLY 35 Ca -0.01 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.72 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 -1.90 3.50 0.05 1.61 0.08 -0.91 -5.00 117.98 115.41 3k4w s PHE 36 Ca 0.00 0.28 -0.22 0.00 0.12 0.00 0.00 56.93 57.10 3k4w s PHE 36 Cb 0.00 -1.79 -0.06 0.00 -0.57 0.00 0.00 43.02 40.60 3k4w s PHE 36 CO 0.00 0.51 0.67 -1.21 -0.10 0.00 0.00 175.22 175.09 3k4w s GLU 37 N -2.88 4.39 0.36 0.44 0.41 -1.26 -3.44 118.70 116.72 3k4w s GLU 37 Ca 0.36 0.91 -0.28 0.00 -0.41 0.00 0.00 54.97 55.55 3k4w s GLU 37 Cb -0.12 -3.32 -0.11 0.00 -1.78 0.00 0.00 34.13 28.80 3k4w s GLU 37 CO 0.28 0.42 1.46 -2.30 -0.49 0.00 0.00 175.26 174.63 3k4w n PRO 38 N 2.39 2.56 -1.71 0.39 -0.02 -1.26 -4.49 135.00 132.85 3k4w n PRO 38 Ca -0.06 0.90 -0.42 0.00 -2.02 0.00 0.00 63.50 61.90 3k4w n PRO 38 Cb 0.50 -2.60 -0.03 0.00 -0.02 0.00 0.00 33.50 31.35 3k4w n PRO 38 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3k4w n ALA 39 N 0.58 2.74 0.26 3.55 0.00 -1.26 -4.91 120.51 121.47 3k4w n ALA 39 Ca 0.03 0.39 0.11 0.00 0.00 0.00 0.00 53.44 53.97 3k4w n ALA 39 Cb 0.38 -2.53 0.69 0.00 0.00 0.00 0.00 19.45 17.99 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 6.99 0.00 -0.73 0.00 0.11 -1.98 -0.51 132.00 135.88 3k4w h PRO 40 Ca -0.43 0.00 0.03 0.00 0.11 0.00 0.00 66.00 65.70 3k4w h PRO 40 Cb 1.20 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 32.27 3k4w h PRO 40 CO 0.96 0.11 0.48 1.03 -0.21 0.00 0.00 178.00 180.37 3k4w h SER 41 N 0.00 0.77 0.54 -2.05 0.87 -1.89 -0.78 113.55 111.01 3k4w h SER 41 Ca -0.00 -0.01 -0.29 0.00 -1.23 0.00 0.00 61.79 60.26 3k4w h SER 41 Cb 0.27 -0.18 -0.00 0.00 -0.44 0.00 0.00 62.40 62.04 3k4w h SER 41 CO 0.01 0.54 -1.40 0.00 -0.53 0.00 0.00 176.83 175.45 3k4w h ALA 42 N 1.57 0.21 -0.27 6.23 0.00 -1.62 -0.45 119.26 124.94 3k4w h ALA 42 Ca 0.29 -1.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.10 3k4w h ALA 42 Cb 0.03 0.16 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 3k4w h ALA 42 CO -0.08 1.08 -0.16 0.93 0.00 0.00 0.00 179.25 181.02 3k4w h GLU 43 N 0.07 0.46 -0.38 0.00 4.39 -0.75 -2.93 114.58 115.44 3k4w h GLU 43 Ca -0.19 -0.14 0.00 0.00 0.34 0.00 0.00 59.36 59.37 3k4w h GLU 43 Cb 1.99 -0.05 0.00 0.00 -0.10 0.00 0.00 28.75 30.60 3k4w h GLU 43 CO 0.18 0.62 0.00 0.39 -1.16 0.00 0.00 179.01 179.03 3k4w n GLU 44 N -4.19 2.62 -3.80 2.33 1.02 -0.33 -4.98 120.64 113.31 3k4w n GLU 44 Ca 0.00 -2.08 -0.23 0.00 -0.02 0.00 0.00 57.16 54.83 3k4w n GLU 44 Cb 0.34 -1.33 0.01 0.00 -0.02 0.00 0.00 31.44 30.45 3k4w n GLU 44 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 3k4w n LYS 45 N 0.76 -4.33 -3.99 3.49 5.02 -0.42 -4.91 118.16 113.78 3k4w n LYS 45 Ca 0.14 0.54 -0.34 0.00 -2.02 0.00 0.00 58.31 56.63 3k4w n LYS 45 Cb 0.45 -4.95 -0.15 0.00 -0.02 0.00 0.00 35.03 30.37 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 -4.33 4.29 0.11 4.39 0.15 -0.31 -4.95 113.70 113.05 3k4w s SER 46 Ca 0.02 -1.00 -0.19 0.00 0.70 0.00 0.00 55.95 55.49 3k4w s SER 46 Cb -0.01 -1.63 -0.06 0.00 -1.71 0.00 0.00 66.02 62.61 3k4w s SER 46 CO 0.84 -0.14 1.65 0.25 1.20 0.00 0.00 173.24 177.04 3k4w h LEU 47 N 7.96 0.37 -0.81 3.45 5.85 -1.86 -1.15 115.31 129.12 3k4w h LEU 47 Ca -0.30 -0.17 0.05 0.00 0.84 0.00 0.00 57.88 58.30 3k4w h LEU 47 Cb 1.09 -0.10 -0.06 0.00 0.37 0.00 0.00 40.66 41.97 3k4w h LEU 47 CO 0.55 0.43 0.50 -0.33 -0.34 0.00 0.00 178.44 179.26 3k4w h GLU 48 N 0.28 0.91 -0.37 1.25 4.39 -1.95 0.18 114.58 119.27 3k4w h GLU 48 Ca 0.09 -0.05 -0.03 0.00 0.34 0.00 0.00 59.36 59.70 3k4w h GLU 48 Cb 0.18 -0.21 -0.02 0.00 -0.10 0.00 0.00 28.75 28.61 3k4w h GLU 48 CO -0.01 0.60 0.11 -0.07 -1.16 0.00 0.00 179.01 178.48 3k4w h LEU 49 N 0.94 0.54 -1.09 1.33 3.38 -1.89 -2.23 115.31 116.29 3k4w h LEU 49 Ca 0.34 -0.21 0.09 0.00 0.09 0.00 0.00 57.88 58.19 3k4w h LEU 49 Cb 0.11 -0.14 -0.07 0.00 0.09 0.00 0.00 40.66 40.64 3k4w h LEU 49 CO -0.15 0.61 0.62 -0.03 0.09 0.00 0.00 178.44 179.58 3k4w h MET 50 N 0.45 0.98 -0.61 1.13 4.05 -0.31 -1.34 114.93 119.28 3k4w h MET 50 Ca 0.12 -0.06 -0.08 0.00 -0.28 0.00 0.00 59.70 59.40 3k4w h MET 50 Cb 0.27 -0.22 -0.02 0.00 -0.80 0.00 0.00 31.60 30.82 3k4w h MET 50 CO -0.00 0.65 0.07 0.74 0.23 0.00 0.00 176.91 178.59 3k4w h PHE 51 N 1.01 1.08 -0.80 1.39 0.04 -0.45 0.93 116.94 120.14 3k4w h PHE 51 Ca 0.45 -0.15 0.00 0.00 2.80 0.00 0.00 57.97 61.07 3k4w h PHE 51 Cb 0.36 -0.30 -0.04 0.00 2.20 0.00 0.00 35.95 38.18 3k4w h PHE 51 CO -0.00 0.93 0.52 0.93 -0.60 0.00 0.00 178.31 180.08 3k4w h GLU 52 N 0.95 1.06 -0.15 1.51 5.08 -1.10 -0.92 114.58 121.02 3k4w h GLU 52 Ca 0.18 -0.07 -0.21 0.00 -1.00 0.00 0.00 59.36 58.26 3k4w h GLU 52 Cb 0.45 -0.23 0.01 0.00 0.50 0.00 0.00 28.75 29.48 3k4w h GLU 52 CO 0.02 0.72 -0.76 0.93 -1.00 0.00 0.00 179.01 178.91 3k4w h GLU 53 N 1.09 0.72 0.01 2.33 5.08 -0.56 -1.63 114.58 121.62 3k4w h GLU 53 Ca 0.29 -0.58 0.02 0.00 -1.00 0.00 0.00 59.36 58.09 3k4w h GLU 53 Cb -0.10 0.12 -0.03 0.00 0.50 0.00 0.00 28.75 29.24 3k4w h GLU 53 CO -0.06 1.20 -0.17 0.52 -1.00 0.00 0.00 179.01 179.50 3k4w h MET 54 N 0.50 -0.27 -0.40 2.33 2.86 -0.74 -1.24 114.93 117.96 3k4w h MET 54 Ca -0.05 0.02 -0.03 0.00 -2.06 0.00 0.00 59.70 57.58 3k4w h MET 54 Cb 1.38 0.06 -0.02 0.00 0.06 0.00 0.00 31.60 33.08 3k4w h MET 54 CO 0.15 -0.18 0.11 0.00 1.06 0.00 0.00 176.91 178.05 3k4w h ALA 55 N 0.63 0.53 -0.32 6.32 0.00 -1.08 -0.43 119.26 124.90 3k4w h ALA 55 Ca 0.05 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.78 3k4w h ALA 55 Cb 0.35 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 3k4w h ALA 55 CO -0.15 0.18 0.20 0.00 0.00 0.00 0.00 179.25 179.48 3k4w h ALA 56 N 0.96 1.75 0.00 0.00 0.00 -1.26 -2.51 119.26 118.21 3k4w h ALA 56 Ca 0.13 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 3k4w h ALA 56 Cb 0.28 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 3k4w h ALA 56 CO -0.00 0.23 -0.16 0.00 0.00 0.00 0.00 179.25 179.32 3k4w h ALA 57 N 1.78 0.91 0.00 0.00 0.00 -0.54 -3.48 119.26 117.93 3k4w h ALA 57 Ca 0.12 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3k4w h ALA 57 Cb -0.03 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.74 3k4w h ALA 57 CO -0.02 0.19 0.00 0.41 0.00 0.00 0.00 179.25 179.83 3k4w n GLY 58 N 0.95 0.79 3.61 0.00 0.00 -0.26 -4.89 105.19 105.38 3k4w n GLY 58 Ca 0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.62 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 -2.19 4.00 -0.05 -0.61 1.01 -0.66 -2.77 121.20 119.93 3k4w s ILE 59 Ca 0.00 1.06 -0.05 0.00 0.00 0.00 0.00 60.65 61.66 3k4w s ILE 59 Cb 0.00 -4.20 -0.28 0.00 0.01 0.00 0.00 42.46 37.99 3k4w s ILE 59 CO 0.00 -0.67 0.66 -0.33 0.00 0.00 0.00 174.94 174.60 3k4w h GLU 60 N 10.13 0.28 -4.12 2.79 5.08 -1.33 -3.39 114.58 124.02 3k4w h GLU 60 Ca -0.27 -0.48 -0.14 0.00 -1.00 0.00 0.00 59.36 57.47 3k4w h GLU 60 Cb 1.10 0.18 -0.17 0.00 0.50 0.00 0.00 28.75 30.36 3k4w h GLU 60 CO 1.07 1.15 -0.68 -0.65 -1.00 0.00 0.00 179.01 178.90 3k4w s GLN 61 N -2.59 0.50 0.12 2.33 -0.21 -1.13 -4.60 119.66 114.09 3k4w s GLN 61 Ca -0.14 -0.97 0.05 0.00 0.02 0.00 0.00 55.36 54.32 3k4w s GLN 61 Cb 0.06 0.18 -0.04 0.00 1.00 0.00 0.00 33.01 34.21 3k4w s GLN 61 CO 0.83 -0.09 -0.12 0.20 -2.12 0.00 0.00 175.29 173.99 3k4w s GLY 62 N -2.35 1.03 -0.33 3.09 0.00 -0.79 -0.46 107.32 107.51 3k4w s GLY 62 Ca -0.02 -1.32 -0.09 0.00 0.00 0.00 0.00 44.72 43.29 3k4w s GLY 62 CO -0.06 -1.40 0.14 0.14 0.00 0.00 0.00 173.10 171.92 3k4w s VAL 63 N -2.52 4.29 -0.23 1.40 1.01 0.17 -0.94 120.40 123.58 3k4w s VAL 63 Ca 0.10 -0.76 -0.18 0.00 0.00 0.00 0.00 61.98 61.15 3k4w s VAL 63 Cb -0.02 -3.31 -0.03 0.00 0.00 0.00 0.00 36.38 33.02 3k4w s VAL 63 CO 0.02 -0.07 0.49 0.00 0.00 0.00 0.00 175.10 175.54 3k4w s VAL 65 N 1.88 4.16 0.00 0.00 1.01 -1.26 -2.47 120.40 123.72 3k4w s VAL 65 Ca 0.22 -0.27 0.00 0.00 0.00 0.00 0.00 61.98 61.93 3k4w s VAL 65 Cb -0.15 -2.83 0.00 0.00 0.00 0.00 0.00 36.38 33.40 3k4w s VAL 65 CO 0.09 0.50 0.00 0.61 0.00 0.00 0.00 175.10 176.30 3k4w n GLY 66 N 3.36 2.12 2.82 4.51 0.00 -1.26 -4.90 105.19 111.84 3k4w n GLY 66 Ca -0.17 -1.98 -0.14 0.00 0.00 0.00 0.00 46.02 43.73 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 