#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3k4w s LYS 2 N 0.00 3.51 -0.05 3.23 2.20 -1.26 -4.83 119.74 122.54 3k4w s LYS 2 Ca 0.00 -0.57 0.03 0.00 -0.36 0.00 0.00 55.97 55.07 3k4w s LYS 2 Cb 0.00 -3.00 -0.03 0.00 -1.51 0.00 0.00 37.83 33.30 3k4w s LYS 2 CO 0.00 -0.02 -0.14 0.42 -0.36 0.00 0.00 175.35 175.25 3k4w s ILE 3 N 1.06 3.10 -0.29 5.43 1.01 -0.63 -4.31 121.20 126.57 3k4w s ILE 3 Ca 0.01 -0.71 -0.09 0.00 0.00 0.00 0.00 60.65 59.86 3k4w s ILE 3 Cb -0.15 -2.22 -0.02 0.00 0.01 0.00 0.00 42.46 40.09 3k4w s ILE 3 CO 0.01 0.59 0.14 -0.63 0.00 0.00 0.00 174.94 175.05 3k4w s ILE 4 N -0.74 4.67 -0.33 2.92 1.01 -0.60 -0.88 121.20 127.26 3k4w s ILE 4 Ca 0.12 -0.27 -0.21 0.00 0.00 0.00 0.00 60.65 60.28 3k4w s ILE 4 Cb -0.11 -3.32 -0.00 0.00 0.01 0.00 0.00 42.46 39.04 3k4w s ILE 4 CO 0.01 0.15 0.66 -0.62 0.00 0.00 0.00 174.94 175.14 3k4w s ASP 5 N 1.64 6.50 0.00 3.58 -1.08 -0.51 -4.63 116.67 122.17 3k4w s ASP 5 Ca 0.05 0.36 0.25 0.00 -0.52 0.00 0.00 52.55 52.70 3k4w s ASP 5 Cb -0.16 -2.34 1.23 0.00 -1.46 0.00 0.00 42.92 40.18 3k4w s ASP 5 CO 0.07 -0.55 1.83 0.33 0.52 0.00 0.00 175.17 177.36 3k4w n PHE 6 N 6.02 0.00 -3.46 -5.34 7.35 -0.20 -1.54 117.46 120.29 3k4w n PHE 6 Ca -0.00 0.00 -0.24 0.00 -0.76 0.00 0.00 57.45 56.45 3k4w n PHE 6 Cb 0.49 -0.31 -0.12 0.00 0.35 0.00 0.00 39.48 39.88 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 -2.63 0.33 -0.06 -4.13 3.52 -1.26 -4.57 118.95 110.16 3k4w s ARG 7 Ca 0.22 -0.55 0.00 0.00 -0.13 0.00 0.00 55.73 55.27 3k4w s ARG 7 Cb 0.17 -0.96 0.02 0.00 -1.56 0.00 0.00 34.95 32.62 3k4w s ARG 7 CO 0.39 -1.07 -0.04 -1.17 -0.81 0.00 0.00 175.30 172.60 3k4w s LEU 8 N 1.97 1.11 -0.34 -0.88 0.20 -0.46 -1.30 118.68 118.99 3k4w s LEU 8 Ca 0.11 -0.15 0.02 0.00 0.69 0.00 0.00 54.13 54.81 3k4w s LEU 8 Cb -0.16 -0.52 0.09 0.00 -0.43 0.00 0.00 46.19 45.17 3k4w s LEU 8 CO -0.27 -0.10 0.05 -0.13 -0.29 0.00 0.00 176.35 175.61 3k4w s ARG 9 N 1.31 1.76 0.51 1.98 3.00 -0.51 -3.66 118.95 123.34 3k4w s ARG 9 Ca -0.05 -1.74 -0.19 0.00 0.00 0.00 0.00 55.73 53.76 3k4w s ARG 9 Cb -0.14 -3.22 -0.07 0.00 0.00 0.00 0.00 34.95 31.52 3k4w s ARG 9 CO -0.02 -0.88 1.03 -1.25 0.00 0.00 0.00 175.30 174.18 3k4w s PRO 10 N 1.00 3.72 -1.44 3.54 0.04 -1.26 -4.14 135.00 136.46 3k4w s PRO 10 Ca 0.06 1.27 -0.12 0.00 0.04 0.00 0.00 61.00 62.25 3k4w s PRO 10 Cb -0.20 -2.09 -0.04 0.00 0.04 0.00 0.00 34.50 32.22 3k4w s PRO 10 CO -0.06 -0.49 2.50 -0.35 0.04 0.00 0.00 177.00 178.64 3k4w n PRO 11 N -1.26 3.04 -4.15 0.56 -0.04 -1.26 -4.70 135.00 127.18 3k4w n PRO 11 Ca 0.09 -2.29 -0.19 0.00 -0.04 0.00 0.00 63.50 61.07 3k4w n PRO 11 Cb 0.53 -2.99 -0.16 0.00 -0.04 0.00 0.00 33.50 30.83 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 2.93 0.61 0.00 0.55 0.00 -1.26 -4.03 121.76 120.55 3k4w s ALA 12 Ca 0.57 -0.05 0.00 0.00 0.00 0.00 0.00 51.96 52.48 3k4w s ALA 12 Cb 0.15 -0.37 0.00 0.00 0.00 0.00 0.00 23.12 22.91 3k4w s ALA 12 CO -0.06 0.01 0.00 -1.33 0.00 0.00 0.00 175.76 174.38 3k4w n MET 13 N 3.90 0.00 0.26 0.00 2.81 -1.26 -1.20 117.12 121.64 3k4w n MET 13 Ca -0.24 0.00 0.15 0.00 -1.81 0.00 0.00 57.70 55.79 3k4w n MET 13 Cb 0.52 0.00 0.86 0.00 -0.71 0.00 0.00 33.22 33.88 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 -1.96 -2.03 103.07 104.11 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 -1.43 -2.76 116.94 118.39 3k4w h PHE 15 Ca 0.03 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.80 3k4w h PHE 15 Cb 0.14 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.29 3k4w h PHE 15 CO 0.00 0.00 0.00 1.28 -0.60 0.00 0.00 178.31 178.99 3k4w n LEU 16 N -3.07 0.00 -0.26 1.54 4.77 -0.76 -1.73 117.00 117.48 3k4w n LEU 16 Ca -0.01 0.46 0.12 0.00 -0.03 0.00 0.00 56.01 56.55 3k4w n LEU 16 Cb 0.20 -0.46 0.27 0.00 -2.33 0.00 0.00 43.42 41.10 3k4w n LEU 16 CO 0.24 -0.24 0.54 0.59 -1.33 0.00 0.00 177.39 177.19 3k4w n ASN 17 N -1.46 1.17 -4.82 -1.43 3.02 -1.04 -4.35 115.26 106.35 3k4w n ASN 17 Ca 0.04 -0.96 -0.33 0.00 -0.03 0.00 0.00 54.58 53.30 3k4w n ASN 17 Cb 0.15 0.25 -0.07 0.00 -0.61 0.00 0.00 39.78 39.50 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 -2.56 3.10 0.27 5.41 0.00 -0.71 -3.75 121.76 123.52 3k4w s ALA 18 Ca 0.21 0.34 -0.00 0.00 0.00 0.00 0.00 51.96 52.51 3k4w s ALA 18 Cb 0.19 -3.08 0.58 0.00 0.00 0.00 0.00 23.12 20.80 3k4w s ALA 18 CO 0.56 0.17 1.73 -0.09 0.00 0.00 0.00 175.76 178.13 3k4w h ARG 19 N 2.07 0.50 -1.32 0.00 2.43 -1.90 0.12 114.38 116.28 3k4w h ARG 19 Ca -0.49 -0.03 0.38 0.00 -0.81 0.00 0.00 59.98 59.04 3k4w h ARG 19 Cb 1.18 -0.11 -0.06 0.00 -0.42 0.00 0.00 29.97 30.56 3k4w h ARG 19 CO 0.62 0.33 0.94 -0.84 -1.51 0.00 0.00 179.97 179.51 3k4w h ILE 20 N 0.51 0.34 0.00 1.20 3.07 -1.93 -1.42 117.51 119.27 3k4w h ILE 20 Ca 0.48 -0.01 -0.28 0.00 1.55 0.00 0.00 64.86 66.61 3k4w h ILE 20 Cb 0.78 0.31 -0.05 0.00 -0.27 0.00 0.00 36.82 37.59 3k4w h ILE 20 CO -0.43 0.00 -2.05 -1.22 -1.05 0.00 0.00 178.15 173.41 3k4w n TYR 21 N -4.18 0.00 0.17 0.16 4.01 0.11 -4.45 117.16 112.98 3k4w n TYR 21 Ca 0.29 0.00 0.04 0.00 -0.16 0.00 0.00 57.90 58.07 3k4w n TYR 21 Cb 1.36 -0.75 0.28 0.00 -0.31 0.00 0.00 39.34 39.92 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 1.03 -2.32 -0.72 1.35 -0.77 -3.32 112.91 108.15 3k4w h THR 22 Ca -0.42 -1.71 -0.64 0.00 -0.55 0.00 0.00 66.41 63.09 3k4w h THR 22 Cb 1.92 2.01 -0.39 0.00 -1.73 0.00 0.00 68.15 69.95 3k4w h THR 22 CO 0.01 0.44 -0.30 0.54 -0.25 0.00 0.00 175.52 175.96 3k4w n ARG 23 N -3.59 3.17 0.26 4.72 5.12 -0.55 -4.90 116.66 120.89 3k4w n ARG 23 Ca -0.00 -4.70 0.16 0.00 -1.93 0.00 0.00 57.85 51.37 3k4w n ARG 23 Cb 0.55 -2.31 0.88 0.00 -1.16 0.00 0.00 32.46 30.42 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 4.10 0.00 -0.40 5.56 0.13 -1.78 -2.83 132.00 136.78 3k4w h PRO 24 Ca 0.20 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.33 3k4w h PRO 24 Cb 0.60 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.71 3k4w h PRO 24 CO 0.93 0.00 0.24 0.38 -0.23 0.00 0.00 178.00 179.32 3k4w h ASP 25 N 0.00 0.49 0.24 1.44 2.03 -1.94 0.65 116.42 119.33 3k4w h ASP 25 Ca 0.04 -0.06 -0.01 0.00 -0.73 0.00 0.00 57.03 56.27 3k4w h ASP 25 Cb 0.23 -0.12 0.00 0.00 -0.83 0.00 0.00 39.33 38.61 3k4w h ASP 25 CO -0.00 0.40 -0.12 0.40 -1.03 0.00 0.00 179.24 178.90 3k4w h ILE 26 N 0.53 0.77 -0.47 4.15 2.04 -1.90 -2.64 117.51 120.00 3k4w h ILE 26 Ca 0.14 -0.06 -0.02 0.00 1.00 0.00 0.00 64.86 65.93 3k4w h ILE 26 Cb 0.01 0.81 -0.02 0.00 -0.74 0.00 0.00 36.82 36.87 3k4w h ILE 26 CO -0.03 0.01 0.22 -0.09 0.00 0.00 0.00 178.15 178.27 3k4w h ARG 27 N -0.36 0.69 0.00 2.37 2.43 -1.36 -1.14 114.38 117.00 3k4w h ARG 27 Ca -0.03 -0.10 -0.02 0.00 -0.81 0.00 0.00 59.98 59.01 3k4w h ARG 27 Cb 0.27 -0.12 -0.00 0.00 -0.42 0.00 0.00 29.97 29.70 3k4w h ARG 27 CO 0.05 0.58 -0.11 -0.91 -1.51 0.00 0.00 179.97 178.08 3k4w h ASN 28 N 0.62 0.00 -0.57 -3.80 2.35 -0.92 -1.37 115.58 111.89 3k4w h ASN 28 Ca 0.16 0.00 -0.08 0.00 -0.55 0.00 0.00 56.30 55.84 3k4w h ASN 28 Cb 0.13 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.48 3k4w h ASN 28 CO -0.02 0.11 0.05 0.03 -1.65 0.00 0.00 177.43 175.96 3k4w h ARG 29 N 0.00 0.97 0.01 0.81 3.08 -0.83 -1.25 114.38 117.17 3k4w h ARG 29 Ca -0.00 -0.28 -0.00 0.00 0.07 0.00 0.00 59.98 59.77 3k4w h ARG 29 Cb 0.23 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.18 3k4w h ARG 29 CO 0.01 0.94 -0.00 0.35 -1.07 0.00 0.00 179.97 180.20 3k4w h PHE 30 N 0.86 -0.01 -0.43 3.04 3.57 -0.96 -1.49 116.94 121.51 3k4w h PHE 30 Ca 0.17 -0.00 0.08 0.00 3.53 0.00 0.00 57.97 61.75 3k4w h PHE 30 Cb 0.47 0.00 -0.08 0.00 2.79 0.00 0.00 35.95 39.14 3k4w h PHE 30 CO 0.03 0.41 -0.04 1.15 -2.23 0.00 0.00 178.31 177.64 3k4w h THR 31 N -0.44 0.63 -0.25 4.41 2.02 -1.29 -1.40 112.91 116.59 3k4w h THR 31 Ca -0.00 -0.02 -0.13 0.00 0.77 0.00 0.00 66.41 67.02 3k4w h THR 31 Cb 0.43 0.55 -0.01 0.00 -1.74 0.00 0.00 68.15 67.38 3k4w h THR 31 CO 0.00 0.01 -0.41 0.03 0.37 0.00 0.00 175.52 175.53 3k4w h ARG 32 N 0.07 0.58 -0.87 6.66 3.08 -1.16 -1.79 114.38 120.95 3k4w h ARG 32 Ca 0.21 -0.30 0.00 0.00 0.07 0.00 0.00 59.98 59.97 3k4w h ARG 32 Cb 0.32 0.01 -0.04 0.00 0.08 0.00 0.00 29.97 30.33 3k4w h ARG 32 CO -0.39 0.89 0.55 0.37 -1.07 0.00 0.00 179.97 180.31 3k4w h GLN 33 N 0.48 1.16 0.00 0.04 4.15 -0.92 -1.28 115.11 118.74 3k4w h GLN 33 Ca 0.04 -0.09 -0.09 0.00 0.77 0.00 0.00 58.65 59.29 3k4w h GLN 33 Cb 0.91 -0.25 -0.01 0.00 0.21 0.00 0.00 27.48 28.34 3k4w h GLN 33 CO 0.08 0.79 -0.41 1.25 -1.93 0.00 0.00 178.83 178.61 3k4w h LEU 34 N 1.19 0.00 0.00 -2.39 5.85 -1.02 -3.47 115.31 115.46 3k4w h LEU 34 Ca 0.31 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.03 3k4w h LEU 34 Cb -0.09 0.00 0.00 0.00 0.37 0.00 0.00 40.66 40.94 3k4w h LEU 34 CO -0.06 0.41 0.00 0.61 -0.34 0.00 0.00 178.44 179.05 3k4w n GLY 35 N -0.30 1.73 3.66 3.75 0.00 -0.48 -4.95 105.19 108.60 3k4w n GLY 35 Ca -0.02 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.75 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 2.79 0.16 1.61 0.08 -0.77 -5.02 117.98 114.84 3k4w s PHE 36 Ca 0.00 -0.17 -0.15 0.00 0.12 0.00 0.00 56.93 56.73 3k4w s PHE 36 Cb 0.00 -1.30 -0.07 0.00 -0.57 0.00 0.00 43.02 41.07 3k4w s PHE 36 CO 0.00 0.55 0.58 -1.21 -0.10 0.00 0.00 175.22 175.05 3k4w s GLU 37 N -3.26 4.02 0.48 0.44 0.41 -1.26 -3.43 118.70 116.10 3k4w s GLU 37 Ca 0.29 0.55 -0.22 0.00 -0.41 0.00 0.00 54.97 55.18 3k4w s GLU 37 Cb -0.08 -2.91 -0.09 0.00 -1.78 0.00 0.00 34.13 29.28 3k4w s GLU 37 CO 0.19 0.45 1.00 -2.30 -0.49 0.00 0.00 175.26 174.11 3k4w n PRO 38 N 0.74 1.23 -2.01 0.39 -0.02 -1.26 -4.50 135.00 129.56 3k4w n PRO 38 Ca -0.04 0.45 -0.42 0.00 -2.02 0.00 0.00 63.50 61.47 3k4w n PRO 38 Cb 0.52 -2.10 -0.03 0.00 -0.02 0.00 0.00 33.50 31.87 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 -1.37 3.68 0.23 3.55 0.00 -1.26 -4.95 121.76 121.64 3k4w s ALA 39 Ca 0.67 1.31 -0.07 0.00 0.00 0.00 0.00 51.96 53.86 3k4w s ALA 39 Cb -0.50 -3.58 0.38 0.00 0.00 0.00 0.00 23.12 19.42 3k4w s ALA 39 CO 0.54 -0.73 1.69 -1.35 0.00 0.00 0.00 175.76 175.91 3k4w h PRO 40 N 6.04 0.25 -0.48 0.00 0.11 -1.99 -2.10 132.00 133.83 3k4w h PRO 40 Ca -0.44 -0.02 0.04 0.00 0.11 0.00 0.00 66.00 65.70 3k4w h PRO 40 Cb 1.21 -0.06 -0.03 0.00 0.11 0.00 0.00 31.00 32.24 3k4w h PRO 40 CO 0.85 0.17 0.32 0.66 -0.21 0.00 0.00 178.00 179.78 3k4w h SER 41 N 0.26 0.43 -0.01 -2.05 4.64 -1.89 0.26 113.55 115.18 3k4w h SER 41 Ca 0.37 -0.00 -0.14 0.00 -0.47 0.00 0.00 61.79 61.54 3k4w h SER 41 Cb 0.59 -0.10 0.01 0.00 -0.31 0.00 0.00 62.40 62.60 3k4w h SER 41 CO -0.47 0.29 -0.55 0.00 -0.87 0.00 0.00 176.83 175.23 3k4w h ALA 42 N 1.73 0.09 -0.71 5.18 0.00 -1.74 0.43 119.26 124.23 3k4w h ALA 42 Ca 0.20 -0.55 0.02 0.00 0.00 0.00 0.00 54.91 54.58 3k4w h ALA 42 Cb 0.17 0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.95 3k4w h ALA 42 CO -0.05 0.33 0.47 0.93 0.00 0.00 0.00 179.25 180.93 3k4w h GLU 43 N -0.11 0.89 -0.01 0.00 5.08 -0.64 -2.10 114.58 117.68 3k4w h GLU 43 Ca -0.06 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.24 3k4w h GLU 43 Cb 1.26 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 30.31 3k4w h GLU 43 CO 0.11 0.59 -0.42 0.39 -1.00 0.00 0.00 179.01 178.67 3k4w n GLU 44 N -4.44 0.87 -3.65 2.33 1.02 0.82 -4.97 120.64 112.62 3k4w n GLU 44 Ca 0.08 -0.63 -0.24 0.00 -0.02 0.00 0.00 57.16 56.35 3k4w n GLU 44 Cb 0.08 -1.49 0.07 0.00 -0.02 0.00 0.00 31.44 30.08 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 -0.51 -7.13 -3.75 3.49 5.02 0.12 -4.93 118.16 110.47 3k4w n LYS 45 Ca 0.10 0.77 -0.37 0.00 -2.02 0.00 0.00 58.31 56.79 3k4w n LYS 45 Cb 0.40 -5.76 -0.12 0.00 -0.02 0.00 0.00 35.03 29.52 3k4w n LYS 45 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 3k4w s SER 46 N -3.52 5.16 0.22 4.39 0.15 0.42 -4.92 113.70 115.60 3k4w s SER 46 Ca 0.49 -0.54 -0.04 0.00 0.70 0.00 0.00 55.95 56.56 3k4w s SER 46 Cb -0.22 -1.91 0.21 0.00 -1.71 0.00 0.00 66.02 62.39 3k4w s SER 46 CO 0.76 -0.15 1.64 0.25 1.20 0.00 0.00 173.24 176.94 3k4w h LEU 47 N 8.25 0.76 -0.16 3.45 5.85 -1.86 -2.54 115.31 129.05 3k4w h LEU 47 Ca -0.34 -0.27 0.05 0.00 0.84 0.00 0.00 57.88 58.16 3k4w h LEU 47 Cb 1.14 -0.21 -0.06 0.00 0.37 0.00 0.00 40.66 41.91 3k4w h LEU 47 CO 0.60 0.96 -0.20 -0.33 -0.34 0.00 0.00 178.44 179.13 3k4w h GLU 48 N 0.65 -0.23 -0.65 1.25 4.39 -1.94 -1.30 114.58 116.76 3k4w h GLU 48 Ca 0.09 0.02 0.01 0.00 0.34 0.00 0.00 59.36 59.82 3k4w h GLU 48 Cb 0.72 0.05 -0.03 0.00 -0.10 0.00 0.00 28.75 29.39 3k4w h GLU 48 CO 0.06 -0.15 0.42 -0.07 -1.16 0.00 0.00 179.01 178.11 3k4w h LEU 49 N -0.24 0.72 -0.31 1.33 3.38 -1.93 -2.36 115.31 115.90 3k4w h LEU 49 Ca 0.11 -0.01 0.01 0.00 0.09 0.00 0.00 57.88 58.07 3k4w h LEU 49 Cb 0.40 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 3k4w h LEU 49 CO -0.30 0.52 0.20 -0.03 0.09 0.00 0.00 178.44 178.92 3k4w h MET 50 N 0.86 0.40 -0.93 1.13 4.05 -1.26 -0.33 114.93 118.84 3k4w h MET 50 Ca 0.24 -0.02 0.13 0.00 -0.28 0.00 0.00 59.70 59.77 3k4w h MET 50 Cb -0.07 -0.09 -0.09 0.00 -0.80 0.00 0.00 31.60 30.55 3k4w h MET 50 CO -0.06 0.26 0.55 0.74 0.23 0.00 0.00 176.91 178.63 3k4w h PHE 51 N 0.41 0.99 -0.58 1.39 0.04 -1.07 0.62 116.94 118.72 3k4w h PHE 51 Ca 0.12 0.03 -0.06 0.00 2.80 0.00 0.00 57.97 60.86 3k4w h PHE 51 Cb -0.04 -0.30 -0.03 0.00 2.20 0.00 0.00 35.95 37.79 3k4w h PHE 51 CO -0.06 0.33 0.12 0.93 -0.60 0.00 0.00 178.31 179.04 3k4w h GLU 52 N 0.83 0.92 -0.08 1.51 5.08 -0.88 -1.23 114.58 120.72 3k4w h GLU 52 Ca 0.48 -0.21 -0.10 0.00 -1.00 0.00 0.00 59.36 58.53 3k4w h GLU 52 Cb 0.57 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.69 3k4w h GLU 52 CO -0.30 0.83 -0.35 0.93 -1.00 0.00 0.00 179.01 179.11 3k4w h GLU 53 N 0.87 0.39 -0.12 2.33 5.08 0.73 -1.83 114.58 122.04 3k4w h GLU 53 Ca 0.19 -0.30 0.03 0.00 -1.00 0.00 0.00 59.36 58.27 3k4w h GLU 53 Cb 0.34 0.06 -0.06 0.00 0.50 0.00 0.00 28.75 29.59 3k4w h GLU 53 CO 0.00 0.94 -0.54 0.52 -1.00 0.00 0.00 179.01 178.93 3k4w h MET 54 N -0.08 -0.56 -0.38 2.33 2.86 0.19 -0.59 114.93 118.70 3k4w h MET 54 Ca -0.02 0.04 0.08 0.00 -2.06 0.00 0.00 59.70 57.73 3k4w h MET 54 Cb 0.99 0.13 -0.07 0.00 0.06 0.00 0.00 31.60 32.71 3k4w h MET 54 CO 0.07 -0.38 -0.10 0.00 1.06 0.00 0.00 176.91 177.57 3k4w h ALA 55 N -0.33 0.24 0.00 6.32 0.00 -1.24 -1.50 119.26 122.74 3k4w h ALA 55 Ca 0.03 0.15 -0.01 0.00 0.00 0.00 0.00 54.91 55.07 3k4w h ALA 55 Cb 0.68 0.30 -0.00 0.00 0.00 0.00 0.00 17.79 18.76 3k4w h ALA 55 CO -0.42 -0.46 -0.05 0.00 0.00 0.00 0.00 179.25 178.31 3k4w h ALA 56 N 1.36 1.35 0.00 0.00 0.00 -1.04 -1.29 119.26 119.64 3k4w h ALA 56 Ca 0.18 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.05 3k4w h ALA 56 Cb 0.28 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.07 3k4w h ALA 56 CO -0.39 0.06 -0.39 0.00 0.00 0.00 0.00 179.25 178.53 3k4w h ALA 57 N 1.95 0.76 0.00 0.00 0.00 -0.09 -3.47 119.26 118.40 3k4w h ALA 57 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3k4w h ALA 57 Cb 0.15 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.94 3k4w h ALA 57 CO 0.01 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.67 3k4w n GLY 58 N 1.28 0.71 3.57 0.00 0.00 -0.49 -4.87 105.19 105.39 3k4w n GLY 58 Ca 0.04 -0.19 -0.42 0.00 0.00 0.00 0.00 46.02 45.45 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 4.88 -0.09 -0.61 1.01 -0.87 -1.60 121.20 121.92 3k4w s ILE 59 Ca 0.00 0.56 0.15 0.00 0.00 0.00 0.00 60.65 