3.34 0.39 -1.23 1.61 6.06 -0.57 -4.92 118.95 123.64 3k4w s ARG 67 Ca 0.00 -0.11 -0.05 0.00 -2.50 0.00 0.00 55.73 53.07 3k4w s ARG 67 Cb 0.00 -0.52 0.10 0.00 0.06 0.00 0.00 34.95 34.60 3k4w s ARG 67 CO 0.00 -1.05 2.46 -1.71 -2.50 0.00 0.00 175.30 172.50 3k4w n ASN 68 N 5.22 7.89 0.06 -2.12 4.05 -1.25 -0.49 115.26 128.62 3k4w n ASN 68 Ca 0.00 -3.12 0.05 0.00 0.45 0.00 0.00 54.58 51.96 3k4w n ASN 68 Cb 0.47 -1.35 -0.05 0.00 1.23 0.00 0.00 39.78 40.08 3k4w n ASN 68 CO 0.00 0.00 0.00 -1.54 -3.05 0.00 0.00 177.26 172.67 3k4w n SER 69 N 1.70 0.81 -2.65 1.20 3.41 -1.26 -4.20 113.62 112.62 3k4w n SER 69 Ca 0.62 0.34 -0.11 0.00 -0.26 0.00 0.00 58.87 59.45 3k4w n SER 69 Cb 0.29 0.37 -0.01 0.00 -0.26 0.00 0.00 64.21 64.60 3k4w n SER 69 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 175.04 173.34 3k4w n SER 70 N -2.77 -3.01 -4.41 4.04 3.41 -1.26 -4.94 113.62 104.68 3k4w n SER 70 Ca -0.06 0.15 -0.21 0.00 -0.26 0.00 0.00 58.87 58.50 3k4w n SER 70 Cb 0.71 -2.58 -0.10 0.00 -0.26 0.00 0.00 64.21 61.97 3k4w n SER 70 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3k4w s VAL 71 N -2.51 1.06 -0.12 -3.33 0.11 -1.26 -5.04 120.40 109.31 3k4w s VAL 71 Ca 0.08 -2.00 -0.39 0.00 -2.93 0.00 0.00 61.98 56.74 3k4w s VAL 71 Cb -0.05 -2.75 -0.19 0.00 -1.53 0.00 0.00 36.38 31.87 3k4w s VAL 71 CO 0.10 0.00 1.14 -0.11 -3.33 0.00 0.00 175.10 172.90 3k4w n LEU 72 N -0.66 0.28 0.00 2.54 7.94 -1.26 -1.36 117.00 124.48 3k4w n LEU 72 Ca -0.02 1.10 0.00 0.00 -1.11 0.00 0.00 56.01 55.98 3k4w n LEU 72 Cb 0.66 -0.86 0.00 0.00 0.53 0.00 0.00 43.42 43.76 3k4w n LEU 72 CO 0.41 -1.55 0.00 0.61 -1.11 0.00 0.00 177.39 175.76 3k4w n GLY 73 N 2.01 0.71 3.76 -3.96 0.00 -1.26 -5.00 105.19 101.45 3k4w n GLY 73 Ca 0.21 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.84 3k4w n GLY 73 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3k4w s SER 74 N -2.91 5.71 -0.39 1.61 1.04 -0.46 -4.24 113.70 114.06 3k4w s SER 74 Ca 0.00 2.84 0.01 0.00 0.48 0.00 0.00 55.95 59.28 3k4w s SER 74 Cb 0.00 -2.65 0.12 0.00 0.10 0.00 0.00 66.02 63.59 3k4w s SER 74 CO 0.00 -1.28 0.17 -0.69 0.98 0.00 0.00 173.24 172.42 3k4w s VAL 75 N -1.25 1.41 1.00 5.02 1.01 0.36 -4.51 120.40 123.44 3k4w s VAL 75 Ca 0.64 -2.20 -0.12 0.00 0.00 0.00 0.00 61.98 60.31 3k4w s VAL 75 Cb -0.42 -2.01 0.15 0.00 0.00 0.00 0.00 36.38 34.10 3k4w s VAL 75 CO 0.52 -0.78 0.86 -1.54 0.00 0.00 0.00 175.10 174.16 3k4w n SER 76 N 4.03 -0.88 0.05 3.32 3.41 -1.26 -1.52 113.62 120.77 3k4w n SER 76 Ca 0.04 0.23 -0.01 0.00 -0.26 0.00 0.00 58.87 58.87 3k4w n SER 76 Cb 0.38 -1.33 0.27 0.00 -0.26 0.00 0.00 64.21 63.27 3k4w n SER 76 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 175.04 175.66 3k4w h ASN 77 N -2.02 0.38 -0.45 4.04 2.35 -1.90 -2.17 115.58 115.81 3k4w h ASN 77 Ca -0.48 -0.11 -0.10 0.00 -0.55 0.00 0.00 56.30 55.06 3k4w h ASN 77 Cb 1.29 -0.10 -0.02 0.00 0.05 0.00 0.00 38.32 39.54 3k4w h ASN 77 CO 0.41 0.60 -0.08 0.00 -1.65 0.00 0.00 177.43 176.71 3k4w h ALA 78 N 1.44 0.91 -0.57 -0.83 0.00 -1.97 -0.93 119.26 117.30 3k4w h ALA 78 Ca 0.06 -0.32 -0.10 0.00 0.00 0.00 0.00 54.91 54.55 3k4w h ALA 78 Cb 0.57 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 3k4w h ALA 78 CO 0.04 0.63 -0.02 -0.44 0.00 0.00 0.00 179.25 179.46 3k4w h ASP 79 N 0.82 1.01 -0.29 0.00 3.32 -1.79 -1.98 116.42 117.52 3k4w h ASP 79 Ca 0.14 -0.31 -0.01 0.00 0.02 0.00 0.00 57.03 56.86 3k4w h ASP 79 Cb 0.60 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.86 3k4w h ASP 79 CO 0.04 1.08 0.13 0.58 -1.72 0.00 0.00 179.24 179.35 3k4w h VAL 80 N 0.92 1.16 -0.89 -1.35 2.07 -1.22 -2.74 116.25 114.19 3k4w h VAL 80 Ca 0.16 -0.47 0.06 0.00 0.82 0.00 0.00 66.70 67.27 3k4w h VAL 80 Cb 0.57 0.94 -0.06 0.00 -1.52 0.00 0.00 31.29 31.23 3k4w h VAL 80 CO 0.03 0.17 0.58 0.00 0.02 0.00 0.00 177.57 178.37 3k4w h ALA 81 N 0.98 1.50 -0.72 1.67 0.00 -1.03 -2.26 119.26 119.40 3k4w h ALA 81 Ca 0.10 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.94 3k4w h ALA 81 Cb 0.14 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 3k4w h ALA 81 CO -0.01 0.38 0.31 0.00 0.00 0.00 0.00 179.25 179.93 3k4w h ALA 82 N 1.51 1.19 -0.62 0.00 0.00 -1.14 -0.95 119.26 119.25 3k4w h ALA 82 Ca 0.37 -0.17 -0.09 0.00 0.00 0.00 0.00 54.91 55.03 3k4w h ALA 82 Cb 0.15 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 3k4w h ALA 82 CO -0.13 0.60 0.04 0.28 0.00 0.00 0.00 179.25 180.03 3k4w h VAL 83 N 1.03 1.26 -0.37 0.00 2.07 -1.19 -1.39 116.25 117.66 3k4w h VAL 83 Ca 0.24 -1.11 -0.07 0.00 0.82 0.00 0.00 66.70 66.59 3k4w h VAL 83 Cb 0.16 0.76 -0.02 0.00 -1.52 0.00 0.00 31.29 30.67 3k4w h VAL 83 CO -0.02 0.41 -0.05 0.00 0.02 0.00 0.00 177.57 177.92 3k4w h ALA 84 N 1.00 1.21 0.00 1.67 0.00 -1.16 -2.47 119.26 119.52 3k4w h ALA 84 Ca 0.18 -0.26 -0.04 0.00 0.00 0.00 0.00 54.91 54.79 3k4w h ALA 84 Cb 0.51 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 3k4w h ALA 84 CO 0.02 0.51 -0.21 -0.22 0.00 0.00 0.00 179.25 179.36 3k4w h LYS 85 N 0.58 0.00 0.00 0.00 3.64 -1.00 -1.26 116.57 118.53 3k4w h LYS 85 Ca 0.11 0.00 -0.22 0.00 -1.27 0.00 0.00 60.65 59.27 3k4w h LYS 85 Cb 0.45 0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.24 3k4w h LYS 85 CO 0.02 0.21 -1.07 0.00 -2.27 0.00 0.00 179.45 176.34 3k4w h ALA 86 N 1.79 0.38 -2.01 5.00 0.00 -1.17 -3.39 119.26 119.87 3k4w h ALA 86 Ca -0.00 -0.96 -0.50 0.00 0.00 0.00 0.00 54.91 53.45 3k4w h ALA 86 Cb 1.12 -0.10 -0.40 0.00 0.00 0.00 0.00 17.79 18.41 3k4w h ALA 86 CO 0.03 1.27 -1.17 0.66 0.00 0.00 0.00 179.25 180.04 3k4w n TYR 87 N -3.33 0.19 0.23 0.00 4.01 -0.94 -4.99 117.16 112.32 3k4w n TYR 87 Ca -0.02 -3.78 0.07 0.00 -0.16 0.00 0.00 57.90 54.01 3k4w n TYR 87 Cb 0.95 -0.41 0.53 0.00 -0.31 0.00 0.00 39.34 40.10 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 3.16 0.00 0.00 -0.72 0.13 -1.43 -0.51 132.00 132.63 3k4w h PRO 88 Ca 0.10 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.23 3k4w h PRO 88 Cb 0.94 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.07 3k4w h PRO 88 CO 0.50 0.21 0.00 0.38 -0.23 0.00 0.00 178.00 178.87 3k4w h ASP 89 N 0.00 0.00 0.00 1.44 2.03 -1.94 -3.37 116.42 114.58 3k4w h ASP 89 Ca -0.00 0.00 -0.39 0.00 -0.73 0.00 0.00 57.03 55.91 3k4w h ASP 89 Cb 0.42 0.00 -0.06 0.00 -0.83 0.00 0.00 39.33 38.86 3k4w h ASP 89 CO 0.03 0.00 -2.32 0.29 -1.03 0.00 0.00 179.24 176.21 3k4w n LYS 90 N -2.60 0.51 -4.35 4.15 4.76 -0.31 -4.74 118.16 115.57 3k4w n LYS 90 Ca 0.04 0.21 -0.34 0.00 -2.87 0.00 0.00 58.31 55.35 3k4w n LYS 90 Cb 0.42 -1.36 -0.11 0.00 -1.84 0.00 0.00 35.03 32.14 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 -2.43 3.08 -0.30 2.13 0.08 -0.53 -1.89 117.98 118.13 3k4w s PHE 91 Ca -0.33 -0.12 -0.10 0.00 0.12 0.00 0.00 56.93 56.50 3k4w s PHE 91 Cb 0.12 -1.93 -0.02 0.00 -0.57 0.00 0.00 43.02 40.62 3k4w s PHE 91 CO 0.43 0.12 0.17 -1.01 -0.10 0.00 0.00 175.22 174.82 3k4w s HIS 92 N 0.05 3.18 0.24 0.36 3.76 -0.12 -4.69 115.29 118.07 3k4w s HIS 92 Ca 0.01 -0.29 -0.30 0.00 -0.15 0.00 0.00 55.06 54.33 3k4w s HIS 92 Cb -0.13 -2.37 -0.09 0.00 1.11 0.00 0.00 32.58 31.10 3k4w s HIS 92 CO 0.02 -0.34 0.95 -1.25 -0.85 0.00 0.00 174.74 173.27 3k4w s PRO 93 N 1.68 4.84 0.01 8.40 0.04 -1.26 -1.66 135.00 147.05 3k4w s PRO 93 Ca 0.06 1.50 0.07 0.00 0.04 0.00 0.00 61.00 62.67 3k4w s PRO 93 Cb -0.17 -3.26 -0.03 0.00 0.04 0.00 0.00 34.50 31.08 3k4w s PRO 93 CO 0.08 0.50 -0.19 0.08 0.04 0.00 0.00 177.00 177.51 3k4w s VAL 94 N -1.19 2.69 -0.24 -0.36 1.01 -1.03 -4.59 120.40 116.69 3k4w s VAL 94 Ca 0.41 -1.09 -0.10 0.00 0.00 0.00 0.00 61.98 61.21 3k4w s VAL 94 Cb -0.26 -2.08 -0.05 0.00 0.00 0.00 0.00 36.38 33.99 3k4w s VAL 94 CO 0.32 0.43 0.14 -0.83 0.00 0.00 0.00 175.10 175.17 3k4w s GLY 95 N -1.14 1.95 -0.12 4.51 0.00 0.82 -4.45 107.32 108.90 3k4w s GLY 95 Ca 0.13 -0.91 -0.04 0.00 0.00 0.00 0.00 44.72 43.90 3k4w s GLY 95 CO 0.03 0.39 0.02 -1.35 0.00 0.00 0.00 173.10 172.19 3k4w s SER 96 N 1.10 5.33 -0.18 1.64 1.04 -1.26 0.60 113.70 121.98 3k4w s SER 96 Ca 0.07 0.12 -0.12 0.00 0.48 0.00 0.00 55.95 56.50 3k4w s SER 96 Cb -0.14 -1.66 -0.05 0.00 0.10 0.00 0.00 66.02 64.28 3k4w s SER 96 CO 0.05 0.31 0.21 -0.63 0.98 