61.36 3k4w s ILE 59 Cb 0.00 -4.08 -0.21 0.00 0.01 0.00 0.00 42.46 38.18 3k4w s ILE 59 CO 0.00 -0.33 0.63 -0.62 0.00 0.00 0.00 174.94 174.62 3k4w n GLU 60 N 6.06 0.64 -4.10 2.79 1.02 -0.06 -4.13 120.64 122.86 3k4w n GLU 60 Ca -0.01 0.22 -0.08 0.00 -0.02 0.00 0.00 57.16 57.27 3k4w n GLU 60 Cb 0.49 -1.75 -0.10 0.00 -0.02 0.00 0.00 31.44 30.05 3k4w n GLU 60 CO 0.00 0.00 0.00 -0.65 1.18 0.00 0.00 177.13 177.66 3k4w s GLN 61 N -2.71 0.66 0.07 3.49 -0.21 -1.03 -4.66 119.66 115.26 3k4w s GLN 61 Ca -0.05 -1.25 0.01 0.00 0.02 0.00 0.00 55.36 54.09 3k4w s GLN 61 Cb 0.08 0.16 -0.03 0.00 1.00 0.00 0.00 33.01 34.22 3k4w s GLN 61 CO 0.82 -0.11 -0.06 0.20 -2.12 0.00 0.00 175.29 174.02 3k4w s GLY 62 N -2.94 0.59 -0.26 3.09 0.00 0.13 -1.43 107.32 106.50 3k4w s GLY 62 Ca 0.09 -1.07 -0.04 0.00 0.00 0.00 0.00 44.72 43.70 3k4w s GLY 62 CO -0.09 -1.15 0.01 0.14 0.00 0.00 0.00 173.10 172.01 3k4w s VAL 63 N -2.72 3.47 -0.24 1.40 1.01 -0.59 -0.99 120.40 121.74 3k4w s VAL 63 Ca 0.01 -0.78 -0.11 0.00 0.00 0.00 0.00 61.98 61.10 3k4w s VAL 63 Cb -0.01 -2.74 -0.05 0.00 0.00 0.00 0.00 36.38 33.58 3k4w s VAL 63 CO -0.03 0.18 0.19 0.00 0.00 0.00 0.00 175.10 175.44 3k4w s VAL 65 N 1.11 3.27 0.00 0.00 1.01 -1.26 -1.83 120.40 122.71 3k4w s VAL 65 Ca 0.09 -0.62 0.00 0.00 0.00 0.00 0.00 61.98 61.45 3k4w s VAL 65 Cb -0.14 -2.33 0.00 0.00 0.00 0.00 0.00 36.38 33.91 3k4w s VAL 65 CO 0.05 0.57 0.00 0.61 0.00 0.00 0.00 175.10 176.33 3k4w n GLY 66 N 2.71 5.63 2.54 4.51 0.00 -1.26 -4.88 105.19 114.44 3k4w n GLY 66 Ca -0.18 -1.94 -0.25 0.00 0.00 0.00 0.00 46.02 43.65 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 1.86 0.60 -0.24 1.61 6.06 -1.09 -4.88 118.95 122.87 3k4w s ARG 67 Ca 0.00 -1.26 -0.01 0.00 -2.50 0.00 0.00 55.73 51.95 3k4w s ARG 67 Cb 0.00 -1.14 0.11 0.00 0.06 0.00 0.00 34.95 33.99 3k4w s ARG 67 CO 0.00 -1.22 2.23 -1.71 -2.50 0.00 0.00 175.30 172.09 3k4w n ASN 68 N 3.98 6.13 -4.12 -2.12 2.85 -1.26 -1.30 115.26 119.44 3k4w n ASN 68 Ca 0.13 -2.89 -0.30 0.00 -0.11 0.00 0.00 54.58 51.41 3k4w n ASN 68 Cb 0.40 -1.12 0.21 0.00 1.24 0.00 0.00 39.78 40.51 3k4w n ASN 68 CO 0.00 0.00 0.00 -0.94 -2.11 0.00 0.00 177.26 174.21 3k4w s SER 69 N 0.74 1.95 -0.33 1.20 1.04 -1.26 -4.45 113.70 112.58 3k4w s SER 69 Ca 0.30 0.65 0.07 0.00 0.48 0.00 0.00 55.95 57.45 3k4w s SER 69 Cb 0.21 -0.94 0.47 0.00 0.10 0.00 0.00 66.02 65.86 3k4w s SER 69 CO -0.03 -3.49 1.39 -1.20 0.98 0.00 0.00 173.24 170.89 3k4w n SER 70 N -4.34 4.06 -3.90 7.02 7.64 -1.26 -4.81 113.62 118.03 3k4w n SER 70 Ca 0.12 -3.79 -0.13 0.00 1.01 0.00 0.00 58.87 56.07 3k4w n SER 70 Cb 0.59 -0.55 -0.08 0.00 -1.01 0.00 0.00 64.21 63.16 3k4w n SER 70 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 3k4w s VAL 71 N -4.02 0.00 -0.25 0.44 1.01 -1.26 -5.06 120.40 111.26 3k4w s VAL 71 Ca 0.49 -1.88 -0.43 0.00 0.00 0.00 0.00 61.98 60.17 3k4w s VAL 71 Cb 0.42 -2.47 -0.19 0.00 0.00 0.00 0.00 36.38 34.13 3k4w s VAL 71 CO 0.00 0.00 1.42 -0.11 0.00 0.00 0.00 175.10 176.42 3k4w n LEU 72 N -0.39 1.04 0.00 3.92 -0.00 -1.26 -1.71 117.00 118.60 3k4w n LEU 72 Ca 0.03 1.16 0.00 0.00 -0.00 0.00 0.00 56.01 57.19 3k4w n LEU 72 Cb 0.64 -0.96 0.00 0.00 -0.00 0.00 0.00 43.42 43.10 3k4w n LEU 72 CO 0.31 -1.14 0.00 0.61 -0.00 0.00 0.00 177.39 177.17 3k4w n GLY 73 N 3.07 0.53 3.81 -3.96 0.00 -1.25 -5.00 105.19 102.40 3k4w n GLY 73 Ca 0.25 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.93 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 -2.51 7.05 -0.27 1.61 1.04 -0.69 -4.31 113.70 115.61 3k4w s SER 74 Ca 0.00 1.75 0.03 0.00 0.48 0.00 0.00 55.95 58.21 3k4w s SER 74 Cb 0.00 -2.55 0.07 0.00 0.10 0.00 0.00 66.02 63.64 3k4w s SER 74 CO 0.00 -0.28 -0.06 0.54 0.98 0.00 0.00 173.24 174.42 3k4w s VAL 75 N -1.97 2.05 0.96 5.02 0.11 -0.42 -4.63 120.40 121.52 3k4w s VAL 75 Ca 0.58 -1.72 -0.12 0.00 -2.93 0.00 0.00 61.98 57.79 3k4w s VAL 75 Cb -0.13 -2.27 0.17 0.00 -1.53 0.00 0.00 36.38 32.62 3k4w s VAL 75 CO 0.17 -0.19 1.09 -0.94 -3.33 0.00 0.00 175.10 171.90 3k4w s SER 76 N 1.12 2.86 0.43 3.54 1.04 -1.26 -2.68 113.70 118.75 3k4w s SER 76 Ca -0.03 1.44 0.10 0.00 0.48 0.00 0.00 55.95 57.94 3k4w s SER 76 Cb -0.20 -2.11 0.95 0.00 0.10 0.00 0.00 66.02 64.76 3k4w s SER 76 CO -0.06 -3.02 2.03 0.78 0.98 0.00 0.00 173.24 173.95 3k4w h ASN 77 N -1.81 0.25 -0.25 7.02 2.35 -1.92 -1.33 115.58 119.88 3k4w h ASN 77 Ca -0.52 -0.02 -0.10 0.00 -0.55 0.00 0.00 56.30 55.10 3k4w h ASN 77 Cb 1.30 -0.06 -0.02 0.00 0.05 0.00 0.00 38.32 39.59 3k4w h ASN 77 CO 0.54 0.26 -0.19 0.00 -1.65 0.00 0.00 177.43 176.39 3k4w h ALA 78 N 1.78 0.97 -0.16 -0.83 0.00 -1.97 -0.88 119.26 118.17 3k4w h ALA 78 Ca 0.07 -0.35 -0.21 0.00 0.00 0.00 0.00 54.91 54.42 3k4w h ALA 78 Cb 0.11 -0.15 0.01 0.00 0.00 0.00 0.00 17.79 17.76 3k4w h ALA 78 CO -0.00 0.60 -0.74 -0.44 0.00 0.00 0.00 179.25 178.67 3k4w h ASP 79 N 0.62 0.89 -0.37 0.00 3.32 -1.75 -1.31 116.42 117.82 3k4w h ASP 79 Ca 0.09 -0.57 -0.04 0.00 0.02 0.00 0.00 57.03 56.53 3k4w h ASP 79 Cb 0.67 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.95 3k4w h ASP 79 CO 0.05 1.36 0.06 0.58 -1.72 0.00 0.00 179.24 179.57 3k4w h VAL 80 N 0.52 1.24 -0.91 -1.35 2.07 -1.09 -2.81 116.25 113.92 3k4w h VAL 80 Ca -0.04 -0.84 0.03 0.00 0.82 0.00 0.00 66.70 66.66 3k4w h VAL 80 Cb 1.36 1.08 -0.05 0.00 -1.52 0.00 0.00 31.29 32.16 3k4w h VAL 80 CO 0.15 0.29 0.60 0.00 0.02 0.00 0.00 177.57 178.63 3k4w h ALA 81 N 0.91 1.40 -0.05 1.67 0.00 -1.02 -2.85 119.26 119.33 3k4w h ALA 81 Ca 0.11 -0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.91 3k4w h ALA 81 Cb 0.36 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 3k4w h ALA 81 CO 0.01 0.52 -0.26 0.00 0.00 0.00 0.00 179.25 179.52 3k4w h ALA 82 N 1.46 1.48 -0.39 0.00 0.00 -1.12 -1.99 119.26 118.71 3k4w h ALA 82 Ca 0.35 -0.26 -0.13 0.00 0.00 0.00 0.00 54.91 54.87 3k4w h ALA 82 Cb -0.03 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 3k4w h ALA 82 CO -0.10 0.38 -0.28 0.28 0.00 0.00 0.00 179.25 179.53 3k4w h VAL 83 N 0.07 1.28 -0.02 0.00 2.07 -1.27 -1.96 116.25 116.43 3k4w h VAL 83 Ca 0.01 -1.44 -0.10 0.00 0.82 0.00 0.00 66.70 65.99 3k4w h VAL 83 Cb 0.50 1.34 -0.01 0.00 -1.52 0.00 0.00 31.29 31.60 3k4w h VAL 83 CO 0.04 0.48 -0.45 0.00 0.02 0.00 0.00 177.57 177.66 3k4w h ALA 84 N 0.79 1.22 -0.08 1.67 0.00 -1.38 -1.92 119.26 119.57 3k4w h ALA 84 Ca 0.08 -0.41 -0.03 0.00 0.00 0.00 0.00 54.91 54.54 3k4w h ALA 84 Cb 0.86 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.57 3k4w h ALA 84 CO 0.08 0.57 -0.07 -0.22 0.00 0.00 0.00 179.25 179.60 3k4w h LYS 85 N 0.04 0.19 -0.94 0.00 3.64 -1.34 -1.17 116.57 116.98 3k4w h LYS 85 Ca -0.00 -0.10 0.11 0.00 -1.27 0.00 0.00 60.65 59.39 3k4w h LYS 85 Cb 0.81 0.00 -0.07 0.00 -0.41 0.00 0.00 32.23 32.56 3k4w h LYS 85 CO 0.06 0.62 0.60 0.00 -2.27 0.00 0.00 179.45 178.46 3k4w h ALA 86 N 0.57 1.60 -2.04 5.00 0.00 -1.32 -3.33 119.26 119.74 3k4w h ALA 86 Ca 0.01 0.01 -0.55 0.00 0.00 0.00 0.00 54.91 54.38 3k4w h ALA 86 Cb 0.58 -0.21 -0.40 0.00 0.00 0.00 0.00 17.79 17.77 3k4w h ALA 86 CO 0.02 0.19 -1.03 0.66 0.00 0.00 0.00 179.25 179.09 3k4w n TYR 87 N -4.56 0.52 0.25 0.00 4.01 -0.73 -4.97 117.16 111.68 3k4w n TYR 87 Ca 0.17 -3.72 0.11 0.00 -0.16 0.00 0.00 57.90 54.31 3k4w n TYR 87 Cb 0.33 -0.40 0.66 0.00 -0.31 0.00 0.00 39.34 39.62 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 3.79 0.00 0.00 -0.72 0.13 -1.33 -0.97 132.00 132.90 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 0.85 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.98 3k4w h PRO 88 CO 0.54 0.15 -0.43 -0.40 -0.23 0.00 0.00 178.00 177.63 3k4w n ASP 89 N -3.65 0.70 -0.11 1.44 5.75 -1.26 -4.31 116.55 115.12 3k4w n ASP 89 Ca -0.02 0.24 -0.14 0.00 -0.01 0.00 0.00 54.79 54.86 3k4w n ASP 89 Cb 0.28 -0.12 -0.10 0.00 -1.03 0.00 0.00 41.12 40.14 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 -2.10 0.63 -4.90 0.11 4.76 -0.40 -4.79 118.16 111.47 3k4w n LYS 90 Ca 0.04 0.11 -0.28 0.00 -2.87 0.00 0.00 58.31 55.31 3k4w n LYS 90 Cb 0.43 -1.43 -0.17 0.00 -1.84 0.00 0.00 35.03 32.02 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 2.00 -0.34 2.13 0.08 -1.00 -0.69 117.98 117.73 3k4w s PHE 91 Ca -0.27 -0.79 -0.12 0.00 0.12 0.00 0.00 56.93 55.88 3k4w s PHE 91 Cb 0.07 -1.39 -0.01 0.00 -0.57 0.00 0.00 43.02 41.13 3k4w s PHE 91 CO 0.52 -0.35 0.21 -1.01 -0.10 0.00 0.00 175.22 174.50 3k4w s HIS 92 N 0.51 3.21 0.36 0.36 3.76 -0.16 -4.63 115.29 118.70 3k4w s HIS 92 Ca -0.17 -0.44 -0.25 0.00 -0.15 0.00 0.00 55.06 54.05 3k4w s HIS 92 Cb -0.17 -2.44 -0.09 0.00 1.11 0.00 0.00 32.58 30.98 3k4w s HIS 92 CO 0.06 -0.44 1.03 -1.25 -0.85 0.00 0.00 174.74 173.29 3k4w s PRO 93 N 1.67 4.33 -0.06 8.40 0.04 -1.26 -2.24 135.00 145.87 3k4w s PRO 93 Ca 0.05 1.52 0.05 0.00 0.04 0.00 0.00 61.00 62.65 3k4w s PRO 93 Cb -0.18 -2.70 -0.00 0.00 0.04 0.00 0.00 34.50 31.66 3k4w s PRO 93 CO 0.09 0.01 -0.21 0.08 0.04 0.00 0.00 177.00 177.01 3k4w s VAL 94 N -1.57 1.77 -0.18 -0.36 1.01 -0.76 -4.54 120.40 115.77 3k4w s VAL 94 Ca 0.54 -0.89 -0.18 0.00 0.00 0.00 0.00 61.98 61.46 3k4w s VAL 94 Cb -0.23 -1.52 -0.04 0.00 0.00 0.00 0.00 36.38 34.59 3k4w s VAL 94 CO 0.29 0.50 0.47 -0.83 0.00 0.00 0.00 175.10 175.52 3k4w s GLY 95 N 0.11 2.16 -0.12 4.51 0.00 -0.21 -4.38 107.32 109.39 3k4w s GLY 95 Ca -0.09 -0.38 -0.05 0.00 0.00 0.00 0.00 44.72 44.20 3k4w s GLY 95 CO 0.05 0.91 0.06 -1.35 0.00 0.00 0.00 173.10 172.77 3k4w s SER 96 N 0.97 5.72 -0.23 1.64 1.04 -1.26 -0.55 113.70 121.02 3k4w s SER 96 Ca 0.23 0.23 -0.10 0.00 0.48 0.00 0.00 55.95 56.79 3k4w s SER 96 Cb -0.15 -1.80 -0.05 0.00 0.10 0.00 0.00 66.02 64.12 3k4w s SER 96 CO 0.09 0.33 0.14 -0.63 0.98 0.00 0.00 173.24 174.15 3k4w s ILE 97 N -0.58 5.16 -0.23 -1.02 1.01 -1.02 -4.68 121.20 119.86 3k4w s ILE 97 Ca 0.11 0.11 -0.04 0.00 0.00 0.00 0.00 60.65 60.83 3k4w s ILE 97 Cb -0.12 -3.40 0.08 0.00 0.01 0.00 0.00 42.46 39.03 3k4w s ILE 97 CO 0.02 0.36 0.12 -0.70 0.00 0.00 0.00 174.94 174.74 3k4w s GLU 98 N 1.02 0.13 -0.01 2.79 2.12 -1.26 -4.63 118.70 118.86 3k4w s GLU 98 Ca 0.07 -0.26 -0.06 0.00 0.36 0.00 0.00 54.97 55.08 3k4w s GLU 98 Cb -0.14 -1.48 0.00 0.00 0.26 0.00 0.00 34.13 32.78 3k4w s GLU 98 CO 0.04 -0.83 0.11 0.00 -0.54 0.00 0.00 175.26 174.04 3k4w s ALA 99 N 2.14 -0.27 -0.19 6.30 0.00 -1.26 -4.86 121.76 123.62 3k4w s ALA 99 Ca 0.05 -0.06 0.18 0.00 0.00 0.00 0.00 51.96 52.13 3k4w s ALA 99 Cb -0.16 0.03 0.02 0.00 0.00 0.00 0.00 23.12 23.01 3k4w s ALA 99 CO -0.22 -0.16 1.21 0.00 0.00 0.00 0.00 175.76 176.59 3k4w h ALA 100 N 4.77 0.68 -2.72 0.00 0.00 -1.99 -3.48 119.26 116.53 3k4w h ALA 100 Ca -0.29 -0.46 -0.15 0.00 0.00 0.00 0.00 54.91 54.01 3k4w h ALA 100 Cb 1.20 0.05 -0.19 0.00 0.00 0.00 0.00 17.79 18.85 3k4w h ALA 100 CO 0.41 0.56 -0.65 0.95 0.00 0.00 0.00 179.25 180.52 3k4w s THR 101 N -3.03 0.14 0.26 0.00 -4.23 -1.26 -5.05 115.64 102.46 3k4w s THR 101 Ca 0.02 -1.15 -0.03 0.00 -1.18 0.00 0.00 61.69 59.35 3k4w s THR 101 Cb 0.08 -0.69 0.27 0.00 1.34 0.00 0.00 72.50 73.49 3k4w s THR 101 CO 0.76 -0.63 1.89 -0.09 -0.54 0.00 0.00 174.62 176.01 3k4w h ARG 102 N 4.08 1.16 -0.21 3.99 2.43 -1.93 -2.03 114.38 121.88 3k4w h ARG 102 Ca -0.33 -0.07 -0.08 0.00 -0.81 0.00 0.00 59.98 58.70 3k4w h ARG 102 Cb 1.19 -0.26 -0.01 0.00 -0.42 0.00 0.00 29.97 30.46 3k4w h ARG 102 CO 0.49 0.77 -0.21 1.57 -1.51 0.00 0.00 179.97 181.08 3k4w h LYS 103 N 1.20 0.37 -0.07 0.20 2.10 -1.99 -0.93 116.57 117.45 3k4w h LYS 103 Ca 0.42 -0.12 0.01 0.00 -2.00 0.00 0.00 60.65 58.97 3k4w h LYS 103 Cb 0.13 -0.03 -0.01 0.00 -0.90 0.00 0.00 32.23 31.41 3k4w h LYS 103 CO -0.16 0.57 -0.02 0.93 -2.00 0.00 0.00 179.45 178.77 3k4w h GLU 104 N 0.34 -0.00 -0.83 0.07 5.08 -1.85 -2.61 114.58 114.79 3k4w h GLU 104 Ca 0.06 0.00 0.08 0.00 -1.00 0.00 0.00 59.36 58.50 3k4w h GLU 104 Cb 0.56 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.74 3k4w h GLU 104 CO 0.04 -0.00 0.49 0.00 -1.00 0.00 0.00 179.01 178.53 3k4w h ALA 105 N 1.06 1.16 -0.42 3.43 0.00 -0.57 0.18 119.26 124.10 3k4w h ALA 105 Ca 0.03 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.90 3k4w h ALA 105 Cb 0.05 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.66 3k4w h ALA 105 CO -0.07 0.15 0.02 0.52 0.00 0.00 0.00 179.25 179.87 3k4w h MET 106 N 0.84 0.73 -0.67 0.00 2.86 -1.25 0.91 114.93 118.34 3k4w h MET 106 Ca 0.38 -0.23 -0.07 0.00 -2.06 0.00 0.00 59.70 57.73 3k4w h MET 106 Cb 0.29 -0.07 -0.03 0.00 0.06 0.00 0.00 31.60 31.85 3k4w h MET 106 CO -0.22 0.80 0.14 0.00 1.06 0.00 0.00 176.91 178.69 3k4w h ALA 107 N 0.90 0.96 -0.66 6.32 0.00 -0.96 0.45 119.26 126.28 3k4w h ALA 107 Ca 0.12 -0.26 -0.02 0.00 0.00 0.00 0.00 54.91 54.76 3k4w h ALA 107 Cb 0.46 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 3k4w h ALA 107 CO 0.02 0.66 0.35 1.96 0.00 0.00 0.00 179.25 182.23 3k4w h GLN 108 N 1.03 0.93 -0.24 0.00 4.20 -0.36 -1.92 115.11 118.74 3k4w h GLN 108 Ca 0.21 -0.12 -0.01 0.00 0.06 0.00 0.00 58.65 58.79 3k4w h GLN 108 Cb 0.40 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 27.99 3k4w h GLN 108 CO 0.01 0.71 0.10 1.98 -0.67 0.00 0.00 178.83 180.95 3k4w h MET 109 N 0.90 0.36 -0.46 1.46 4.05 -0.44 -0.91 114.93 119.89 3k4w h MET 109 Ca 0.23 -0.07 0.09 0.00 -0.28 0.00 0.00 59.70 59.67 3k4w h MET 109 Cb 0.06 -0.06 -0.08 0.00 -0.80 0.00 0.00 31.60 30.73 3k4w h MET 109 CO -0.03 0.41 0.00 0.37 0.23 0.00 0.00 176.91 177.89 3k4w h GLN 110 N 0.24 0.11 -0.52 0.39 5.75 -0.75 -1.71 115.11 118.62 3k4w h GLN 110 Ca 0.08 -0.01 -0.02 0.00 -0.15 0.00 0.00 58.65 58.55 3k4w h GLN 110 Cb 0.18 -0.03 -0.02 0.00 1.07 0.00 0.00 27.48 28.68 3k4w h GLN 110 CO -0.01 0.08 0.23 1.49 -2.65 0.00 0.00 178.83 177.97 3k4w h GLU 111 N 0.12 0.76 -0.67 1.69 4.81 -1.11 0.08 114.58 120.26 3k4w h GLU 111 Ca 0.23 -0.12 0.14 0.00 -0.13 0.00 0.00 59.36 59.47 3k4w h GLU 111 Cb 0.34 -0.13 -0.13 0.00 0.63 0.00 0.00 28.75 29.46 3k4w h GLU 111 CO -0.38 0.65 -0.14 0.82 -0.73 0.00 0.00 179.01 179.23 3k4w h ILE 112 N 0.70 0.34 -0.08 2.32 2.04 -0.90 -0.58 117.51 121.35 3k4w h ILE 112 Ca 0.18 -0.01 -0.05 0.00 1.00 0.00 0.00 64.86 65.99 3k4w h ILE 112 Cb 0.15 0.33 -0.00 0.00 -0.74 0.00 0.00 36.82 36.56 3k4w h ILE 112 CO -0.02 0.00 -0.12 -0.07 0.00 0.00 0.00 178.15 177.94 3k4w h LEU 113 N 0.02 0.25 -1.85 1.44 3.38 -0.98 -1.92 115.31 115.66 3k4w h LEU 113 Ca 0.33 -0.53 0.19 0.00 0.09 0.00 0.00 57.88 57.96 3k4w h LEU 113 Cb 0.51 -0.07 -0.04 0.00 0.09 0.00 0.00 40.66 41.16 3k4w h LEU 113 CO -0.67 0.73 0.51 0.44 0.09 0.00 0.00 178.44 179.54 3k4w h ASP 114 N -0.22 0.13 0.77 -0.43 3.32 -0.75 -1.13 116.42 118.11 3k4w h ASP 114 Ca 0.01 0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.07 3k4w h ASP 114 Cb 0.68 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 40.21 3k4w h ASP 114 CO 0.03 0.06 0.00 0.18 -1.72 0.00 0.00 179.24 177.79 3k4w n LEU 115 N -4.39 0.00 0.00 1.55 4.77 -0.24 -4.90 117.00 113.79 3k4w n LEU 115 Ca 0.14 0.43 0.00 0.00 -0.03 0.00 0.00 56.01 56.55 3k4w n LEU 115 Cb 0.70 -0.43 0.00 0.00 -2.33 0.00 0.00 43.42 41.36 3k4w n LEU 115 CO 0.36 -0.04 0.00 0.61 -1.33 0.00 0.00 177.39 176.98 3k4w n GLY 116 N 1.14 0.72 3.75 -0.72 0.00 -0.43 -5.00 105.19 104.65 3k4w n GLY 116 Ca 0.08 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.70 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 -2.39 4.19 0.00 -0.61 1.01 -0.73 -4.96 121.20 117.71 3k4w s ILE 117 Ca 0.00 2.00 0.00 0.00 0.00 0.00 0.00 60.65 62.65 3k4w s ILE 117 Cb 0.00 -4.29 0.00 0.00 0.01 0.00 0.00 42.46 38.18 3k4w s ILE 117 CO 0.00 0.48 0.77 0.54 0.00 0.00 0.00 174.94 176.74 3k4w n ARG 118 N 1.69 1.64 -4.56 2.79 5.12 -1.26 -4.25 116.66 117.83 3k4w n ARG 118 Ca -0.02 -1.07 -0.23 0.00 -1.93 0.00 0.00 57.85 54.60 3k4w n ARG 118 Cb 0.48 -0.88 -0.16 0.00 -1.16 0.00 0.00 32.46 30.74 3k4w n ARG 118 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 3k4w s ILE 119 N -0.60 1.03 0.09 0.55 1.01 -1.26 -4.38 121.20 117.63 3k4w s ILE 119 Ca 0.00 -0.49 0.04 0.00 0.00 0.00 0.00 60.65 60.20 3k4w s ILE 119 Cb 0.00 -0.91 -0.04 0.00 0.01 0.00 0.00 42.46 41.52 3k4w s ILE 119 CO 0.00 0.31 0.04 0.54 0.00 0.00 0.00 174.94 175.83 3k4w s VAL 120 N 0.17 4.27 0.07 2.92 0.11 -1.01 -1.04 120.40 125.88 3k4w s VAL 120 Ca -0.04 -0.89 0.09 0.00 -2.93 0.00 0.00 61.98 58.21 3k4w s VAL 120 Cb -0.10 -3.05 -0.03 0.00 -1.53 0.00 0.00 36.38 31.67 3k4w s VAL 120 CO 0.01 0.12 -0.25 0.21 -3.33 0.00 0.00 175.10 171.86 3k4w s ASN 121 N -2.36 3.00 -0.08 3.54 2.47 0.29 0.06 114.94 121.86 3k4w s ASN 121 Ca 0.27 -0.63 -0.04 0.00 0.42 0.00 0.00 52.86 52.89 3k4w s ASN 121 Cb -0.12 -0.24 0.04 0.00 -1.45 0.00 0.00 41.25 39.48 3k4w s ASN 121 CO 0.20 0.20 0.19 -0.76 -3.72 0.00 0.00 177.10 173.21 3k4w s LEU 122 N -1.51 0.66 -0.52 3.21 1.43 0.14 -2.43 118.68 119.66 3k4w s LEU 122 Ca 0.11 0.39 0.07 0.00 -1.03 0.00 0.00 54.13 53.67 3k4w s LEU 122 Cb -0.10 0.53 0.26 0.00 0.03 0.00 0.00 46.19 46.92 3k4w s LEU 122 CO 0.03 -0.15 0.66 -0.62 0.23 0.00 0.00 176.35 176.51 3k4w n GLU 123 N 4.10 1.73 0.17 1.70 1.02 -1.26 -2.16 120.64 125.93 3k4w n GLU 123 Ca -0.25 -4.00 0.13 0.00 -0.02 0.00 0.00 57.16 53.02 3k4w n GLU 123 Cb 0.53 -1.79 0.53 0.00 -0.02 0.00 0.00 31.44 30.69 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 3.96 0.00 0.00 3.49 0.13 -1.87 -2.37 132.00 135.34 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 0.66 0.00 0.00 0.78 -0.23 0.00 0.00 178.00 179.21 3k4w h GLY 125 N 2.39 0.00 -0.98 1.56 0.00 -1.51 -1.24 103.07 103.28 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 -2.66 0.62 -1.06 4.60 0.24 -0.89 -4.11 118.33 115.06 3k4w n VAL 126 Ca 0.01 -0.81 -0.32 0.00 -2.04 0.00 0.00 64.34 61.17 3k4w n VAL 126 Cb 0.22 0.77 0.13 0.00 -1.47 0.00 0.00 33.84 33.48 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 -0.93 1.92 0.55 6.34 0.51 -1.15 -4.91 118.94 121.27 3k4w s TRP 127 Ca 0.17 1.69 0.23 0.00 -2.12 0.00 0.00 56.10 56.07 3k4w s TRP 127 Cb 0.10 -3.36 1.50 0.00 -0.81 0.00 0.00 33.47 30.90 3k4w s TRP 127 CO 0.13 -2.60 2.14 0.00 -0.51 0.00 0.00 176.95 176.11 3k4w h ALA 128 N -1.15 1.93 -3.79 0.98 0.00 -1.94 -3.24 119.26 112.05 3k4w h ALA 128 Ca -0.45 -0.00 -0.66 0.00 0.00 0.00 0.00 54.91 53.79 3k4w h ALA 128 Cb 1.27 0.01 -0.38 0.00 0.00 0.00 0.00 17.79 18.69 3k4w h ALA 128 CO 0.46 -0.16 -0.77 0.99 0.00 0.00 0.00 179.25 179.77 3k4w s THR 129 N -4.87 2.19 0.30 0.00 2.01 -1.26 -5.10 115.64 108.91 3k4w s THR 129 Ca -0.05 -1.91 -0.28 0.00 0.31 0.00 0.00 61.69 59.76 3k4w s THR 129 Cb 0.17 -2.43 -0.09 0.00 0.01 0.00 0.00 72.50 70.16 3k4w s THR 129 CO 0.63 -0.26 1.04 -2.84 -0.69 0.00 0.00 174.62 172.50 3k4w s PRO 130 N 1.03 4.58 0.04 4.92 0.02 -1.23 -4.98 135.00 139.39 3k4w s PRO 130 Ca -0.01 1.64 -0.02 0.00 0.02 0.00 0.00 61.00 62.63 3k4w s PRO 130 Cb -0.20 -3.04 -0.03 0.00 0.02 0.00 0.00 34.50 31.26 3k4w s PRO 130 CO -0.06 0.21 0.01 0.00 -0.33 0.00 0.00 177.00 176.83 3k4w s MET 131 N -1.66 0.56 0.46 5.54 0.23 -0.48 -4.97 119.30 118.98 3k4w s MET 131 Ca 0.47 -0.97 -0.23 0.00 -1.03 0.00 0.00 55.69 53.93 3k4w s MET 131 Cb -0.27 0.20 -0.07 0.00 -1.53 0.00 0.00 34.83 33.15 3k4w s MET 131 CO 0.35 -0.12 1.14 -1.01 -2.03 0.00 0.00 175.02 173.35 3k4w s HIS 132 N -3.12 2.92 0.53 3.16 3.76 -1.26 -2.83 115.29 118.45 3k4w s HIS 132 Ca -0.01 1.55 0.32 0.00 -0.15 0.00 0.00 55.06 56.78 3k4w s HIS 132 Cb 0.02 -3.32 1.48 0.00 1.11 0.00 0.00 32.58 31.86 3k4w s HIS 132 CO -0.07 -1.36 1.88 -0.39 -0.85 0.00 0.00 174.74 173.95 3k4w h VAL 133 N 1.84 0.54 -0.56 -0.90 -1.51 -1.91 -0.90 116.25 112.85 3k4w h VAL 133 Ca -0.49 -0.01 -0.10 0.00 -1.23 0.00 0.00 66.70 64.87 3k4w h VAL 133 Cb 1.24 0.51 -0.06 0.00 -2.13 0.00 0.00 31.29 30.86 3k4w h VAL 133 CO 0.60 0.00 0.13 -0.90 -1.23 0.00 0.00 177.57 176.17 3k4w n ASP 134 N -4.27 4.63 -4.77 4.19 5.75 -1.26 -4.90 116.55 115.93 3k4w n ASP 134 Ca 0.20 -2.91 -0.39 0.00 -0.01 0.00 0.00 54.79 51.68 3k4w n ASP 134 Cb 0.99 -0.69 -0.00 0.00 -1.03 0.00 0.00 41.12 40.39 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 -0.70 6.24 0.36 -1.12 -1.08 -0.34 -4.90 116.67 115.13 3k4w s ASP 135 Ca 0.46 2.60 0.08 0.00 -0.52 0.00 0.00 52.55 55.17 3k4w s ASP 135 Cb 0.36 -2.63 0.81 0.00 -1.46 0.00 0.00 42.92 40.00 3k4w s ASP 135 CO 0.12 -0.89 1.91 0.08 0.52 0.00 0.00 175.17 176.91 3k4w h ARG 136 N 2.52 0.67 -0.06 4.34 0.11 -1.93 -1.39 114.38 118.64 3k4w h ARG 136 Ca -0.50 -0.04 0.02 0.00 0.10 0.00 0.00 59.98 59.56 3k4w h ARG 136 Cb 1.25 -0.15 -0.00 0.00 1.11 0.00 0.00 29.97 32.18 3k4w h ARG 136 CO 0.62 0.44 0.05 0.00 0.10 0.00 0.00 179.97 181.18 3k4w h ARG 137 N 0.69 0.00 0.00 0.08 3.08 -1.96 -2.26 114.38 114.01 3k4w h ARG 137 Ca 0.39 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.44 3k4w h ARG 137 Cb 0.57 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.62 3k4w h ARG 137 CO -0.16 0.00 -0.58 1.28 -1.07 0.00 0.00 179.97 179.44 3k4w n LEU 138 N -4.10 0.68 -0.37 3.04 4.77 -0.53 -4.34 117.00 116.15 3k4w n LEU 138 Ca -0.02 0.23 0.02 0.00 -0.03 0.00 0.00 56.01 56.22 3k4w n LEU 138 Cb 0.15 -0.20 0.17 0.00 -2.33 0.00 0.00 43.42 41.21 3k4w n LEU 138 CO 0.30 -0.05 1.27 1.88 -1.33 0.00 0.00 177.39 179.46 3k4w h TYR 139 N 0.00 1.21 -0.86 -1.77 -1.99 -1.46 -2.17 116.97 109.93 3k4w h TYR 139 Ca 0.00 0.03 0.01 0.00 2.00 0.00 0.00 58.73 60.77 3k4w h TYR 139 Cb 0.72 -0.40 -0.04 0.00 2.00 0.00 0.00 36.73 39.01 3k4w h TYR 139 CO 0.00 0.63 0.57 -1.35 -0.00 0.00 0.00 178.16 178.02 3k4w h PRO 140 N 1.19 1.13 -0.14 4.88 0.11 -1.77 -1.62 132.00 135.78 3k4w h PRO 140 Ca 0.43 -0.07 0.03 0.00 0.11 0.00 0.00 66.00 66.50 3k4w h PRO 140 Cb 0.15 -0.25 -0.03 0.00 0.11 0.00 0.00 31.00 30.97 3k4w h PRO 140 CO -0.17 0.75 -0.05 1.25 -0.21 0.00 0.00 178.00 179.57 3k4w h LEU 141 N 1.16 -0.19 -1.52 2.35 5.85 -1.68 -2.15 115.31 119.14 3k4w h LEU 141 Ca 0.32 0.05 0.05 0.00 0.84 0.00 0.00 57.88 59.14 3k4w h LEU 141 Cb -0.12 0.11 -0.03 0.00 0.37 0.00 0.00 40.66 40.98 3k4w h LEU 141 CO -0.07 -0.07 0.39 1.88 -0.34 0.00 0.00 178.44 180.22 3k4w h TYR 142 N -0.03 0.60 -0.29 1.25 0.05 -1.17 -1.53 116.97 115.86 3k4w h TYR 142 Ca 0.08 0.02 -0.07 0.00 0.05 0.00 0.00 58.73 58.80 3k4w h TYR 142 Cb 0.14 -0.20 -0.01 0.00 1.01 0.00 0.00 36.73 37.67 3k4w h TYR 142 CO -0.19 0.34 -0.08 0.00 -1.05 0.00 0.00 178.16 177.17 3k4w h ALA 143 N 1.68 0.40 -0.31 3.88 0.00 -1.10 0.26 119.26 124.06 3k4w h ALA 143 Ca 0.24 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 3k4w h ALA 143 Cb 0.20 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 3k4w h ALA 143 CO -0.07 0.23 0.15 0.35 0.00 0.00 0.00 179.25 179.91 3k4w h PHE 144 N 0.33 0.45 -0.21 0.00 3.57 -1.08 -0.57 116.94 119.43 3k4w h PHE 144 Ca 0.07 -0.02 -0.12 0.00 3.53 0.00 0.00 57.97 61.44 3k4w h PHE 144 Cb 0.56 -0.14 -0.01 0.00 2.79 0.00 0.00 35.95 39.15 3k4w h PHE 144 CO 0.05 0.39 -0.36 0.00 -2.23 0.00 0.00 178.31 176.16 3k4w h GLU 146 N 0.38 -0.04 -0.57 0.00 4.81 -0.27 -1.12 114.58 117.77 3k4w h GLU 146 Ca 0.04 0.00 0.02 0.00 -0.13 0.00 0.00 59.36 59.29 3k4w h GLU 146 Cb 0.82 0.01 -0.03 0.00 0.63 0.00 0.00 28.75 30.18 3k4w h GLU 146 CO 0.07 0.09 0.38 -0.44 -0.73 0.00 0.00 179.01 178.37 3k4w h ASP 147 N -0.17 0.61 -0.32 1.04 3.32 -1.06 -3.09 116.42 