0.00 0.00 173.24 174.16 3k4w s ILE 97 N -0.48 5.36 -0.23 -1.02 1.01 -0.90 -4.50 121.20 120.44 3k4w s ILE 97 Ca 0.09 0.37 -0.03 0.00 0.00 0.00 0.00 60.65 61.08 3k4w s ILE 97 Cb -0.12 -3.55 0.11 0.00 0.01 0.00 0.00 42.46 38.91 3k4w s ILE 97 CO 0.02 0.42 0.24 -0.70 0.00 0.00 0.00 174.94 174.92 3k4w s GLU 98 N 0.40 0.23 -0.06 2.79 2.12 -1.26 -4.68 118.70 118.23 3k4w s GLU 98 Ca 0.12 0.09 -0.07 0.00 0.36 0.00 0.00 54.97 55.47 3k4w s GLU 98 Cb -0.12 -1.05 0.02 0.00 0.26 0.00 0.00 34.13 33.24 3k4w s GLU 98 CO 0.01 -0.77 0.19 0.00 -0.54 0.00 0.00 175.26 174.15 3k4w s ALA 99 N 2.33 -0.46 0.01 6.30 0.00 -1.26 -4.85 121.76 123.83 3k4w s ALA 99 Ca 0.08 0.47 -0.15 0.00 0.00 0.00 0.00 51.96 52.36 3k4w s ALA 99 Cb -0.15 -0.27 -0.08 0.00 0.00 0.00 0.00 23.12 22.62 3k4w s ALA 99 CO -0.19 -0.10 1.00 0.00 0.00 0.00 0.00 175.76 176.47 3k4w h ALA 100 N 5.68 -0.92 -2.65 0.00 0.00 -2.01 -3.47 119.26 115.89 3k4w h ALA 100 Ca -0.26 -0.12 -0.56 0.00 0.00 0.00 0.00 54.91 53.97 3k4w h ALA 100 Cb 1.20 0.21 -0.06 0.00 0.00 0.00 0.00 17.79 19.13 3k4w h ALA 100 CO 0.39 -0.88 -0.54 0.95 0.00 0.00 0.00 179.25 179.17 3k4w s THR 101 N -3.78 4.65 0.48 0.00 -4.23 -1.26 -5.01 115.64 106.49 3k4w s THR 101 Ca -0.08 -1.02 0.15 0.00 -1.18 0.00 0.00 61.69 59.56 3k4w s THR 101 Cb 0.01 -3.39 0.23 0.00 1.34 0.00 0.00 72.50 70.69 3k4w s THR 101 CO 0.23 -0.12 2.07 -0.09 -0.54 0.00 0.00 174.62 176.18 3k4w h ARG 102 N 2.31 0.04 -0.01 3.99 2.43 -1.92 -1.33 114.38 119.89 3k4w h ARG 102 Ca -0.48 -0.00 -0.07 0.00 -0.81 0.00 0.00 59.98 58.61 3k4w h ARG 102 Cb 1.20 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.73 3k4w h ARG 102 CO 0.64 0.10 -0.34 -0.22 -1.51 0.00 0.00 179.97 178.64 3k4w h LYS 103 N 0.04 0.02 0.07 0.20 3.64 -1.99 -0.63 116.57 117.92 3k4w h LYS 103 Ca 0.01 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.38 3k4w h LYS 103 Cb 0.14 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.96 3k4w h LYS 103 CO 0.01 0.36 -0.03 1.49 -2.27 0.00 0.00 179.45 179.00 3k4w h GLU 104 N 0.02 -0.09 -0.71 1.90 4.81 -1.70 -2.71 114.58 116.10 3k4w h GLU 104 Ca -0.00 0.01 0.07 0.00 -0.13 0.00 0.00 59.36 59.30 3k4w h GLU 104 Cb 0.61 0.02 -0.06 0.00 0.63 0.00 0.00 28.75 29.95 3k4w h GLU 104 CO 0.04 0.33 0.40 0.00 -0.73 0.00 0.00 179.01 179.05 3k4w h ALA 105 N 0.34 0.97 0.00 2.92 0.00 -1.05 -0.03 119.26 122.40 3k4w h ALA 105 Ca -0.01 0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.84 3k4w h ALA 105 Cb 0.46 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 3k4w h ALA 105 CO 0.02 0.06 -0.40 0.52 0.00 0.00 0.00 179.25 179.45 3k4w h MET 106 N 0.71 0.00 -0.03 0.00 2.86 -1.18 0.68 114.93 117.97 3k4w h MET 106 Ca 0.33 0.00 -0.17 0.00 -2.06 0.00 0.00 59.70 57.80 3k4w h MET 106 Cb 0.23 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.88 3k4w h MET 106 CO -0.20 0.40 -0.74 0.00 1.06 0.00 0.00 176.91 177.43 3k4w h ALA 107 N 1.60 0.70 -0.34 6.32 0.00 -1.06 -1.42 119.26 125.07 3k4w h ALA 107 Ca -0.00 -0.63 -0.14 0.00 0.00 0.00 0.00 54.91 54.13 3k4w h ALA 107 Cb 0.93 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.63 3k4w h ALA 107 CO 0.05 0.83 -0.36 1.96 0.00 0.00 0.00 179.25 181.73 3k4w h GLN 108 N 0.13 0.84 -0.54 0.00 4.20 -0.40 -2.32 115.11 117.02 3k4w h GLN 108 Ca -0.02 -0.45 -0.11 0.00 0.06 0.00 0.00 58.65 58.13 3k4w h GLN 108 Cb 1.30 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 29.08 3k4w h GLN 108 CO 0.11 1.09 -0.08 1.98 -0.67 0.00 0.00 178.83 181.26 3k4w h MET 109 N 0.62 0.99 -0.35 1.46 4.05 -0.91 -1.94 114.93 118.85 3k4w h MET 109 Ca 0.05 -0.34 0.00 0.00 -0.28 0.00 0.00 59.70 59.13 3k4w h MET 109 Cb 0.94 -0.07 -0.02 0.00 -0.80 0.00 0.00 31.60 31.65 3k4w h MET 109 CO 0.09 1.02 0.23 0.37 0.23 0.00 0.00 176.91 178.85 3k4w h GLN 110 N 0.89 0.46 -0.79 0.39 5.75 -1.19 -1.83 115.11 118.77 3k4w h GLN 110 Ca 0.14 -0.03 -0.03 0.00 -0.15 0.00 0.00 58.65 58.59 3k4w h GLN 110 Cb 0.63 -0.10 -0.04 0.00 1.07 0.00 0.00 27.48 29.04 3k4w h GLN 110 CO 0.04 0.30 0.37 1.49 -2.65 0.00 0.00 178.83 178.39 3k4w h GLU 111 N 0.47 1.15 -0.04 1.69 4.81 -1.31 0.15 114.58 121.50 3k4w h GLU 111 Ca 0.13 -0.17 0.03 0.00 -0.13 0.00 0.00 59.36 59.21 3k4w h GLU 111 Cb -0.05 -0.20 -0.04 0.00 0.63 0.00 0.00 28.75 29.09 3k4w h GLU 111 CO -0.03 0.90 -0.16 0.82 -0.73 0.00 0.00 179.01 179.80 3k4w h ILE 112 N 1.13 0.59 -0.76 2.32 2.04 -1.16 0.26 117.51 121.93 3k4w h ILE 112 Ca 0.27 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 66.09 3k4w h ILE 112 Cb 0.13 0.59 -0.03 0.00 -0.74 0.00 0.00 36.82 36.77 3k4w h ILE 112 CO -0.03 0.00 0.31 -0.07 0.00 0.00 0.00 178.15 178.36 3k4w h LEU 113 N -0.25 1.04 -1.68 1.44 3.38 -1.22 -2.07 115.31 115.95 3k4w h LEU 113 Ca 0.07 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 57.86 3k4w h LEU 113 Cb 0.34 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.81 3k4w h LEU 113 CO -0.19 0.92 0.08 0.44 0.09 0.00 0.00 178.44 179.79 3k4w h ASP 114 N 1.09 0.26 0.66 -0.43 3.32 0.01 -1.67 116.42 119.66 3k4w h ASP 114 Ca 0.25 -0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.28 3k4w h ASP 114 Cb 0.20 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 39.69 3k4w h ASP 114 CO -0.02 0.24 0.00 0.18 -1.72 0.00 0.00 179.24 177.92 3k4w n LEU 115 N -4.44 0.00 0.00 1.55 4.77 0.84 -4.89 117.00 114.82 3k4w n LEU 115 Ca 0.00 0.42 0.00 0.00 -0.03 0.00 0.00 56.01 56.40 3k4w n LEU 115 Cb 0.12 -0.42 0.00 0.00 -2.33 0.00 0.00 43.42 40.79 3k4w n LEU 115 CO 0.36 -0.09 0.00 0.61 -1.33 0.00 0.00 177.39 176.94 3k4w n GLY 116 N 0.82 0.73 3.76 -0.72 0.00 -0.63 -5.03 105.19 104.12 3k4w n GLY 116 Ca 0.08 -0.11 -0.40 0.00 0.00 0.00 0.00 46.02 45.59 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 -2.00 4.60 -0.01 -0.61 1.01 -0.84 -4.96 121.20 118.39 3k4w s ILE 117 Ca 0.00 1.60 0.01 0.00 0.00 0.00 0.00 60.65 62.27 3k4w s ILE 117 Cb 0.00 -4.10 0.02 0.00 0.01 0.00 0.00 42.46 38.39 3k4w s ILE 117 CO 0.00 0.44 0.94 0.54 0.00 0.00 0.00 174.94 176.86 3k4w n ARG 118 N 2.26 2.44 -4.33 2.79 5.12 -1.26 -4.21 116.66 119.47 3k4w n ARG 118 Ca -0.05 -1.43 -0.18 0.00 -1.93 0.00 0.00 57.85 54.26 3k4w n ARG 118 Cb 0.50 -0.96 -0.14 0.00 -1.16 0.00 0.00 32.46 30.70 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 -0.98 0.73 0.17 0.55 1.01 -1.26 -4.32 121.20 117.11 3k4w s ILE 119 Ca 0.02 -0.51 0.11 0.00 0.00 0.00 0.00 60.65 60.27 3k4w s ILE 119 Cb 0.02 -0.64 -0.04 0.00 0.01 0.00 0.00 42.46 41.81 3k4w s ILE 119 CO 0.00 0.12 -0.23 0.54 0.00 0.00 0.00 174.94 175.37 3k4w s VAL 120 N -0.39 2.41 0.01 2.92 0.11 -0.95 -0.13 120.40 124.38 3k4w s VAL 120 Ca 0.02 -1.92 0.06 0.00 -2.93 0.00 0.00 61.98 57.21 3k4w s VAL 120 Cb -0.04 -2.14 -0.02 0.00 -1.53 0.00 0.00 36.38 32.65 3k4w s VAL 120 CO -0.00 -0.06 -0.20 0.21 -3.33 0.00 0.00 175.10 171.72 3k4w s ASN 121 N -2.52 2.32 -0.02 3.54 2.47 0.20 -0.44 114.94 120.49 3k4w s ASN 121 Ca 0.19 -0.41 0.01 0.00 0.42 0.00 0.00 52.86 53.07 3k4w s ASN 121 Cb -0.09 -0.23 0.01 0.00 -1.45 0.00 0.00 41.25 39.49 3k4w s ASN 121 CO 0.09 0.21 -0.03 -0.76 -3.72 0.00 0.00 177.10 172.89 3k4w s LEU 122 N -0.71 1.56 -0.46 3.21 1.43 -0.12 -2.12 118.68 121.47 3k4w s LEU 122 Ca 0.07 -0.08 0.08 0.00 -1.03 0.00 0.00 54.13 53.17 3k4w s LEU 122 Cb -0.08 -0.30 0.30 0.00 0.03 0.00 0.00 46.19 46.14 3k4w s LEU 122 CO 0.00 -0.02 0.70 -0.62 0.23 0.00 0.00 176.35 176.64 3k4w n GLU 123 N 3.63 1.56 0.24 1.70 1.02 -1.26 -1.71 120.64 125.81 3k4w n GLU 123 Ca -0.21 -3.81 0.16 0.00 -0.02 0.00 0.00 57.16 53.28 3k4w n GLU 123 Cb 0.54 -1.74 0.69 0.00 -0.02 0.00 0.00 31.44 30.92 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 3.53 0.00 0.00 3.49 0.13 -1.88 -2.38 132.00 134.89 3k4w h PRO 124 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 3k4w h PRO 124 Cb 0.80 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.93 3k4w h PRO 124 CO 0.60 0.00 0.00 0.78 -0.23 0.00 0.00 178.00 179.15 3k4w h GLY 125 N 1.77 0.00 -1.74 1.56 0.00 -1.62 -2.13 103.07 100.91 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 -2.80 0.99 -1.46 4.60 0.24 -0.90 -4.11 118.33 114.88 3k4w n VAL 126 Ca 0.02 -0.99 -0.32 0.00 -2.04 0.00 0.00 64.34 61.00 3k4w n VAL 126 Cb 0.31 0.51 0.08 0.00 -1.47 0.00 0.00 33.84 