116.75 3k4w h ASP 147 Ca -0.00 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.03 3k4w h ASP 147 Cb 0.15 -0.15 0.00 0.00 0.22 0.00 0.00 39.33 39.56 3k4w h ASP 147 CO 0.01 0.43 0.00 0.59 -1.72 0.00 0.00 179.24 178.55 3k4w n ASN 148 N -4.46 3.40 -0.11 6.45 3.02 -0.75 -4.95 115.26 117.86 3k4w n ASN 148 Ca 0.06 -2.00 -0.01 0.00 -0.03 0.00 0.00 54.58 52.60 3k4w n ASN 148 Cb 0.09 -0.20 -0.01 0.00 -0.61 0.00 0.00 39.78 39.05 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 1.49 0.50 3.60 7.41 0.00 -0.84 -5.00 105.19 112.34 3k4w n GLY 149 Ca 0.18 -0.95 -0.41 0.00 0.00 0.00 0.00 46.02 44.85 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 -2.05 4.99 0.37 -0.61 1.01 -0.48 -4.67 121.20 119.76 3k4w s ILE 150 Ca 0.00 0.76 -0.28 0.00 0.00 0.00 0.00 60.65 61.14 3k4w s ILE 150 Cb 0.00 -3.94 -0.10 0.00 0.01 0.00 0.00 42.46 38.43 3k4w s ILE 150 CO 0.00 -0.09 1.36 -2.84 0.00 0.00 0.00 174.94 173.37 3k4w s PRO 151 N 2.48 4.15 -0.10 2.79 0.02 -1.26 -4.62 135.00 138.46 3k4w s PRO 151 Ca 0.23 2.31 0.03 0.00 0.02 0.00 0.00 61.00 63.58 3k4w s PRO 151 Cb -0.15 -2.94 0.01 0.00 0.02 0.00 0.00 34.50 31.44 3k4w s PRO 151 CO 0.11 -0.39 -0.18 0.08 -0.33 0.00 0.00 177.00 176.29 3k4w s VAL 152 N -1.17 1.67 -0.20 3.83 1.01 -0.16 -2.41 120.40 122.97 3k4w s VAL 152 Ca 0.53 -0.77 -0.13 0.00 0.00 0.00 0.00 61.98 61.60 3k4w s VAL 152 Cb -0.41 -1.48 -0.05 0.00 0.00 0.00 0.00 36.38 34.44 3k4w s VAL 152 CO 0.55 0.47 0.26 -0.63 0.00 0.00 0.00 175.10 175.75 3k4w s ILE 153 N 0.65 5.31 -0.05 2.22 1.01 0.11 -0.38 121.20 130.08 3k4w s ILE 153 Ca -0.13 0.44 0.03 0.00 0.00 0.00 0.00 60.65 60.99 3k4w s ILE 153 Cb -0.16 -3.60 0.01 0.00 0.01 0.00 0.00 42.46 38.71 3k4w s ILE 153 CO 0.04 0.35 -0.13 0.00 0.00 0.00 0.00 174.94 175.20 3k4w s MET 154 N 0.82 1.52 -0.67 2.79 0.23 0.16 -0.69 119.30 123.47 3k4w s MET 154 Ca 0.13 -0.44 -0.27 0.00 -1.03 0.00 0.00 55.69 54.08 3k4w s MET 154 Cb -0.13 -1.31 0.01 0.00 -1.53 0.00 0.00 34.83 31.87 3k4w s MET 154 CO 0.04 0.12 1.50 1.41 -2.03 0.00 0.00 175.02 176.06 3k4w s MET 155 N 0.34 3.02 -0.06 3.16 1.75 -0.92 -1.51 119.30 125.08 3k4w s MET 155 Ca -0.08 0.17 0.10 0.00 -1.25 0.00 0.00 55.69 54.62 3k4w s MET 155 Cb -0.12 -4.24 0.18 0.00 2.84 0.00 0.00 34.83 33.49 3k4w s MET 155 CO 0.02 -2.31 1.11 0.25 -0.65 0.00 0.00 175.02 173.45 3k4w n THR 156 N 6.74 1.45 -4.44 10.11 -2.24 -1.09 -4.81 114.28 120.01 3k4w n THR 156 Ca 0.10 -1.56 -0.22 0.00 -2.27 0.00 0.00 64.05 60.10 3k4w n THR 156 Cb 0.50 0.15 -0.10 0.00 -2.10 0.00 0.00 70.33 68.78 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 -1.80 1.82 0.00 3.38 0.00 -1.11 -4.00 107.32 105.60 3k4w s GLY 157 Ca 0.18 -1.88 0.00 0.00 0.00 0.00 0.00 44.72 43.02 3k4w s GLY 157 CO 0.03 -1.88 0.00 0.61 0.00 0.00 0.00 173.10 171.86 3k4w n GLY 158 N -0.58 1.06 2.43 0.20 0.00 0.58 -3.39 105.19 105.49 3k4w n GLY 158 Ca -0.06 -0.76 -0.40 0.00 0.00 0.00 0.00 46.02 44.81 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 1.42 7.98 0.23 1.61 3.02 -1.26 -4.64 115.26 123.62 3k4w n ASN 159 Ca 0.00 -2.84 0.15 0.00 -0.03 0.00 0.00 54.58 51.85 3k4w n ASN 159 Cb 0.00 -1.48 0.47 0.00 -0.61 0.00 0.00 39.78 38.16 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 4.95 1.00 -2.26 5.41 0.00 -1.87 -3.47 119.26 123.02 3k4w h ALA 160 Ca 0.76 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.67 3k4w h ALA 160 Cb 0.33 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.12 3k4w h ALA 160 CO 1.66 0.00 0.00 0.41 0.00 0.00 0.00 179.25 181.32 3k4w n GLY 161 N 0.48 2.41 0.21 0.00 0.00 -1.26 -3.31 105.19 103.73 3k4w n GLY 161 Ca 0.02 -1.06 0.14 0.00 0.00 0.00 0.00 46.02 45.13 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 -1.90 -3.46 132.00 128.38 3k4w h PRO 162 Ca 0.00 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 64.92 3k4w h PRO 162 Cb 0.00 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 31.08 3k4w h PRO 162 CO 0.00 0.00 -0.03 -0.40 -0.23 0.00 0.00 178.00 177.34 3k4w n ASP 163 N -2.82 -1.60 0.20 1.44 5.68 -1.26 -5.06 116.55 113.13 3k4w n ASP 163 Ca 0.03 -2.79 0.14 0.00 -0.50 0.00 0.00 54.79 51.67 3k4w n ASP 163 Cb 0.38 2.87 0.57 0.00 -1.14 0.00 0.00 41.12 43.79 3k4w n ASP 163 CO 0.00 0.00 0.00 -0.29 -1.33 0.00 0.00 177.20 175.58 3k4w h ILE 164 N 1.99 0.00 -0.03 2.12 2.10 -1.95 -1.59 117.51 120.15 3k4w h ILE 164 Ca -0.29 -0.39 0.01 0.00 1.08 0.00 0.00 64.86 65.28 3k4w h ILE 164 Cb 1.19 1.25 -0.00 0.00 -1.09 0.00 0.00 36.82 38.17 3k4w h ILE 164 CO 0.38 0.00 0.05 0.71 -1.08 0.00 0.00 178.15 178.21 3k4w h THR 165 N 0.00 0.26 0.00 2.19 1.35 -1.98 -2.32 112.91 112.41 3k4w h THR 165 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 3k4w h THR 165 Cb 0.46 0.95 0.00 0.00 -1.73 0.00 0.00 68.15 67.84 3k4w h THR 165 CO 0.00 0.00 0.00 -1.22 -0.25 0.00 0.00 175.52 174.05 3k4w n TYR 166 N -3.45 0.00 0.06 4.73 4.01 -0.60 -1.87 117.16 120.05 3k4w n TYR 166 Ca -0.02 0.00 0.02 0.00 -0.16 0.00 0.00 57.90 57.74 3k4w n TYR 166 Cb 0.13 -0.26 0.04 0.00 -0.31 0.00 0.00 39.34 38.95 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 -1.26 0.51 -1.67 -0.72 -2.24 -0.88 -4.70 114.28 103.32 3k4w n THR 167 Ca 0.12 -0.75 -0.46 0.00 -2.27 0.00 0.00 64.05 60.68 3k4w n THR 167 Cb 0.18 0.80 -0.04 0.00 -2.10 0.00 0.00 70.33 69.16 3k4w n THR 167 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 3k4w n ASN 168 N 0.11 3.11 0.17 3.42 2.85 -0.78 -4.81 115.26 119.34 3k4w n ASN 168 Ca 0.04 1.07 0.13 0.00 -0.11 0.00 0.00 54.58 55.71 3k4w n ASN 168 Cb 0.23 -1.42 0.62 0.00 1.24 0.00 0.00 39.78 40.45 3k4w n ASN 168 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 3k4w h PRO 169 N 6.29 0.00 -0.75 1.20 0.13 -1.92 -2.57 132.00 134.37 3k4w h PRO 169 Ca -0.45 0.00 0.12 0.00 -0.87 0.00 0.00 66.00 64.80 3k4w h PRO 169 Cb 1.26 0.00 -0.05 0.00 0.13 0.00 0.00 31.00 32.34 3k4w h PRO 169 CO 0.89 0.00 0.50 1.05 -0.23 0.00 0.00 178.00 180.21 3k4w h GLU 170 N 0.00 0.52 0.32 0.86 4.11 -1.96 -2.16 114.58 116.26 3k4w h GLU 170 Ca 0.00 -0.03 -0.02 0.00 0.07 0.00 0.00 59.36 59.38 3k4w h GLU 170 Cb 0.13 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.27 3k4w h GLU 170 CO 0.00 0.35 -0.15 0.45 0.07 0.00 0.00 179.01 179.72 3k4w h HIS 171 N 0.54 -0.40 -0.04 2.06 3.86 -1.82 -1.99 115.15 117.36 3k4w h HIS 171 Ca 0.36 -0.01 -0.08 0.00 -1.16 0.00 0.00 60.37 59.48 3k4w h HIS 171 Cb 0.66 0.13 -0.01 0.00 1.06 0.00 0.00 27.41 29.25 3k4w h HIS 171 CO -0.00 -0.08 -0.36 0.97 0.86 0.00 0.00 177.93 179.32 3k4w h ILE 172 N -0.74 1.27 -0.19 2.45 2.10 -1.76 -2.81 117.51 117.84 3k4w h ILE 172 Ca -0.04 -1.30 -0.09 0.00 1.08 0.00 0.00 64.86 64.50 3k4w h ILE 172 Cb 0.50 1.65 -0.01 0.00 -1.09 0.00 0.00 36.82 37.86 3k4w h ILE 172 CO 0.07 0.38 -0.30 -0.78 -1.08 0.00 0.00 178.15 176.45 3k4w h ASP 173 N 0.08 0.37 -0.44 2.19 3.58 -1.40 -0.94 116.42 119.86 3k4w h ASP 173 Ca 0.01 -0.13 -0.14 0.00 0.42 0.00 0.00 57.03 57.19 3k4w h ASP 173 Cb 0.68 -0.10 -0.01 0.00 1.72 0.00 0.00 39.33 41.61 3k4w h ASP 173 CO 0.05 0.66 -0.25 0.03 -2.88 0.00 0.00 179.24 176.85 3k4w h ARG 174 N 0.32 0.97 -0.46 0.28 3.08 -1.11 -1.05 114.38 116.42 3k4w h ARG 174 Ca 0.04 -0.43 0.01 0.00 0.07 0.00 0.00 59.98 59.68 3k4w h ARG 174 Cb 0.69 -0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.69 3k4w h ARG 174 CO 0.05 1.10 0.29 0.28 -1.07 0.00 0.00 179.97 180.62 3k4w h VAL 175 N 0.83 1.08 -0.66 2.04 2.07 -1.28 -0.17 116.25 120.15 3k4w h VAL 175 Ca 0.10 -0.20 -0.05 0.00 0.82 0.00 0.00 66.70 67.37 3k4w h VAL 175 Cb 0.83 0.44 -0.03 0.00 -1.52 0.00 0.00 31.29 31.02 3k4w h VAL 175 CO 0.07 0.11 0.21 -0.07 0.02 0.00 0.00 177.57 177.91 3k4w h LEU 176 N 0.58 0.95 -0.72 2.57 3.38 -1.09 -0.18 115.31 120.80 3k4w h LEU 176 Ca 0.18 -0.20 -0.00 0.00 0.09 0.00 0.00 57.88 57.94 3k4w h LEU 176 Cb -0.02 -0.25 -0.04 0.00 0.09 0.00 0.00 40.66 40.44 3k4w h LEU 176 CO -0.06 0.90 0.45 1.23 0.09 0.00 0.00 178.44 181.05 3k4w h GLY 177 N 0.95 1.04 1.52 0.83 0.00 -0.87 -3.16 103.07 103.39 3k4w h GLY 177 Ca 0.21 -0.42 0.00 0.00 0.00 0.00 0.00 47.33 47.12 3k4w h GLY 177 CO -0.01 0.41 -0.43 -0.55 0.00 0.00 0.00 176.54 175.96 3k4w h ASP 178 N 0.99 0.00 -2.60 0.19 3.32 -0.75 -3.34 116.42 114.23 3k4w h ASP 178 Ca 0.26 -0.05 -0.60 0.00 0.02 0.00 0.00 57.03 56.66 3k4w h ASP 178 Cb -0.06 0.00 -0.40 0.00 0.22 0.00 0.00 39.33 39.09 3k4w h ASP 178 CO -0.05 0.02 -0.80 0.49 -1.72 0.00 0.00 179.24 177.18 3k4w n PHE 179 N -2.61 1.13 0.48 4.55 3.72 -0.10 -4.98 117.46 119.64 3k4w n PHE 179 Ca 0.03 -3.79 0.09 0.00 -0.05 0.00 0.00 57.45 53.73 3k4w n PHE 179 Cb 0.50 -0.20 0.40 0.00 -0.94 0.00 0.00 39.48 39.23 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 2.20 0.09 -0.48 -1.08 -0.04 -1.20 -2.38 135.00 132.11 3k4w n PRO 180 Ca 0.25 0.31 0.07 0.00 -0.04 0.00 0.00 63.50 64.09 3k4w n PRO 180 Cb 0.43 -1.66 0.24 0.00 -0.04 0.00 0.00 33.50 32.47 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 -1.83 3.59 -4.55 3.54 8.00 -1.26 -4.74 116.55 119.30 3k4w n ASP 181 Ca 0.03 -3.14 -0.37 0.00 0.71 0.00 0.00 54.79 52.02 3k4w n ASP 181 Cb 0.21 -0.55 -0.11 0.00 -0.02 0.00 0.00 41.12 40.64 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 -2.90 3.82 -0.12 0.64 2.96 -1.00 -4.88 118.68 117.20 3k4w s LEU 182 Ca 0.42 -0.05 -0.29 0.00 -0.22 0.00 0.00 54.13 53.98 3k4w s LEU 182 Cb 0.35 -2.04 -0.04 0.00 0.50 0.00 0.00 46.19 44.96 3k4w s LEU 182 CO 0.07 -0.01 1.54 -0.89 -1.32 0.00 0.00 176.35 175.74 3k4w s THR 183 N 1.51 3.79 -0.02 3.68 2.01 -1.26 -4.73 115.64 120.62 3k4w s THR 183 Ca 0.06 0.94 0.06 0.00 0.31 0.00 0.00 61.69 63.07 3k4w s THR 183 Cb -0.15 -3.66 -0.01 0.00 0.01 0.00 0.00 72.50 68.69 3k4w s THR 183 CO 0.07 -0.14 -0.19 -0.69 -0.69 0.00 0.00 174.62 172.98 3k4w s VAL 184 N 4.17 1.49 -0.23 3.82 1.01 -0.88 -0.99 120.40 128.79 3k4w s VAL 184 Ca 0.68 -0.80 -0.03 0.00 0.00 0.00 0.00 61.98 61.84 3k4w s VAL 184 Cb -0.28 -1.24 0.01 0.00 0.00 0.00 0.00 36.38 34.86 3k4w s VAL 184 CO 0.26 0.42 -0.07 -0.69 0.00 0.00 0.00 175.10 175.02 3k4w s VAL 185 N -0.39 3.05 -0.64 2.92 1.01 0.49 -0.82 120.40 126.03 3k4w s VAL 185 Ca 0.06 -0.73 -0.28 0.00 0.00 0.00 0.00 61.98 61.03 3k4w s VAL 185 Cb -0.08 -2.44 0.03 0.00 0.00 0.00 0.00 36.38 33.89 3k4w s VAL 185 CO -0.00 0.35 1.26 -0.55 0.00 0.00 0.00 175.10 176.16 3k4w s SER 186 N 1.40 6.28 0.31 3.32 0.15 -0.85 -0.66 113.70 123.66 3k4w s SER 186 Ca 0.04 -0.07 -0.28 0.00 0.70 0.00 0.00 55.95 56.33 3k4w s SER 186 Cb -0.15 -2.55 -0.09 0.00 -1.71 0.00 0.00 66.02 61.51 3k4w s SER 186 CO -0.05 -1.66 1.08 -0.94 1.20 0.00 0.00 173.24 172.88 3k4w s SER 187 N 3.51 7.15 -0.05 5.45 1.04 -0.57 -1.04 113.70 129.19 3k4w s SER 187 Ca 0.42 2.21 0.00 0.00 0.48 0.00 0.00 55.95 59.06 3k4w s SER 187 Cb -0.08 -2.62 0.00 0.00 0.10 0.00 0.00 66.02 63.42 3k4w s SER 187 CO 0.21 -0.22 0.00 1.41 0.98 0.00 0.00 173.24 175.63 3k4w n HIS 188 N 0.90 0.00 -2.06 5.02 8.25 -0.14 -2.66 115.22 124.54 3k4w n HIS 188 Ca 0.00 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.32 3k4w n HIS 188 Cb 0.46 -1.42 -0.03 0.00 1.12 0.00 0.00 29.99 30.12 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 -0.26 0.20 2.76 -1.41 0.00 -0.82 -1.77 105.19 103.88 3k4w n GLY 189 Ca -0.00 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.90 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 -1.41 -5.66 -4.66 1.61 5.15 -1.26 -4.90 115.26 104.14 3k4w n ASN 190 Ca -0.16 0.28 -0.44 0.00 -0.60 0.00 0.00 54.58 53.65 3k4w n ASN 190 Cb 0.57 -4.14 -0.02 0.00 -0.53 0.00 0.00 39.78 35.67 3k4w n ASN 190 CO 0.00 0.00 0.00 1.87 1.40 0.00 0.00 177.26 180.53 3k4w n TRP 191 N -2.24 1.95 1.24 1.20 -0.00 -0.73 -1.59 117.44 117.27 3k4w n TRP 191 Ca -0.11 0.54 0.13 0.00 -0.00 0.00 0.00 57.50 58.06 3k4w n TRP 191 Cb 0.58 -2.39 0.42 0.00 -0.00 0.00 0.00 31.31 29.92 3k4w n TRP 191 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 177.69 177.34 3k4w n PRO 192 N 1.33 0.67 -1.16 5.87 -0.04 -1.26 -0.31 135.00 140.10 3k4w n PRO 192 Ca 0.09 -0.36 -0.34 0.00 -0.04 0.00 0.00 63.50 62.85 3k4w n PRO 192 Cb 0.32 -1.49 -0.02 0.00 -0.04 0.00 0.00 33.50 32.27 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 -0.85 2.17 0.10 0.54 7.02 -0.62 -4.66 117.44 121.14 3k4w n TRP 193 Ca 0.12 -2.53 -0.23 0.00 -1.02 0.00 0.00 57.50 53.84 3k4w n TRP 193 Cb 0.33 -2.13 -0.13 0.00 -2.42 0.00 0.00 31.31 26.96 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 3.49 1.28 -0.76 -0.99 2.07 -1.91 -0.47 116.25 118.97 3k4w h VAL 194 Ca 0.64 -2.48 0.09 0.00 0.82 0.00 0.00 66.70 65.77 3k4w h VAL 194 Cb 0.34 2.74 -0.05 0.00 -1.52 0.00 0.00 31.29 32.80 3k4w h VAL 194 CO 1.71 0.75 0.50 1.56 0.02 0.00 0.00 177.57 182.11 3k4w h GLN 195 N 0.26 0.69 0.08 1.57 4.20 -1.95 -2.37 115.11 117.58 3k4w h GLN 195 Ca -0.20 -0.04 -0.22 0.00 0.06 0.00 0.00 58.65 58.25 3k4w h GLN 195 Cb 1.95 -0.16 0.02 0.00 0.30 0.00 0.00 27.48 29.59 3k4w h GLN 195 CO 0.24 0.46 -0.93 0.93 -0.67 0.00 0.00 178.83 178.86 3k4w h GLU 196 N 0.71 0.49 0.00 1.46 3.07 -1.90 -3.16 114.58 115.25 3k4w h GLU 196 Ca 0.35 -0.63 -0.06 0.00 -0.50 0.00 0.00 59.36 58.51 3k4w h GLU 196 Cb 0.41 0.20 -0.01 0.00 -0.84 0.00 0.00 28.75 28.51 3k4w h GLU 196 CO -0.13 1.26 -0.29 0.97 -1.40 0.00 0.00 179.01 179.42 3k4w h ILE 197 N 0.02 0.92 -0.16 3.13 6.09 -0.60 -1.89 117.51 125.03 3k4w h ILE 197 Ca -0.14 -1.13 -0.02 0.00 -1.37 0.00 0.00 64.86 62.20 3k4w h ILE 197 Cb 1.64 1.66 -0.01 0.00 0.47 0.00 0.00 36.82 40.59 3k4w h ILE 197 CO 0.18 0.29 0.01 0.40 -3.07 0.00 0.00 178.15 175.96 3k4w h ILE 198 N 0.00 1.24 -0.51 2.19 1.08 -1.49 0.55 117.51 120.58 3k4w h ILE 198 Ca -0.00 -0.80 0.08 0.00 -0.39 0.00 0.00 64.86 63.75 3k4w h ILE 198 Cb 0.64 1.46 -0.10 0.00 -3.07 0.00 0.00 36.82 35.75 3k4w h ILE 198 CO 0.04 0.24 -0.41 -0.74 -0.69 0.00 0.00 178.15 176.58 3k4w h HIS 199 N 0.03 -1.19 -0.69 1.37 -0.00 -1.45 0.15 115.15 113.37 3k4w h HIS 199 Ca 0.05 0.07 0.07 0.00 -0.00 0.00 0.00 60.37 60.56 3k4w h HIS 199 Cb 0.35 0.59 -0.06 0.00 -0.00 0.00 0.00 27.41 28.29 3k4w h HIS 199 CO 0.03 -0.42 0.38 0.28 -0.00 0.00 0.00 177.93 178.19 3k4w h VAL 200 N -0.26 0.94 0.00 5.26 2.07 -1.17 0.80 116.25 123.89 3k4w h VAL 200 Ca 0.17 -0.23 -0.07 0.00 0.82 0.00 0.00 66.70 67.39 3k4w h VAL 200 Cb 0.57 0.20 -0.01 0.00 -1.52 0.00 0.00 31.29 30.53 3k4w h VAL 200 CO -0.64 0.12 -0.33 0.00 0.02 0.00 0.00 177.57 176.75 3k4w h ALA 201 N 1.37 1.34 -0.17 1.67 0.00 -0.63 0.12 119.26 122.96 3k4w h ALA 201 Ca 0.32 -0.30 -0.02 0.00 0.00 0.00 0.00 54.91 54.90 3k4w h ALA 201 Cb 0.24 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 3k4w h ALA 201 CO -0.21 0.42 0.01 0.35 0.00 0.00 0.00 179.25 179.82 3k4w h PHE 202 N 0.00 0.32 0.04 0.00 3.57 0.15 -3.26 116.94 117.75 3k4w h PHE 202 Ca -0.00 -0.05 -0.24 0.00 3.53 0.00 0.00 57.97 61.20 3k4w h PHE 202 Cb 0.63 -0.08 0.01 0.00 2.79 0.00 0.00 35.95 39.29 3k4w h PHE 202 CO 0.00 0.49 -1.03 -0.09 -2.23 0.00 0.00 178.31 175.45 3k4w h ARG 203 N 0.05 0.40 -4.17 1.11 2.43 -0.78 -3.43 114.38 110.00 3k4w h ARG 203 Ca 0.05 -0.48 -0.75 0.00 -0.81 0.00 0.00 59.98 57.99 3k4w h ARG 203 Cb 0.35 0.15 -0.25 0.00 -0.42 0.00 0.00 29.97 29.80 3k4w h ARG 203 CO 0.01 1.15 -0.28 1.03 -1.51 0.00 0.00 179.97 180.37 3k4w s ARG 204 N -3.12 2.84 0.47 0.20 1.81 0.39 -4.95 118.95 116.60 3k4w s ARG 204 Ca -0.06 -1.69 0.32 0.00 -1.72 0.00 0.00 55.73 52.58 3k4w s ARG 204 Cb 0.08 -4.18 1.52 0.00 -0.45 0.00 0.00 34.95 31.92 3k4w s ARG 204 CO 0.88 -1.26 1.96 -1.00 -0.68 0.00 0.00 175.30 175.19 3k4w h PRO 