33.27 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 -1.00 2.44 0.46 6.34 0.51 -1.07 -4.91 118.94 121.70 3k4w s TRP 127 Ca 0.32 1.58 0.22 0.00 -2.12 0.00 0.00 56.10 56.10 3k4w s TRP 127 Cb 0.16 -3.19 1.22 0.00 -0.81 0.00 0.00 33.47 30.86 3k4w s TRP 127 CO 0.22 -1.95 1.85 0.00 -0.51 0.00 0.00 176.95 176.56 3k4w h ALA 128 N -0.54 2.43 -3.44 0.98 0.00 -1.95 -2.84 119.26 113.90 3k4w h ALA 128 Ca -0.46 0.01 -0.68 0.00 0.00 0.00 0.00 54.91 53.78 3k4w h ALA 128 Cb 1.25 0.01 -0.35 0.00 0.00 0.00 0.00 17.79 18.70 3k4w h ALA 128 CO 0.51 -0.72 -0.66 0.99 0.00 0.00 0.00 179.25 179.37 3k4w s THR 129 N -5.28 2.89 0.31 0.00 2.01 -1.26 -5.11 115.64 109.20 3k4w s THR 129 Ca -0.07 -1.82 -0.29 0.00 0.31 0.00 0.00 61.69 59.82 3k4w s THR 129 Cb 0.23 -2.86 -0.11 0.00 0.01 0.00 0.00 72.50 69.77 3k4w s THR 129 CO 0.78 -0.40 1.44 -2.84 -0.69 0.00 0.00 174.62 172.91 3k4w s PRO 130 N 1.13 4.23 0.06 4.92 0.02 -1.07 -4.96 135.00 139.34 3k4w s PRO 130 Ca 0.02 2.39 0.00 0.00 0.02 0.00 0.00 61.00 63.44 3k4w s PRO 130 Cb -0.21 -3.05 -0.04 0.00 0.02 0.00 0.00 34.50 31.23 3k4w s PRO 130 CO -0.04 -0.41 -0.05 0.00 -0.33 0.00 0.00 177.00 176.17 3k4w s MET 131 N -1.28 0.63 0.54 5.54 0.23 -0.82 -4.96 119.30 119.17 3k4w s MET 131 Ca 0.55 -1.13 -0.19 0.00 -1.03 0.00 0.00 55.69 53.89 3k4w s MET 131 Cb -0.43 0.03 -0.06 0.00 -1.53 0.00 0.00 34.83 32.83 3k4w s MET 131 CO 0.52 -0.06 1.07 -1.01 -2.03 0.00 0.00 175.02 173.51 3k4w s HIS 132 N -3.28 2.90 0.62 3.16 3.76 -1.26 -3.00 115.29 118.20 3k4w s HIS 132 Ca 0.04 1.55 0.41 0.00 -0.15 0.00 0.00 55.06 56.91 3k4w s HIS 132 Cb 0.03 -3.10 2.24 0.00 1.11 0.00 0.00 32.58 32.86 3k4w s HIS 132 CO -0.06 -1.11 2.33 -0.39 -0.85 0.00 0.00 174.74 174.65 3k4w h VAL 133 N 1.09 0.12 -0.59 -0.90 -1.51 -1.92 -0.02 116.25 112.53 3k4w h VAL 133 Ca -0.49 -0.04 -0.02 0.00 -1.23 0.00 0.00 66.70 64.92 3k4w h VAL 133 Cb 1.23 1.04 -0.01 0.00 -2.13 0.00 0.00 31.29 31.42 3k4w h VAL 133 CO 0.58 0.00 0.02 -0.90 -1.23 0.00 0.00 177.57 176.04 3k4w n ASP 134 N -3.25 5.68 -4.75 4.19 5.75 -1.26 -4.91 116.55 117.99 3k4w n ASP 134 Ca -0.03 -2.95 -0.41 0.00 -0.01 0.00 0.00 54.79 51.38 3k4w n ASP 134 Cb 0.09 -0.69 -0.02 0.00 -1.03 0.00 0.00 41.12 39.47 3k4w n ASP 134 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 3k4w s ASP 135 N -0.79 6.42 0.41 -1.12 -1.08 -0.02 -4.87 116.67 115.62 3k4w s ASP 135 Ca 0.55 2.91 0.25 0.00 -0.52 0.00 0.00 52.55 55.74 3k4w s ASP 135 Cb 0.42 -2.64 1.31 0.00 -1.46 0.00 0.00 42.92 40.55 3k4w s ASP 135 CO 0.16 -0.87 1.66 0.08 0.52 0.00 0.00 175.17 176.72 3k4w h ARG 136 N 4.66 0.17 0.00 4.34 0.11 -1.94 -1.24 114.38 120.48 3k4w h ARG 136 Ca -0.47 -0.01 -0.01 0.00 0.10 0.00 0.00 59.98 59.59 3k4w h ARG 136 Cb 1.22 -0.04 -0.00 0.00 1.11 0.00 0.00 29.97 32.26 3k4w h ARG 136 CO 0.77 0.11 -0.03 0.00 0.10 0.00 0.00 179.97 180.93 3k4w h ARG 137 N 0.18 0.00 0.00 0.08 3.08 -1.96 -1.98 114.38 113.78 3k4w h ARG 137 Ca 0.76 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.81 3k4w h ARG 137 Cb 2.21 0.00 0.00 0.00 0.08 0.00 0.00 29.97 32.26 3k4w h ARG 137 CO -0.43 0.03 -0.68 1.28 -1.07 0.00 0.00 179.97 179.10 3k4w n LEU 138 N -3.23 0.61 -0.37 3.04 4.77 -0.47 -4.40 117.00 116.96 3k4w n LEU 138 Ca -0.02 0.08 -0.01 0.00 -0.03 0.00 0.00 56.01 56.03 3k4w n LEU 138 Cb 0.19 -0.19 0.12 0.00 -2.33 0.00 0.00 43.42 41.21 3k4w n LEU 138 CO 0.25 0.04 1.28 1.88 -1.33 0.00 0.00 177.39 179.51 3k4w h TYR 139 N 0.00 1.22 -0.17 -1.77 -1.99 -1.45 -0.29 116.97 112.52 3k4w h TYR 139 Ca 0.00 0.03 0.02 0.00 2.00 0.00 0.00 58.73 60.78 3k4w h TYR 139 Cb 0.65 -0.41 -0.01 0.00 2.00 0.00 0.00 36.73 38.96 3k4w h TYR 139 CO 0.00 0.74 0.12 -1.35 -0.00 0.00 0.00 178.16 177.67 3k4w h PRO 140 N 1.29 0.14 -0.03 4.88 0.11 -1.77 -1.97 132.00 134.65 3k4w h PRO 140 Ca 0.37 -0.01 -0.13 0.00 0.11 0.00 0.00 66.00 66.35 3k4w h PRO 140 Cb -0.09 -0.03 0.01 0.00 0.11 0.00 0.00 31.00 31.00 3k4w h PRO 140 CO -0.10 0.09 -0.47 1.25 -0.21 0.00 0.00 178.00 178.56 3k4w h LEU 141 N 0.14 0.47 -1.07 2.35 5.85 -1.37 -2.49 115.31 119.20 3k4w h LEU 141 Ca 0.07 -0.72 0.12 0.00 0.84 0.00 0.00 57.88 58.19 3k4w h LEU 141 Cb 0.11 -0.14 -0.08 0.00 0.37 0.00 0.00 40.66 40.92 3k4w h LEU 141 CO -0.01 1.12 0.62 1.88 -0.34 0.00 0.00 178.44 181.71 3k4w h TYR 142 N -0.14 1.09 -0.20 1.25 0.05 -1.04 -1.35 116.97 116.63 3k4w h TYR 142 Ca -0.05 0.03 -0.15 0.00 0.05 0.00 0.00 58.73 58.61 3k4w h TYR 142 Cb 1.17 -0.35 -0.01 0.00 1.01 0.00 0.00 36.73 38.55 3k4w h TYR 142 CO 0.14 0.44 -0.49 0.00 -1.05 0.00 0.00 178.16 177.20 3k4w h ALA 143 N 1.55 0.78 -0.67 3.88 0.00 -1.24 0.35 119.26 123.91 3k4w h ALA 143 Ca 0.48 -0.48 -0.07 0.00 0.00 0.00 0.00 54.91 54.84 3k4w h ALA 143 Cb 0.49 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 18.16 3k4w h ALA 143 CO -0.24 0.67 0.13 0.35 0.00 0.00 0.00 179.25 180.16 3k4w h PHE 144 N 0.42 1.14 -0.03 0.00 3.57 -0.96 -0.44 116.94 120.63 3k4w h PHE 144 Ca 0.02 -0.14 -0.26 0.00 3.53 0.00 0.00 57.97 61.12 3k4w h PHE 144 Cb 1.01 -0.32 0.02 0.00 2.79 0.00 0.00 35.95 39.45 3k4w h PHE 144 CO 0.04 0.94 -0.99 0.00 -2.23 0.00 0.00 178.31 176.07 3k4w h GLU 146 N 0.41 0.62 -0.16 0.00 4.81 -0.26 0.27 114.58 120.27 3k4w h GLU 146 Ca -0.11 -0.13 -0.09 0.00 -0.13 0.00 0.00 59.36 58.90 3k4w h GLU 146 Cb 1.63 -0.09 -0.01 0.00 0.63 0.00 0.00 28.75 30.91 3k4w h GLU 146 CO 0.19 0.60 -0.32 -0.44 -0.73 0.00 0.00 179.01 178.32 3k4w h ASP 147 N 0.51 0.32 -0.26 1.04 3.32 -0.99 -3.08 116.42 117.28 3k4w h ASP 147 Ca 0.13 -0.11 0.00 0.00 0.02 0.00 0.00 57.03 57.07 3k4w h ASP 147 Cb 0.23 -0.09 0.00 0.00 0.22 0.00 0.00 39.33 39.69 3k4w h ASP 147 CO -0.01 0.63 0.00 0.59 -1.72 0.00 0.00 179.24 178.73 3k4w n ASN 148 N -4.10 2.38 -1.69 6.45 3.02 -0.55 -4.94 115.26 115.83 3k4w n ASN 148 Ca -0.01 -1.84 -0.14 0.00 -0.03 0.00 0.00 54.58 52.56 3k4w n ASN 148 Cb 0.42 -0.17 -0.00 0.00 -0.61 0.00 0.00 39.78 39.42 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 1.28 -0.21 3.63 7.41 0.00 -0.69 -5.00 105.19 111.61 3k4w n GLY 149 Ca 0.17 -0.27 -0.39 0.00 0.00 0.00 0.00 46.02 45.53 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 -2.74 5.13 0.33 -0.61 1.01 -0.00 -4.69 121.20 119.63 3k4w s ILE 150 Ca 0.02 0.75 -0.27 0.00 0.00 0.00 0.00 60.65 61.14 3k4w s ILE 150 Cb -0.01 -3.76 -0.09 0.00 0.01 0.00 0.00 42.46 38.60 3k4w s ILE 150 CO 0.03 0.15 1.10 -2.84 0.00 0.00 0.00 174.94 173.38 3k4w s PRO 151 N 1.97 4.44 -0.16 2.79 0.02 -1.26 -4.57 135.00 138.22 3k4w s PRO 151 Ca 0.19 1.74 0.01 0.00 0.02 0.00 0.00 61.00 62.96 3k4w s PRO 151 Cb -0.15 -2.95 0.00 0.00 0.02 0.00 0.00 34.50 31.42 3k4w s PRO 151 CO 0.09 0.05 -0.17 0.08 -0.33 0.00 0.00 177.00 176.72 3k4w s VAL 152 N -1.32 2.47 -0.11 3.83 1.01 0.27 -2.24 120.40 124.31 3k4w s VAL 152 Ca 0.50 -0.83 -0.12 0.00 0.00 0.00 0.00 61.98 61.52 3k4w s VAL 152 Cb -0.29 -2.04 -0.05 0.00 0.00 0.00 0.00 36.38 34.00 3k4w s VAL 152 CO 0.37 0.52 0.29 -0.63 0.00 0.00 0.00 175.10 175.65 3k4w s ILE 153 N 0.90 5.28 -0.02 2.22 1.01 0.42 -0.60 121.20 130.40 3k4w s ILE 153 Ca -0.04 0.55 0.02 0.00 0.00 0.00 0.00 60.65 61.18 3k4w s ILE 153 Cb -0.15 -3.60 0.00 0.00 0.01 0.00 0.00 42.46 38.72 3k4w s ILE 153 CO -0.02 0.49 -0.08 0.00 0.00 0.00 0.00 174.94 175.33 3k4w s MET 154 N -0.29 0.88 -0.61 2.79 0.23 -0.16 -0.94 119.30 121.20 3k4w s MET 154 Ca 0.18 -0.28 -0.28 0.00 -1.03 0.00 0.00 55.69 54.28 3k4w s MET 154 Cb -0.14 -0.83 0.03 0.00 -1.53 0.00 0.00 34.83 32.36 3k4w s MET 154 CO 0.06 0.10 1.22 1.41 -2.03 0.00 0.00 175.02 175.79 3k4w s MET 155 N 0.19 3.44 0.00 3.16 1.75 -0.70 -0.99 119.30 126.16 3k4w s MET 155 Ca -0.03 0.18 0.00 0.00 -1.25 0.00 0.00 55.69 54.59 3k4w s MET 155 Cb -0.08 -4.05 0.00 0.00 2.84 0.00 0.00 34.83 33.54 3k4w s MET 155 CO 0.00 -1.78 0.83 0.25 -0.65 0.00 0.00 175.02 173.67 3k4w n THR 156 N 6.64 0.67 -4.50 10.11 -2.24 -1.18 -4.82 114.28 118.96 3k4w n THR 156 Ca 0.08 -0.82 -0.23 0.00 -2.27 0.00 0.00 64.05 60.81 3k4w n THR 156 Cb 0.49 0.68 -0.11 0.00 -2.10 0.00 0.00 70.33 69.29 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 -0.67 2.18 0.00 3.38 0.00 -1.19 -4.19 107.32 106.83 3k4w s GLY 157 Ca 0.00 -2.12 0.00 0.00 0.00 0.00 0.00 44.72 42.60 3k4w s GLY 157 CO 0.00 -1.90 0.00 0.61 0.00 0.00 0.00 173.10 171.81 3k4w n GLY 158 N -0.76 0.75 2.55 0.20 0.00 0.18 -3.77 105.19 104.33 3k4w n GLY 158 Ca -0.03 -0.80 -0.41 0.00 0.00 0.00 0.00 46.02 44.78 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 0.37 6.65 0.18 1.61 3.02 -1.26 -4.63 115.26 121.20 3k4w n ASN 159 Ca 0.00 -2.83 0.05 0.00 -0.03 0.00 0.00 54.58 51.77 3k4w n ASN 159 Cb 0.00 -1.54 0.32 0.00 -0.61 0.00 0.00 39.78 37.95 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 5.34 0.99 -2.67 5.41 0.00 -1.88 -3.47 119.26 122.98 3k4w h ALA 160 Ca 0.69 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 55.24 3k4w h ALA 160 Cb 0.44 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.17 3k4w h ALA 160 CO 1.74 0.48 0.00 0.41 0.00 0.00 0.00 179.25 181.89 3k4w n GLY 161 N 0.26 3.29 0.26 0.00 0.00 -1.26 -3.38 105.19 104.36 3k4w n GLY 161 Ca -0.00 -1.15 0.18 0.00 0.00 0.00 0.00 46.02 45.04 3k4w n GLY 161 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3k4w h PRO 162 N 0.00 0.00 0.00 1.61 0.13 -1.91 -3.45 132.00 128.38 3k4w h PRO 162 Ca 0.00 0.00 -0.15 0.00 -0.87 0.00 0.00 66.00 64.98 3k4w h PRO 162 Cb 0.00 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.10 3k4w h PRO 162 CO 0.00 0.00 -0.01 -0.40 -0.23 0.00 0.00 178.00 177.36 3k4w n ASP 163 N -2.88 -1.29 0.01 1.44 5.68 -1.26 -5.05 116.55 113.19 3k4w n ASP 163 Ca -0.00 -2.39 0.13 0.00 -0.50 0.00 0.00 54.79 52.03 3k4w n ASP 163 Cb 0.21 2.29 0.56 0.00 -1.14 0.00 0.00 41.12 43.04 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 -0.44 0.19 0.31 2.12 3.06 -1.26 -2.06 119.36 121.28 3k4w n ILE 164 Ca -0.02 0.03 0.18 0.00 -2.50 0.00 0.00 62.75 60.44 3k4w n ILE 164 Cb 0.45 -0.59 1.01 0.00 0.54 0.00 0.00 39.64 41.06 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 0.33 0.00 9.51 1.35 -1.97 -1.81 112.91 120.33 3k4w h THR 165 Ca 0.00 -0.05 0.00 0.00 -0.55 0.00 0.00 66.41 65.81 3k4w h THR 165 Cb 0.47 1.04 0.00 0.00 -1.73 0.00 0.00 68.15 67.92 3k4w h THR 165 CO 0.00 0.01 0.00 -1.22 -0.25 0.00 0.00 175.52 174.06 3k4w n TYR 166 N -3.55 0.00 0.10 4.73 4.01 -0.88 -2.33 117.16 119.26 3k4w n TYR 166 Ca -0.03 0.00 0.03 0.00 -0.16 0.00 0.00 57.90 57.74 3k4w n TYR 166 Cb 0.09 -0.16 0.04 0.00 -0.31 0.00 0.00 39.34 39.00 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 -1.16 0.38 -1.68 -0.72 -2.24 -0.69 -4.68 114.28 103.49 3k4w n THR 167 Ca 0.16 -0.69 -0.43 0.00 -2.27 0.00 0.00 64.05 60.82 3k4w n THR 167 Cb 0.16 0.88 -0.03 0.00 -2.10 0.00 0.00 70.33 69.24 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 0.17 3.97 0.11 3.42 2.85 -0.98 -4.81 115.26 119.98 3k4w n ASN 168 Ca 0.04 0.98 0.09 0.00 -0.11 0.00 0.00 54.58 55.58 3k4w n ASN 168 Cb 0.21 -1.52 0.42 0.00 1.24 0.00 0.00 39.78 40.13 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 5.87 0.12 0.11 1.20 -0.04 -1.26 -2.14 135.00 138.86 3k4w n PRO 169 Ca 0.19 0.50 0.17 0.00 -0.04 0.00 0.00 63.50 64.31 3k4w n PRO 169 Cb 0.37 -1.80 0.71 0.00 -0.04 0.00 0.00 33.50 32.74 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 -0.01 0.54 4.11 -1.97 -2.29 114.58 114.97 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 0.14 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.39 3k4w h GLU 170 CO 0.00 0.00 -0.04 0.45 0.07 0.00 0.00 179.01 179.49 3k4w h HIS 171 N 0.00 0.06 0.00 2.06 3.86 -1.80 -2.44 115.15 116.89 3k4w h HIS 171 Ca 0.15 -0.03 -0.08 0.00 -1.16 0.00 0.00 60.37 59.25 3k4w h HIS 171 Cb 0.65 -0.01 -0.01 0.00 1.06 0.00 0.00 27.41 29.10 3k4w h HIS 171 CO 0.00 0.74 -0.39 0.97 0.86 0.00 0.00 177.93 180.11 3k4w h ILE 172 N -0.64 0.89 -0.25 2.45 2.10 -1.72 -3.04 117.51 117.30 3k4w h ILE 172 Ca -0.00 -1.58 -0.15 0.00 1.08 0.00 0.00 64.86 64.21 3k4w h ILE 172 Cb 0.75 1.96 -0.01 0.00 -1.09 0.00 0.00 36.82 38.43 3k4w h ILE 172 CO 0.01 0.38 -0.47 -0.78 -1.08 0.00 0.00 178.15 176.21 3k4w h ASP 173 N 0.00 0.72 -0.69 2.19 3.58 -1.34 -1.97 116.42 118.90 3k4w h ASP 173 Ca -0.00 -0.35 0.00 0.00 0.42 0.00 0.00 57.03 57.10 3k4w h ASP 173 Cb 0.93 -0.20 -0.03 0.00 1.72 0.00 0.00 39.33 41.74 3k4w h ASP 173 CO 0.05 1.07 0.45 0.03 -2.88 0.00 0.00 179.24 177.96 3k4w h ARG 174 N 0.53 0.92 0.22 0.28 3.08 -1.33 -1.56 114.38 116.51 3k4w h ARG 174 Ca 0.03 -0.06 0.00 0.00 0.07 0.00 0.00 59.98 60.02 3k4w h ARG 174 Cb 1.01 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 30.85 3k4w h ARG 174 CO 0.10 0.62 -0.21 0.28 -1.07 0.00 0.00 179.97 179.69 3k4w h VAL 175 N 0.94 0.55 -0.68 2.04 2.07 -1.40 -1.18 116.25 118.58 3k4w h VAL 175 Ca 0.25 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.76 3k4w h VAL 175 Cb -0.08 0.55 -0.03 0.00 -1.52 0.00 0.00 31.29 30.20 3k4w h VAL 175 CO -0.05 0.00 0.38 -0.07 0.02 0.00 0.00 177.57 177.85 3k4w h LEU 176 N -0.45 0.85 -1.17 2.57 3.38 -1.32 0.57 115.31 119.73 3k4w h LEU 176 Ca -0.00 -0.09 -0.04 0.00 0.09 0.00 0.00 57.88 57.83 3k4w h LEU 176 Cb 0.42 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 3k4w h LEU 176 CO -0.04 0.69 0.09 1.23 0.09 0.00 0.00 178.44 180.50 3k4w h GLY 177 N 0.94 0.71 1.40 0.83 0.00 -1.22 -3.03 103.07 102.70 3k4w h GLY 177 Ca 0.24 -0.40 0.00 0.00 0.00 0.00 0.00 47.33 47.17 3k4w h GLY 177 CO -0.04 0.37 -0.43 1.22 0.00 0.00 0.00 176.54 177.66 3k4w n ASP 178 N -4.30 0.69 -3.28 0.19 8.00 -0.45 -4.08 116.55 113.33 3k4w n ASP 178 Ca 0.03 0.23 -0.25 0.00 0.71 0.00 0.00 54.79 55.50 3k4w n ASP 178 Cb 0.22 -0.10 -0.08 0.00 -0.02 0.00 0.00 41.12 41.14 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 -2.09 0.72 0.30 1.24 3.72 0.06 -5.00 117.46 116.42 3k4w n PHE 179 Ca 0.04 -3.72 0.19 0.00 -0.05 0.00 0.00 57.45 53.91 3k4w n PHE 179 Cb 0.43 -0.38 0.85 0.00 -0.94 0.00 0.00 39.48 39.44 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 4.16 0.00 -0.72 -1.08 0.13 -1.68 -1.98 132.00 130.84 3k4w h PRO 180 Ca 0.12 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.25 3k4w h PRO 180 Cb 0.82 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.95 3k4w h PRO 180 CO 0.56 0.00 0.00 -0.25 -0.23 0.00 0.00 178.00 178.08 3k4w n ASP 181 N -3.01 4.24 -4.70 1.44 8.00 -1.26 -4.72 116.55 116.53 3k4w n ASP 181 Ca -0.01 -2.14 -0.38 0.00 0.71 0.00 0.00 54.79 52.97 3k4w n ASP 181 Cb 0.22 -0.52 -0.06 0.00 -0.02 0.00 0.00 41.12 40.73 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 -1.26 4.23 -0.27 0.64 2.96 -0.75 -4.92 118.68 119.32 3k4w s LEU 182 Ca 0.50 0.78 -0.29 0.00 -0.22 0.00 0.00 54.13 54.91 3k4w s LEU 182 Cb 0.28 -2.72 0.01 0.00 0.50 0.00 0.00 46.19 44.26 3k4w s LEU 182 CO 0.31 -0.07 1.05 -0.89 -1.32 0.00 0.00 176.35 175.42 3k4w s THR 183 N 1.01 4.61 -0.09 3.68 2.01 -1.26 -4.71 115.64 120.89 3k4w s THR 183 Ca 0.26 1.89 0.04 0.00 0.31 0.00 0.00 61.69 64.19 3k4w s THR 183 Cb -0.15 -4.35 0.00 0.00 0.01 0.00 0.00 72.50 68.01 3k4w s THR 183 CO 0.10 -0.30 -0.22 -0.69 -0.69 0.00 0.00 174.62 172.82 3k4w s VAL 184 N 3.38 1.93 -0.30 3.82 1.01 -0.85 -0.57 120.40 128.82 3k4w s VAL 184 Ca 0.44 -0.95 -0.09 0.00 0.00 0.00 0.00 61.98 61.39 3k4w s VAL 184 Cb -0.14 -1.68 -0.01 0.00 0.00 0.00 0.00 36.38 34.56 3k4w s VAL 184 CO 0.10 0.53 0.14 -0.69 0.00 0.00 0.00 175.10 175.18 3k4w s VAL 185 N 0.37 4.51 -0.56 2.92 1.01 0.23 -0.42 120.40 128.47 3k4w s VAL 185 Ca -0.18 -0.42 -0.28 0.00 0.00 0.00 0.00 61.98 61.09 3k4w s VAL 185 Cb -0.18 -3.28 0.03 0.00 0.00 0.00 0.00 36.38 32.95 3k4w s VAL 185 CO 0.08 0.10 1.19 -0.55 0.00 0.00 0.00 175.10 175.91 3k4w s SER 186 N 1.60 6.48 0.14 3.32 0.15 0.61 -0.99 113.70 125.02 3k4w s SER 186 Ca 0.05 0.19 -0.25 0.00 0.70 0.00 0.00 55.95 56.64 3k4w s SER 186 Cb -0.17 -2.55 -0.07 0.00 -1.71 0.00 0.00 66.02 61.51 3k4w s SER 186 CO 0.06 -1.44 0.77 -0.94 1.20 0.00 0.00 173.24 172.88 3k4w s SER 187 N 2.88 7.34 -0.31 5.45 1.04 -0.16 -1.46 113.70 128.47 3k4w s SER 187 Ca 0.44 1.59 0.00 0.00 0.48 0.00 0.00 55.95 58.46 3k4w s SER 187 Cb -0.07 -2.49 0.00 0.00 0.10 0.00 0.00 66.02 63.56 3k4w s SER 187 CO 0.27 0.17 0.00 1.41 0.98 0.00 0.00 173.24 176.07 3k4w n HIS 188 N 1.85 0.00 -3.20 5.02 8.25 -0.04 -3.10 115.22 123.99 3k4w n HIS 188 Ca -0.05 0.00 -0.16 0.00 -0.26 0.00 0.00 57.72 57.25 3k4w n HIS 188 Cb 0.49 -1.45 -0.03 0.00 1.12 0.00 0.00 29.99 30.13 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 -0.81 -0.47 2.50 -1.41 0.00 -0.84 -1.05 105.19 103.11 3k4w n GLY 189 Ca -0.03 0.03 -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 -1.88 -5.30 -4.77 1.61 5.15 -1.26 -4.89 115.26 103.92 3k4w n ASN 190 Ca 0.03 0.34 -0.39 0.00 -0.60 0.00 0.00 54.58 53.96 3k4w n ASN 190 Cb 0.49 -4.43 0.01 0.00 -0.53 0.00 0.00 39.78 35.32 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 -2.76 2.68 -1.58 1.20 -0.00 -0.21 -1.59 118.94 116.68 3k4w s TRP 191 Ca 0.00 1.38 0.30 0.00 -0.00 0.00 0.00 56.10 57.78 3k4w s TRP 191 Cb 0.00 -3.72 1.51 0.00 -0.00 0.00 0.00 33.47 31.26 3k4w s TRP 191 CO 0.00 -2.33 2.04 -0.35 -0.00 0.00 0.00 176.95 176.30 3k4w n PRO 192 N -0.13 0.59 -1.74 5.86 -0.04 -1.26 -0.65 135.00 137.63 3k4w n PRO 192 Ca 0.05 -0.06 -0.40 0.00 -0.04 0.00 0.00 63.50 63.05 3k4w n PRO 192 Cb 0.44 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.38 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 -1.15 2.65 0.03 0.54 7.02 -0.62 -4.68 117.44 121.23 3k4w n TRP 193 Ca 0.16 -2.94 -0.19 0.00 -1.02 0.00 0.00 57.50 53.51 3k4w n TRP 193 Cb 0.23 -2.18 -0.12 0.00 -2.42 0.00 0.00 31.31 26.83 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 3.02 1.40 -0.91 -0.99 2.07 -1.91 -0.32 116.25 118.61 3k4w h VAL 194 Ca 0.73 -2.21 0.18 0.00 0.82 0.00 0.00 66.70 66.21 3k4w h VAL 194 Cb 0.36 2.67 -0.10 0.00 -1.52 0.00 0.00 31.29 32.70 3k4w h VAL 194 CO 1.66 0.65 0.48 1.56 0.02 0.00 0.00 177.57 181.94 3k4w h GLN 195 N -0.03 0.59 0.07 1.57 4.20 -1.95 -2.45 115.11 117.10 3k4w h GLN 195 Ca -0.11 -0.04 -0.27 0.00 0.06 0.00 0.00 58.65 58.30 3k4w h GLN 195 Cb 1.48 -0.13 0.02 0.00 0.30 0.00 0.00 27.48 29.15 3k4w h GLN 195 CO 0.15 0.39 -1.09 0.93 -0.67 0.00 0.00 178.83 178.54 3k4w h GLU 196 N 0.61 0.62 0.00 1.46 3.07 -1.91 -3.22 114.58 115.21 3k4w h GLU 196 Ca 0.52 -0.76 -0.08 0.00 -0.50 0.00 0.00 59.36 58.54 3k4w h GLU 196 Cb 0.83 0.24 -0.01 0.00 -0.84 0.00 0.00 28.75 28.96 3k4w h GLU 196 CO -0.41 1.33 -0.39 0.97 -1.40 0.00 0.00 179.01 179.12 3k4w h ILE 197 N 0.25 1.17 -0.19 3.13 6.09 -0.71 -1.70 117.51 125.55 3k4w h ILE 197 Ca -0.15 -1.37 -0.02 0.00 -1.37 0.00 0.00 64.86 61.94 3k4w h ILE 197 Cb 1.76 1.76 -0.01 0.00 0.47 0.00 0.00 36.82 40.81 3k4w h ILE 197 CO 0.21 0.38 0.02 0.40 -3.07 0.00 0.00 178.15 176.09 3k4w h ILE 198 N 0.00 1.23 -0.62 2.19 1.08 -1.49 -1.42 117.51 118.48 3k4w h ILE 198 Ca -0.00 -0.76 0.13 0.00 -0.39 0.00 0.00 64.86 63.83 3k4w h ILE 198 Cb 0.73 1.37 -0.10 0.00 -3.07 0.00 0.00 36.82 35.75 3k4w h ILE 198 CO 0.05 0.23 0.05 -0.74 -0.69 0.00 0.00 178.15 177.05 3k4w h HIS 199 N 0.10 0.05 0.14 1.37 -0.00 -1.47 -0.29 115.15 115.05 3k4w h HIS 199 Ca 0.06 0.04 -0.01 0.00 -0.00 0.00 0.00 60.37 60.46 3k4w h HIS 199 Cb 0.33 0.07 0.00 0.00 -0.00 0.00 0.00 27.41 27.81 3k4w h HIS 199 CO 0.02 -0.12 -0.07 0.28 -0.00 0.00 0.00 177.93 178.04 3k4w h VAL 200 N 0.17 0.87 -0.91 5.26 2.07 -0.96 -0.64 116.25 122.10 3k4w h VAL 200 Ca 0.33 -0.01 0.12 0.00 0.82 0.00 0.00 66.70 67.96 3k4w h VAL 200 Cb 0.53 0.88 -0.08 0.00 -1.52 0.00 0.00 31.29 31.09 3k4w h VAL 200 CO -0.49 0.00 0.54 0.00 0.02 0.00 0.00 177.57 177.64 3k4w h ALA 201 N 0.68 1.36 -0.66 1.67 0.00 -1.23 0.61 119.26 121.69 3k4w h ALA 201 Ca -0.02 0.04 0.02 0.00 0.00 0.00 0.00 54.91 54.94 3k4w h ALA 201 Cb 0.14 -0.14 -0.04 0.00 0.00 0.00 0.00 17.79 17.75 3k4w h ALA 201 CO 0.03 0.12 0.42 0.35 0.00 0.00 0.00 179.25 180.17 3k4w h PHE 202 N 0.85 0.80 0.09 0.00 3.57 -0.55 -3.17 116.94 118.53 3k4w h PHE 202 Ca 0.46 0.02 -0.26 0.00 3.53 0.00 0.00 57.97 61.72 3k4w h PHE 202 Cb 0.48 -0.27 -0.01 0.00 2.79 0.00 0.00 35.95 38.95 3k4w h PHE 202 CO -0.04 0.48 -1.22 -0.09 -2.23 0.00 0.00 178.31 175.21 3k4w h ARG 203 N 0.85 0.20 -4.02 1.11 2.43 -0.49 -3.43 114.38 111.04 3k4w h ARG 203 Ca 0.25 -0.34 -0.69 0.00 -0.81 0.00 0.00 59.98 58.39 3k4w h ARG 203 Cb -0.05 0.13 -0.35 0.00 -0.42 0.00 0.00 29.97 29.27 3k4w h ARG 203 CO -0.07 1.14 -0.47 1.03 -1.51 0.00 0.00 179.97 180.09 3k4w s ARG 204 N -2.66 2.25 0.00 0.20 1.81 0.21 -4.97 118.95 115.79 3k4w s ARG 204 Ca -0.03 -2.19 0.17 0.00 -1.72 0.00 0.00 55.73 51.95 3k4w s ARG 204 Cb 0.08 -3.63 0.94 0.00 -0.45 0.00 0.00 34.95 31.89 3k4w s ARG 204 CO 0.86 -1.12 1.44 -0.35 -0.68 0.00 0.00 175.30 175.46 3k4w n PRO 205 N 4.00 0.41 -0.34 3.54 -0.04 -1.26 -2.32 135.00 138.99 3k4w n PRO 205 Ca 0.03 0.05 0.07 0.00 -0.04 0.00 0.00 63.50 63.61 3k4w n PRO 205 Cb 0.39 -1.50 0.22 0.00 -0.04 0.00 0.00 33.50 32.57 3k4w n PRO 205 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3k4w n ASN 206 N -1.11 3.55 -4.68 3.54 3.02 -1.26 -4.94 115.26 113.37 3k4w n ASN 206 Ca 0.11 -2.55 -0.40 0.00 -0.03 0.00 0.00 54.58 51.71 3k4w n ASN 206 Cb 0.09 -0.41 -0.05 0.00 -0.61 0.00 0.00 39.78 38.79 3k4w n ASN 206 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 3k4w s LEU 207 N -1.98 4.20 0.03 3.41 2.96 -0.98 -2.01 118.68 124.30 3k4w s LEU 207 Ca 0.35 1.03 0.02 0.00 -0.22 0.00 0.00 54.13 55.30 3k4w s LEU 207 Cb 0.25 -3.04 -0.04 0.00 0.50 0.00 0.00 46.19 43.86 3k4w s LEU 207 CO 0.13 -0.27 0.04 -0.31 -1.32 0.00 0.00 176.35 174.62 3k4w s TYR 208 N 1.70 3.14 -0.10 5.38 2.02 0.44 -4.87 117.35 125.07 3k4w s TYR 208 Ca 0.34 0.10 0.00 0.00 -0.37 0.00 0.00 57.07 57.14 3k4w s TYR 208 Cb -0.16 -1.66 -0.02 0.00 -0.40 0.00 0.00 41.96 39.71 3k4w s TYR 208 CO 0.13 0.50 -0.09 -0.51 -1.57 0.00 0.00 175.55 174.01 3k4w s LEU 209 N -1.90 2.99 -0.54 -1.29 1.43 0.20 -0.28 118.68 119.29 3k4w s LEU 209 Ca 0.24 -0.16 0.04 0.00 -1.03 0.00 0.00 54.13 53.22 3k4w s LEU 209 Cb -0.12 -1.66 0.17 0.00 0.03 0.00 0.00 46.19 44.61 3k4w s LEU 209 CO 0.15 0.27 0.40 -0.55 0.23 0.00 0.00 176.35 176.85 3k4w s SER 210 N -0.24 2.93 0.45 2.29 0.15 -0.54 -1.27 113.70 117.48 3k4w s SER 210 Ca 0.03 -3.39 0.25 0.00 0.70 0.00 0.00 55.95 53.54 3k4w s SER 210 Cb -0.13 -0.96 0.88 0.00 -1.71 0.00 0.00 66.02 64.11 3k4w s SER 210 CO 0.03 -0.14 1.81 1.55 1.20 0.00 0.00 173.24 177.69 3k4w h PRO 211 N 5.57 0.00 0.00 5.44 0.13 -1.81 0.02 132.00 141.35 3k4w h PRO 211 Ca 0.21 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.34 3k4w h PRO 211 Cb 0.84 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.97 3k4w h PRO 211 CO 0.52 0.18 0.00 -0.40 -0.23 0.00 0.00 178.00 178.07 3k4w n ASP 212 N -3.29 0.00 0.23 1.44 5.68 -1.26 -1.75 116.55 117.60 3k4w n ASP 212 Ca 0.01 0.00 0.06 0.00 -0.50 0.00 0.00 54.79 54.36 3k4w n ASP 212 Cb 0.44 0.00 0.52 0.00 -1.14 0.00 0.00 41.12 40.94 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 -1.73 -2.76 114.93 110.55 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 0.17 0.00 0.66 -0.00 0.00 0.00 176.91 177.74 3k4w n TYR 214 N -4.28 0.00 0.26 -0.10 4.01 -0.72 -2.25 117.16 114.08 3k4w n TYR 214 Ca -0.02 0.00 0.15 0.00 -0.16 0.00 0.00 57.90 57.87 3k4w n TYR 214 Cb 0.24 -0.10 0.62 0.00 -0.31 0.00 0.00 39.34 39.79 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 -8.65 7.72 5.85 -1.61 -3.42 115.31 115.21 3k4w h LEU 215 Ca 0.00 0.00 -0.63 0.00 0.84 0.00 0.00 57.88 58.09 3k4w h LEU 215 Cb 0.09 0.00 -0.13 0.00 0.37 0.00 0.00 40.66 40.99 3k4w h LEU 215 CO 0.00 0.05 0.29 -0.47 -0.34 0.00 0.00 178.44 177.98 3k4w s TYR 216 N -3.66 3.03 -1.45 1.25 5.04 -0.96 -4.35 117.35 116.25 3k4w s TYR 216 Ca 0.01 0.18 -0.10 0.00 -2.44 0.00 0.00 57.07 54.71 3k4w s TYR 216 Cb 0.09 -3.53 0.06 0.00 0.35 0.00 0.00 41.96 38.94 3k4w s TYR 216 CO 0.57 -0.91 0.74 -1.71 -1.34 0.00 0.00 175.55 172.90 3k4w n ASN 217 N 6.54 -4.76 -4.34 4.32 5.15 -1.26 -4.98 115.26 115.93 3k4w n ASN 217 Ca 0.01 -0.53 -0.17 0.00 -0.60 0.00 0.00 54.58 53.29 3k4w n ASN 217 Cb 0.48 -3.85 -0.10 0.00 -0.53 0.00 0.00 39.78 35.78 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 -6.89 1.94 0.57 1.20 1.43 -1.26 -5.10 118.68 110.57 3k4w s LEU 218 Ca 0.50 -1.31 -0.20 0.00 -1.03 0.00 0.00 54.13 52.09 3k4w s LEU 218 Cb -0.25 -0.14 -0.06 0.00 0.03 0.00 0.00 46.19 45.77 3k4w s LEU 218 CO 0.61 -0.63 1.03 -2.65 0.23 0.00 0.00 176.35 174.95 3k4w n PRO 219 N -0.47 1.09 0.00 1.29 -0.02 -1.26 -2.58 135.00 133.05 3k4w n PRO 219 Ca -0.03 0.41 0.00 0.00 -2.02 0.00 0.00 63.50 61.87 3k4w n PRO 219 Cb 0.65 -2.21 0.00 0.00 -0.02 0.00 0.00 33.50 31.92 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 1.19 3.17 0.25 -1.23 0.00 -1.26 -4.93 105.19 102.37 3k4w n GLY 220 Ca 0.12 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.12 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 -0.41 -0.24 1.61 6.17 -1.78 -0.45 115.15 120.04 3k4w h HIS 221 Ca 0.00 0.05 -0.09 0.00 0.71 0.00 0.00 60.37 61.05 3k4w h HIS 221 Cb 0.00 0.27 -0.01 0.00 2.52 0.00 0.00 27.41 30.18 3k4w h HIS 221 CO 0.00 -0.27 -0.22 0.00 0.71 0.00 0.00 177.93 178.14 3k4w h ALA 222 N 1.44 1.16 -0.45 5.26 0.00 -1.92 -2.26 119.26 122.49 3k4w h ALA 222 Ca 0.26 -0.32 -0.13 0.00 0.00 0.00 0.00 54.91 54.72 3k4w h ALA 222 Cb 0.44 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.10 3k4w h ALA 222 CO -0.59 0.53 -0.21 -0.44 0.00 0.00 0.00 179.25 178.55 3k4w h ASP 223 N 0.40 0.97 -0.54 0.00 3.32 -1.71 0.98 116.42 119.84 3k4w h ASP 223 Ca 0.06 -0.40 -0.03 0.00 0.02 0.00 0.00 57.03 56.68 3k4w h ASP 223 Cb 0.62 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.88 3k4w h ASP 223 CO 0.04 1.15 0.21 -0.26 -1.72 0.00 0.00 179.24 178.66 3k4w h PHE 224 N 0.78 0.84 -0.04 4.55 0.04 -0.81 0.05 116.94 122.35 3k4w h PHE 224 Ca 0.10 -0.07 -0.09 0.00 2.80 0.00 0.00 57.97 60.72 3k4w h PHE 224 Cb 0.78 -0.25 0.01 0.00 2.20 0.00 0.00 35.95 38.68 3k4w h PHE 224 CO 0.05 0.69 -0.32 0.82 -0.60 0.00 0.00 178.31 178.95 3k4w h ILE 225 N 0.74 1.46 -0.54 -0.55 1.08 -1.22 0.41 117.51 118.90 3k4w h ILE 225 Ca 0.18 -1.82 0.10 0.00 -0.39 0.00 0.00 64.86 62.93 3k4w h ILE 225 Cb 0.22 2.49 -0.11 0.00 -3.07 0.00 0.00 36.82 36.35 3k4w h ILE 225 CO -0.01 0.52 -0.34 -0.61 -0.69 0.00 0.00 178.15 177.01 3k4w h GLN 226 N -0.26 -0.18 -0.83 2.37 4.15 -0.75 -1.79 115.11 117.81 3k4w h GLN 226 Ca -0.03 0.01 0.04 0.00 0.77 0.00 0.00 58.65 59.45 3k4w h GLN 226 Cb 1.01 0.04 -0.05 0.00 0.21 0.00 0.00 27.48 28.69 3k4w h GLN 226 CO 0.07 -0.12 0.52 0.00 -1.93 0.00 0.00 178.83 177.37 3k4w h ALA 227 N 0.91 1.11 -0.24 3.38 0.00 -0.88 -2.68 119.26 120.87 3k4w h ALA 227 Ca 0.21 -0.02 0.06 0.00 0.00 0.00 0.00 54.91 55.16 3k4w h ALA 227 Cb 0.55 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 3k4w h ALA 227 CO -0.64 0.32 0.17 0.00 0.00 0.00 0.00 179.25 179.09 3k4w h ALA 228 N 1.37 2.16 -0.05 0.00 0.00 -0.52 -0.61 119.26 121.62 3k4w h ALA 228 Ca 0.34 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.25 3k4w h ALA 228 Cb 0.07 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.86 3k4w h ALA 228 CO -0.14 -0.22 0.00 0.09 0.00 0.00 0.00 179.25 178.98 3k4w n ASN 229 N -4.48 1.14 0.00 0.00 3.02 -0.71 -3.51 115.26 110.73 3k4w n ASN 229 Ca 0.02 -1.46 0.00 0.00 -0.03 0.00 0.00 54.58 53.12 3k4w n ASN 229 Cb 0.29 -0.03 0.00 0.00 -0.61 0.00 0.00 39.78 39.43 3k4w n ASN 229 CO 0.00 0.00 0.00 -1.54 -2.62 0.00 0.00 177.26 173.10 3k4w n SER 230 N -0.08 0.00 0.17 6.41 3.41 -0.87 -4.97 113.62 117.68 3k4w n SER 230 Ca 0.19 0.00 0.01 0.00 -0.26 0.00 0.00 58.87 58.81 3k4w n SER 230 Cb 0.28 0.00 0.31 0.00 -0.26 0.00 0.00 64.21 64.53 3k4w n SER 230 CO 0.00 0.00 0.00 2.19 -0.16 0.00 0.00 175.04 177.07 3k4w h PHE 231 N 0.00 0.02 -0.17 7.33 -5.15 -1.87 -2.89 116.94 114.21 3k4w h PHE 231 Ca 0.00 -0.01 0.00 0.00 -0.20 0.00 0.00 57.97 57.76 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 0.45 0.00 -0.11 -2.00 0.00 0.00 178.31 176.65 3k4w n LEU 232 N -4.03 1.12 0.18 2.10 7.94 -0.29 -3.94 117.00 120.08 3k4w n LEU 232 Ca -0.02 -0.53 0.12 0.00 -1.11 0.00 0.00 56.01 54.48 3k4w n LEU 232 Cb 0.46 -0.11 0.67 0.00 0.53 0.00 0.00 43.42 44.96 3k4w n LEU 232 CO 0.40 0.26 1.11 0.00 -1.11 0.00 0.00 177.39 178.05 3k4w h ALA 233 N 3.60 2.14 -0.02 1.96 0.00 -1.55 -1.08 119.26 124.31 3k4w h ALA 233 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3k4w h ALA 233 Cb 0.30 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.10 3k4w h ALA 233 CO 0.00 -0.21 -0.03 -0.25 0.00 0.00 0.00 179.25 178.76 3k4w n ASP 234 N -4.45 1.79 -0.43 0.00 8.00 -1.25 -4.30 116.55 115.91 3k4w n ASP 234 Ca 0.01 -1.56 0.04 0.00 0.71 0.00 0.00 54.79 53.99 3k4w n ASP 234 Cb 0.26 0.02 0.07 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 0.36 0.57 -5.11 -1.24 1.74 -0.44 -4.82 116.66 107.74 3k4w n ARG 235 Ca 0.17 -1.81 -0.32 0.00 -0.77 0.00 0.00 57.85 55.12 3k4w n ARG 235 Cb 0.41 -0.90 -0.15 0.00 -1.02 0.00 0.00 32.46 30.80 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 -1.27 2.33 -0.12 5.56 1.75 -1.03 -0.62 119.30 125.90 3k4w s MET 236 Ca 0.17 -0.82 0.01 0.00 -1.25 0.00 0.00 55.69 53.80 3k4w s MET 236 Cb 0.16 -2.21 0.02 0.00 2.84 0.00 0.00 34.83 35.64 3k4w s MET 236 CO -0.01 0.58 -0.13 -0.51 -0.65 0.00 0.00 175.02 174.30 3k4w s LEU 237 N -0.64 1.57 0.22 4.11 1.43 -0.40 -4.37 118.68 120.62 3k4w s LEU 237 Ca 0.10 -0.41 -0.32 0.00 -1.03 0.00 0.00 54.13 52.47 3k4w s LEU 237 Cb -0.11 -1.05 -0.13 0.00 0.03 0.00 0.00 46.19 44.93 3k4w s LEU 237 CO -0.00 -0.04 1.49 0.33 0.23 0.00 0.00 176.35 178.36 3k4w n PHE 238 N 4.58 2.31 -3.51 0.29 7.35 -0.34 -4.51 117.46 123.64 3k4w n PHE 238 Ca -0.17 0.35 -0.10 0.00 -0.76 0.00 0.00 57.45 56.77 3k4w n PHE 238 Cb 0.50 -2.51 -0.03 0.00 0.35 0.00 0.00 39.48 37.80 3k4w n PHE 238 CO 0.00 0.00 0.00 0.20 -0.76 0.00 0.00 176.76 176.20 3k4w s GLY 239 N 0.52 -0.46 -0.07 7.13 0.00 -1.26 -1.03 107.32 112.15 3k4w s GLY 239 Ca 0.71 1.13 0.20 0.00 0.00 0.00 0.00 44.72 46.76 3k4w s GLY 239 CO 0.46 0.47 0.40 -1.30 0.00 0.00 0.00 173.10 173.13 3k4w n THR 240 N -0.03 0.69 -1.42 0.90 -2.24 -1.26 -4.08 114.28 106.84 3k4w n THR 240 Ca -0.11 -0.66 -0.14 0.00 -2.27 0.00 0.00 64.05 60.87 3k4w n THR 240 Cb 0.61 -0.28 -0.06 0.00 -2.10 0.00 0.00 70.33 68.50 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 -2.45 -0.22 -1.44 6.98 0.00 -0.38 -3.95 120.51 119.05 3k4w n ALA 241 Ca -0.15 0.23 -0.54 0.00 0.00 0.00 0.00 53.44 52.98 3k4w n ALA 241 Cb 0.82 -1.80 -0.06 0.00 0.00 0.00 0.00 19.45 18.40 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 -2.35 0.30 0.35 0.00 9.36 -1.12 -0.34 117.16 123.35 3k4w n TYR 242 Ca -0.14 1.01 0.05 0.00 3.32 0.00 0.00 57.90 62.14 3k4w n TYR 242 Cb 0.59 -2.00 0.20 0.00 -0.63 0.00 0.00 39.34 37.50 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 1.32 2.53 -0.02 2.98 -0.04 -1.26 -0.87 135.00 139.64 3k4w n PRO 243 Ca 0.19 -1.58 -0.01 0.00 -0.04 0.00 0.00 63.50 62.06 3k4w n PRO 243 Cb 0.13 -1.62 0.27 0.00 -0.04 0.00 0.00 33.50 32.24 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 2.25 0.56 -6.55 0.54 2.86 -0.98 -3.43 114.93 110.18 3k4w h MET 244 Ca 0.00 -0.13 -0.63 0.00 -2.06 0.00 0.00 59.70 56.88 3k4w h MET 244 Cb 0.92 -0.08 -0.21 0.00 0.06 0.00 0.00 31.60 32.30 3k4w h MET 244 CO 0.13 0.60 -0.84 0.00 1.06 0.00 0.00 176.91 177.86 3k4w s PRO 246 N -2.17 4.76 0.09 0.00 0.04 -1.26 -4.01 135.00 132.44 3k4w s PRO 246 Ca 0.13 1.59 -0.21 0.00 0.04 0.00 0.00 61.00 62.55 3k4w s PRO 246 Cb -0.09 -3.21 -0.10 0.00 0.04 0.00 0.00 34.50 31.14 3k4w s PRO 246 CO 0.06 0.39 1.63 -0.07 0.04 0.00 0.00 177.00 179.06 3k4w h LEU 247 N 3.95 0.22 0.24 -3.56 3.38 -1.96 -1.55 115.31 116.03 3k4w h LEU 247 Ca -0.46 -0.15 -0.01 0.00 0.09 0.00 0.00 57.88 57.35 3k4w h LEU 247 Cb 1.20 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.90 3k4w h LEU 247 CO 0.67 0.31 -0.12 0.50 0.09 0.00 0.00 178.44 179.90 3k4w h LYS 248 N 0.11 -0.31 -0.29 1.13 3.64 -1.94 -2.55 116.57 116.36 3k4w h LYS 248 Ca 0.05 0.02 -0.18 0.00 -1.27 0.00 0.00 60.65 59.28 3k4w h LYS 248 Cb 0.16 0.07 -0.00 0.00 -0.41 0.00 0.00 32.23 32.04 3k4w h LYS 248 CO -0.01 -0.19 -0.53 0.93 -2.27 0.00 0.00 179.45 177.39 3k4w h GLU 249 N -0.34 0.85 0.07 1.90 3.07 -1.98 -1.93 114.58 116.21 3k4w h GLU 249 Ca -0.03 -0.52 -0.00 0.00 -0.50 0.00 0.00 59.36 58.30 3k4w h GLU 249 Cb 0.26 0.06 0.00 0.00 -0.84 0.00 0.00 28.75 28.23 3k4w h GLU 249 CO 0.05 1.16 -0.03 -0.92 -1.40 0.00 0.00 179.01 177.87 3k4w h TYR 250 N 0.66 -0.09 -0.29 4.33 3.20 -1.33 -2.39 116.97 121.06 3k4w h TYR 250 Ca 0.02 -0.00 -0.02 0.00 3.14 0.00 0.00 58.73 61.86 3k4w h TYR 250 Cb 1.12 0.03 -0.01 0.00 1.54 0.00 0.00 36.73 39.41 3k4w h TYR 250 CO 0.07 0.12 0.09 1.15 -1.64 0.00 0.00 178.16 177.95 3k4w h THR 251 N -0.28 1.20 -0.94 1.81 2.02 -1.43 -0.55 112.91 114.75 3k4w h THR 251 Ca -0.01 -0.65 0.07 0.00 0.77 0.00 0.00 66.41 66.59 3k4w h THR 251 Cb 0.24 1.08 -0.06 0.00 -1.74 0.00 0.00 68.15 67.67 3k4w h THR 251 CO 0.02 0.22 0.61 -0.08 0.37 0.00 0.00 175.52 176.65 3k4w h GLU 252 N 0.32 1.02 -0.37 6.66 4.81 -1.42 -0.79 114.58 124.81 3k4w h GLU 252 Ca 0.09 -0.06 -0.14 0.00 -0.13 0.00 0.00 59.36 59.12 3k4w h GLU 252 Cb 0.25 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 29.39 3k4w h GLU 252 CO -0.00 0.68 -0.32 2.35 -0.73 0.00 0.00 179.01 180.99 3k4w h TRP 253 N 1.05 1.03 -0.36 0.92 7.01 -0.93 -3.19 115.95 121.49 3k4w h TRP 253 Ca 0.41 -0.30 -0.09 0.00 2.11 0.00 0.00 58.89 61.02 3k4w h TRP 253 Cb 0.24 -0.22 -0.02 0.00 -2.10 0.00 0.00 29.16 27.06 3k4w h TRP 253 CO -0.00 1.09 -0.16 0.35 -2.79 0.00 0.00 178.44 176.93 3k4w h PHE 254 N 0.67 0.72 0.00 2.65 3.57 0.10 -0.24 116.94 124.41 3k4w h PHE 254 Ca 0.07 -0.14 0.00 0.00 3.53 0.00 0.00 57.97 61.43 3k4w h PHE 254 Cb 0.90 -0.18 0.00 0.00 2.79 0.00 0.00 35.95 39.46 3k4w h PHE 254 CO 0.06 0.77 0.00 1.28 -2.23 0.00 0.00 178.31 178.20 3k4w n LEU 255 N -4.15 0.00 -0.20 0.59 4.77 -0.42 -1.83 117.00 115.76 3k4w n LEU 255 Ca 0.01 0.26 0.11 0.00 -0.03 0.00 0.00 56.01 56.35 3k4w n LEU 255 Cb 0.38 -0.26 -0.02 0.00 -2.33 0.00 0.00 43.42 41.19 3k4w n LEU 255 CO 0.42 -0.14 0.16 0.35 -1.33 0.00 0.00 177.39 176.86 3k4w n THR 256 N -1.26 0.00 -2.12 -5.08 -2.24 -0.10 -5.00 114.28 98.48 3k4w n THR 256 Ca 0.07 -0.10 -0.37 0.00 -2.27 0.00 0.00 64.05 61.38 3k4w n THR 256 Cb 0.11 1.00 0.01 0.00 -2.10 0.00 0.00 70.33 69.35 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 -2.78 3.86 -1.36 3.22 1.43 -0.76 -4.91 118.68 117.37 3k4w s LEU 257 Ca 0.13 2.39 -0.13 0.00 -1.03 0.00 0.00 54.13 55.49 3k4w s LEU 257 Cb 0.17 -4.39 -0.04 0.00 0.03 0.00 0.00 46.19 41.97 3k4w s LEU 257 CO 0.73 -1.24 2.40 -0.81 0.23 0.00 0.00 176.35 177.65 3k4w n PRO 258 N -0.97 2.84 -4.36 1.29 -0.04 -1.26 -4.87 135.00 127.64 3k4w n PRO 258 Ca 0.10 -2.26 -0.34 0.00 -0.04 0.00 0.00 63.50 60.96 3k4w n PRO 258 Cb 0.48 -3.01 -0.11 0.00 -0.04 0.00 0.00 33.50 30.82 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 3.16 4.10 0.55 0.52 1.01 -1.26 -4.97 121.20 124.32 3k4w s ILE 259 Ca 0.55 -0.29 -0.20 0.00 0.00 0.00 0.00 60.65 60.70 3k4w s ILE 259 Cb 0.15 -2.78 -0.05 0.00 0.01 0.00 0.00 42.46 39.79 3k4w s ILE 259 CO -0.05 0.52 1.17 -1.59 0.00 0.00 0.00 174.94 174.99 3k4w s LYS 260 N -0.01 3.27 0.26 2.79 -2.85 -1.26 -4.64 119.74 117.30 3k4w s LYS 260 Ca 0.02 1.72 -0.01 0.00 -1.00 0.00 0.00 55.97 56.70 3k4w s LYS 260 Cb -0.13 -2.03 0.57 0.00 -2.06 0.00 0.00 37.83 34.18 3k4w s LYS 260 CO 0.02 -0.94 1.71 -1.35 0.10 0.00 0.00 175.35 174.89 3k4w h PRO 261 N 1.20 0.40 0.00 1.78 0.11 -1.99 0.40 132.00 133.89 3k4w h PRO 261 Ca -0.50 -0.02 -0.16 0.00 0.11 0.00 0.00 66.00 65.43 3k4w h PRO 261 Cb 1.27 -0.09 -0.02 0.00 0.11 0.00 0.00 31.00 32.27 3k4w h PRO 261 CO 0.57 0.26 -0.76 -0.44 -0.21 0.00 0.00 178.00 177.42 3k4w h ASP 262 N 0.41 0.00 0.43 -2.05 3.32 -2.01 -2.71 116.42 113.81 3k4w h ASP 262 Ca 0.48 0.00 -0.16 0.00 0.02 0.00 0.00 57.03 57.37 3k4w h ASP 262 Cb 0.81 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.35 3k4w h ASP 262 CO -0.47 0.76 -0.68 0.00 -1.72 0.00 0.00 179.24 177.12 3k4w h ALA 263 N 1.24 0.76 -0.46 3.45 0.00 -1.70 -2.88 119.26 119.68 3k4w h ALA 263 Ca -0.01 -0.59 -0.04 0.00 0.00 0.00 0.00 54.91 54.27 3k4w h ALA 263 Cb 1.45 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 19.14 3k4w h ALA 263 CO 0.10 0.78 0.12 1.98 0.00 0.00 0.00 179.25 182.23 3k4w h MET 264 N 0.15 0.72 -0.91 0.00 -1.53 -0.75 -1.52 114.93 111.10 3k4w h MET 264 Ca -0.02 -0.17 0.01 0.00 -3.44 0.00 0.00 59.70 56.08 3k4w h MET 264 Cb 1.22 -0.10 -0.05 0.00 -0.55 0.00 0.00 31.60 32.12 3k4w h MET 264 CO 0.10 0.71 0.60 0.93 0.14 0.00 0.00 176.91 179.39 3k4w h GLU 265 N 0.61 1.21 -0.12 0.39 5.08 -1.48 0.10 114.58 120.37 3k4w h GLU 265 Ca 0.14 -0.08 -0.01 0.00 -1.00 0.00 0.00 59.36 58.42 3k4w h GLU 265 Cb 0.30 -0.27 -0.01 0.00 0.50 0.00 0.00 28.75 29.28 3k4w h GLU 265 CO -0.00 0.81 0.05 0.87 -1.00 0.00 0.00 179.01 179.74 3k4w h LYS 266 N 1.24 0.18 -0.04 2.33 1.57 -1.27 -1.96 116.57 118.62 3k4w h LYS 266 Ca 0.33 -0.03 -0.23 0.00 -1.87 0.00 0.00 60.65 58.85 3k4w h LYS 266 Cb -0.13 -0.03 0.01 0.00 0.08 0.00 0.00 32.23 32.16 3k4w h LYS 266 CO -0.07 0.26 -0.90 0.82 -0.57 0.00 0.00 179.45 178.99 3k4w h ILE 267 N 0.05 1.34 -0.56 1.86 2.04 -1.07 0.18 117.51 121.36 3k4w h ILE 267 Ca 0.04 -2.25 -0.09 0.00 1.00 0.00 0.00 64.86 63.56 3k4w h ILE 267 Cb 0.15 2.27 -0.02 0.00 -0.74 0.00 0.00 36.82 38.48 3k4w h ILE 267 CO -0.00 0.69 -0.00 -0.07 0.00 0.00 0.00 178.15 178.76 3k4w h LEU 268 N 0.34 0.94 0.00 1.44 3.38 -0.80 -0.89 115.31 119.73 3k4w h LEU 268 Ca -0.08 -0.26 0.00 0.00 0.09 0.00 0.00 57.88 57.63 3k4w h LEU 268 Cb 1.53 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 42.03 3k4w h LEU 268 CO 0.17 1.00 0.00 0.00 0.09 0.00 0.00 178.44 179.70 3k4w n HIS 269 N -4.19 0.00 0.01 1.13 1.44 -0.80 -1.29 115.22 111.51 3k4w n HIS 269 Ca 0.03 0.00 -0.10 0.00 -2.01 0.00 0.00 57.72 55.64 3k4w n HIS 269 Cb 0.33 0.00 -0.03 0.00 0.12 0.00 0.00 29.99 30.41 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 -0.16 1.24 -1.39 0.00 -0.63 -1.39 103.07 100.74 3k4w h GLY 270 Ca 0.00 0.23 -0.04 0.00 0.00 0.00 0.00 47.33 47.52 3k4w h GLY 270 CO 0.00 -0.17 0.22 3.43 0.00 0.00 0.00 176.54 180.02 3k4w h ASN 271 N -0.25 0.89 -0.38 0.19 2.35 -0.96 -0.23 115.58 117.19 3k4w h ASN 271 Ca 0.09 -0.14 -0.14 0.00 -0.55 0.00 0.00 56.30 55.57 3k4w h ASN 271 Cb 0.38 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.52 3k4w h ASN 271 CO -0.26 0.82 -0.30 0.00 -1.65 0.00 0.00 177.43 176.04 3k4w h ALA 272 N 1.31 0.55 0.00 -0.83 0.00 -1.74 -2.31 119.26 116.24 3k4w h ALA 272 Ca 0.21 -0.42 -0.04 0.00 0.00 0.00 0.00 54.91 54.67 3k4w h ALA 272 Cb 0.23 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 3k4w h ALA 272 CO -0.01 0.59 -0.18 0.93 0.00 0.00 0.00 179.25 180.58 3k4w h GLU 273 N 0.68 0.00 -0.09 0.00 5.08 -0.80 -0.28 114.58 119.18 3k4w h GLU 273 Ca 0.07 0.00 -0.19 0.00 -1.00 0.00 0.00 59.36 58.24 3k4w h GLU 273 Cb 0.88 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.14 3k4w h GLU 273 CO 0.08 0.18 -0.67 -0.09 -1.00 0.00 0.00 179.01 177.51 3k4w h ARG 274 N 0.00 0.61 -0.05 2.33 2.43 -0.70 -2.31 114.38 116.70 3k4w h ARG 274 Ca -0.00 -0.54 -0.01 0.00 -0.81 0.00 0.00 59.98 58.62 3k4w h ARG 274 Cb 0.40 0.12 -0.00 0.00 -0.42 0.00 0.00 29.97 30.07 3k4w h ARG 274 CO 0.02 1.16 0.01 1.25 -1.51 0.00 0.00 179.97 180.90 3k4w h LEU 275 N 0.25 0.08 -0.80 3.80 6.46 -1.15 -1.61 115.31 122.34 3k4w h LEU 275 Ca -0.06 -0.27 0.14 0.00 -0.12 0.00 0.00 57.88 57.58 3k4w h LEU 275 Cb 1.32 -0.02 -0.09 0.00 -0.73 0.00 0.00 40.66 41.13 3k4w h LEU 275 CO 0.14 0.33 0.37 -0.07 -0.62 0.00 0.00 178.44 178.59 3k4w h LEU 276 N -0.17 0.41 -0.88 2.25 3.38 -1.14 0.78 115.31 119.94 3k4w h LEU 276 Ca 0.02 0.10 -0.10 0.00 0.09 0.00 0.00 57.88 57.99 3k4w h LEU 276 Cb 0.29 0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.07 3k4w h LEU 276 CO 0.00 0.16 -0.23 0.00 0.09 0.00 0.00 178.44 178.46 3k4w h ALA 277 N 1.55 1.05 -0.36 1.53 0.00 -1.24 -0.87 119.26 120.93 3k4w h ALA 277 Ca 0.44 -0.34 -0.12 0.00 0.00 0.00 0.00 54.91 54.88 3k4w h ALA 277 Cb 0.65 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.29 3k4w h ALA 277 CO -0.38 0.57 -0.28 0.37 0.00 0.00 0.00 179.25 179.53 3k4w h GLN 278 N 0.50 0.75 -0.65 0.00 4.15 -0.88 -2.91 115.11 116.07 3k4w h GLN 278 Ca 0.07 -0.33 -0.00 0.00 0.77 0.00 0.00 58.65 59.17 3k4w h GLN 278 Cb 0.67 -0.02 -0.03 0.00 0.21 0.00 0.00 27.48 28.31 3k4w h GLN 278 CO 0.05 0.94 0.40 0.00 -1.93 0.00 0.00 178.83 178.29 3k4w h ALA 279 N 1.04 0.82 0.00 3.38 0.00 -0.57 -1.93 119.26 122.01 3k4w h ALA 279 Ca 0.08 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3k4w h ALA 279 Cb 0.80 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.33 3k4w h ALA 279 CO 0.07 0.29 0.19 0.41 0.00 0.00 0.00 179.25 180.21 3k4w n GLY 280 N -1.18 -0.29 3.59 0.00 0.00 -0.36 -4.86 105.19 102.09 3k4w n GLY 280 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 3k4w n GLY 280 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86