205 N 8.75 0.00 -0.67 3.54 0.13 -1.83 -2.57 132.00 139.35 3k4w h PRO 205 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 3k4w h PRO 205 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 3k4w h PRO 205 CO 0.97 0.00 0.00 0.09 -0.23 0.00 0.00 178.00 178.83 3k4w n ASN 206 N -2.73 4.13 -4.67 1.44 3.02 -1.26 -4.90 115.26 110.28 3k4w n ASN 206 Ca -0.00 -2.16 -0.41 0.00 -0.03 0.00 0.00 54.58 51.98 3k4w n ASN 206 Cb 0.18 -0.50 -0.05 0.00 -0.61 0.00 0.00 39.78 38.80 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 -1.30 4.17 0.19 3.41 2.96 -0.97 -2.08 118.68 125.07 3k4w s LEU 207 Ca 0.47 1.04 0.05 0.00 -0.22 0.00 0.00 54.13 55.48 3k4w s LEU 207 Cb 0.27 -3.09 -0.04 0.00 0.50 0.00 0.00 46.19 43.83 3k4w s LEU 207 CO 0.29 -0.33 0.22 -0.31 -1.32 0.00 0.00 176.35 174.90 3k4w s TYR 208 N 1.94 3.27 -0.06 5.38 2.02 -0.00 -4.87 117.35 125.03 3k4w s TYR 208 Ca 0.35 -0.00 0.04 0.00 -0.37 0.00 0.00 57.07 57.09 3k4w s TYR 208 Cb -0.16 -1.54 -0.00 0.00 -0.40 0.00 0.00 41.96 39.86 3k4w s TYR 208 CO 0.12 0.51 -0.19 -0.51 -1.57 0.00 0.00 175.55 173.91 3k4w s LEU 209 N -3.41 1.93 -0.52 -1.29 1.43 0.27 -2.00 118.68 115.09 3k4w s LEU 209 Ca 0.33 -0.42 0.04 0.00 -1.03 0.00 0.00 54.13 53.04 3k4w s LEU 209 Cb -0.10 -1.12 0.15 0.00 0.03 0.00 0.00 46.19 45.16 3k4w s LEU 209 CO 0.26 0.15 0.34 -0.55 0.23 0.00 0.00 176.35 176.78 3k4w s SER 210 N 0.21 3.46 0.49 2.29 0.15 -0.21 -1.59 113.70 118.49 3k4w s SER 210 Ca -0.10 -3.13 0.22 0.00 0.70 0.00 0.00 55.95 53.64 3k4w s SER 210 Cb -0.14 -1.08 1.26 0.00 -1.71 0.00 0.00 66.02 64.35 3k4w s SER 210 CO 0.04 -0.18 2.03 1.55 1.20 0.00 0.00 173.24 177.88 3k4w h PRO 211 N 6.03 0.00 0.00 5.44 0.13 -1.80 -0.25 132.00 141.56 3k4w h PRO 211 Ca 0.11 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.24 3k4w h PRO 211 Cb 0.87 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.00 3k4w h PRO 211 CO 0.53 0.15 0.00 -0.40 -0.23 0.00 0.00 178.00 178.05 3k4w n ASP 212 N -3.91 0.00 -0.17 1.44 5.68 -1.26 -1.96 116.55 116.37 3k4w n ASP 212 Ca -0.02 0.00 0.11 0.00 -0.50 0.00 0.00 54.79 54.38 3k4w n ASP 212 Cb 0.25 0.00 0.43 0.00 -1.14 0.00 0.00 41.12 40.65 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 0.57 0.00 0.11 -0.00 -1.76 -2.53 114.93 111.32 3k4w h MET 213 Ca 0.00 -0.03 0.00 0.00 -0.00 0.00 0.00 59.70 59.67 3k4w h MET 213 Cb 0.00 -0.13 0.00 0.00 -0.00 0.00 0.00 31.60 31.47 3k4w h MET 213 CO 0.00 0.38 0.00 0.66 -0.00 0.00 0.00 176.91 177.95 3k4w n TYR 214 N -4.49 0.68 0.32 -0.10 4.01 -0.83 -1.58 117.16 115.16 3k4w n TYR 214 Ca 0.13 0.26 0.19 0.00 -0.16 0.00 0.00 57.90 58.32 3k4w n TYR 214 Cb 0.38 -0.92 1.08 0.00 -0.31 0.00 0.00 39.34 39.57 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 -8.31 7.72 5.85 -1.54 -3.40 115.31 115.63 3k4w h LEU 215 Ca 0.00 0.00 -0.61 0.00 0.84 0.00 0.00 57.88 58.11 3k4w h LEU 215 Cb 0.38 0.00 -0.13 0.00 0.37 0.00 0.00 40.66 41.29 3k4w h LEU 215 CO 0.00 0.00 0.66 -0.47 -0.34 0.00 0.00 178.44 178.29 3k4w s TYR 216 N -4.35 2.61 -1.39 1.25 5.04 -0.62 -4.34 117.35 115.55 3k4w s TYR 216 Ca -0.05 -0.35 -0.04 0.00 -2.44 0.00 0.00 57.07 54.19 3k4w s TYR 216 Cb 0.14 -4.33 0.00 0.00 0.35 0.00 0.00 41.96 38.12 3k4w s TYR 216 CO 0.47 -1.69 0.47 -1.71 -1.34 0.00 0.00 175.55 171.75 3k4w n ASN 217 N 8.03 -5.55 -4.32 4.32 5.15 -1.26 -5.01 115.26 116.62 3k4w n ASN 217 Ca -0.01 -0.22 -0.19 0.00 -0.60 0.00 0.00 54.58 53.55 3k4w n ASN 217 Cb 0.46 -4.41 -0.10 0.00 -0.53 0.00 0.00 39.78 35.20 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 -5.82 2.50 0.55 1.20 1.43 -1.26 -5.10 118.68 112.19 3k4w s LEU 218 Ca 0.23 -0.94 -0.19 0.00 -1.03 0.00 0.00 54.13 52.19 3k4w s LEU 218 Cb -0.10 -0.68 -0.07 0.00 0.03 0.00 0.00 46.19 45.36 3k4w s LEU 218 CO 0.29 -0.13 0.82 -2.65 0.23 0.00 0.00 176.35 174.91 3k4w n PRO 219 N -0.05 0.85 0.00 1.29 -0.02 -1.26 -2.27 135.00 133.54 3k4w n PRO 219 Ca -0.11 0.32 0.00 0.00 -2.02 0.00 0.00 63.50 61.70 3k4w n PRO 219 Cb 0.59 -1.98 0.00 0.00 -0.02 0.00 0.00 33.50 32.09 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 1.44 2.55 0.21 -1.23 0.00 -1.26 -4.94 105.19 101.96 3k4w n GLY 220 Ca 0.12 0.00 -0.02 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 -0.26 -0.45 1.61 6.17 -1.75 -0.84 115.15 119.63 3k4w h HIS 221 Ca 0.00 0.05 -0.13 0.00 0.71 0.00 0.00 60.37 60.99 3k4w h HIS 221 Cb 0.00 0.19 -0.01 0.00 2.52 0.00 0.00 27.41 30.11 3k4w h HIS 221 CO 0.00 -0.22 -0.24 0.00 0.71 0.00 0.00 177.93 178.18 3k4w h ALA 222 N 1.52 0.72 -0.24 5.26 0.00 -1.92 -1.76 119.26 122.84 3k4w h ALA 222 Ca 0.26 -0.40 0.06 0.00 0.00 0.00 0.00 54.91 54.83 3k4w h ALA 222 Cb 0.39 -0.16 -0.06 0.00 0.00 0.00 0.00 17.79 17.96 3k4w h ALA 222 CO -0.53 0.67 -0.15 -0.44 0.00 0.00 0.00 179.25 178.79 3k4w h ASP 223 N 0.81 -0.49 -0.01 0.00 3.32 -1.85 0.66 116.42 118.84 3k4w h ASP 223 Ca 0.10 0.11 0.01 0.00 0.02 0.00 0.00 57.03 57.27 3k4w h ASP 223 Cb 0.80 0.26 -0.01 0.00 0.22 0.00 0.00 39.33 40.60 3k4w h ASP 223 CO 0.07 -0.19 -0.05 -0.26 -1.72 0.00 0.00 179.24 177.09 3k4w h PHE 224 N -0.13 -0.12 -0.43 4.55 0.04 -0.92 -1.61 116.94 118.32 3k4w h PHE 224 Ca 0.13 0.01 -0.01 0.00 2.80 0.00 0.00 57.97 60.90 3k4w h PHE 224 Cb 0.33 0.06 -0.02 0.00 2.20 0.00 0.00 35.95 38.52 3k4w h PHE 224 CO -0.32 -0.08 0.22 0.82 -0.60 0.00 0.00 178.31 178.35 3k4w h ILE 225 N -0.08 1.17 -0.23 -0.55 1.08 -1.23 0.12 117.51 117.79 3k4w h ILE 225 Ca 0.03 -0.47 0.01 0.00 -0.39 0.00 0.00 64.86 64.04 3k4w h ILE 225 Cb 0.12 0.70 -0.01 0.00 -3.07 0.00 0.00 36.82 34.55 3k4w h ILE 225 CO -0.06 0.18 0.15 -0.61 -0.69 0.00 0.00 178.15 177.12 3k4w h GLN 226 N 0.55 0.25 0.16 2.37 4.15 -0.84 -1.46 115.11 120.29 3k4w h GLN 226 Ca 0.15 -0.01 -0.30 0.00 0.77 0.00 0.00 58.65 59.25 3k4w h GLN 226 Cb 0.10 -0.06 0.03 0.00 0.21 0.00 0.00 27.48 27.76 3k4w h GLN 226 CO -0.02 0.16 -1.29 0.00 -1.93 0.00 0.00 178.83 175.75 3k4w h ALA 227 N 1.86 -0.06 -0.77 3.38 0.00 -0.91 -2.99 119.26 119.77 3k4w h ALA 227 Ca 0.09 -0.79 0.14 0.00 0.00 0.00 0.00 54.91 54.35 3k4w h ALA 227 Cb 0.05 0.13 -0.05 0.00 0.00 0.00 0.00 17.79 17.92 3k4w h ALA 227 CO -0.02 0.66 0.51 0.00 0.00 0.00 0.00 179.25 180.40 3k4w h ALA 228 N 0.23 2.02 -0.00 0.00 0.00 -0.53 0.46 119.26 121.44 3k4w h ALA 228 Ca -0.21 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.70 3k4w h ALA 228 Cb 1.97 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.68 3k4w h ALA 228 CO 0.24 -0.22 -0.05 0.09 0.00 0.00 0.00 179.25 179.31 3k4w n ASN 229 N -4.50 0.48 0.00 0.00 3.02 -0.57 -2.73 115.26 110.97 3k4w n ASN 229 Ca 0.14 -0.81 0.00 0.00 -0.03 0.00 0.00 54.58 53.88 3k4w n ASN 229 Cb 0.49 -0.06 0.00 0.00 -0.61 0.00 0.00 39.78 39.60 3k4w n ASN 229 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 3k4w n SER 230 N -0.80 0.00 0.25 6.41 2.88 -0.18 -4.95 113.62 117.22 3k4w n SER 230 Ca 0.18 0.00 0.15 0.00 -1.33 0.00 0.00 58.87 57.87 3k4w n SER 230 Cb 0.24 0.00 0.48 0.00 -0.75 0.00 0.00 64.21 64.18 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 -0.01 0.66 -5.15 -1.84 -3.08 116.94 107.53 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 0.00 -0.02 -0.11 -2.00 0.00 0.00 178.31 176.18 3k4w n LEU 232 N -3.03 0.92 -0.33 2.10 7.94 -0.02 -4.15 117.00 120.41 3k4w n LEU 232 Ca 0.02 -0.29 0.21 0.00 -1.11 0.00 0.00 56.01 54.84 3k4w n LEU 232 Cb 0.39 -0.02 0.40 0.00 0.53 0.00 0.00 43.42 44.72 3k4w n LEU 232 CO 0.30 0.15 0.90 0.00 -1.11 0.00 0.00 177.39 177.63 3k4w h ALA 233 N 4.15 1.54 -0.02 1.96 0.00 -1.42 -1.92 119.26 123.56 3k4w h ALA 233 Ca 0.00 0.31 0.00 0.00 0.00 0.00 0.00 54.91 55.22 3k4w h ALA 233 Cb 0.33 0.50 0.00 0.00 0.00 0.00 0.00 17.79 18.62 3k4w h ALA 233 CO 0.00 -0.71 0.00 -0.25 0.00 0.00 0.00 179.25 178.29 3k4w n ASP 234 N -5.40 1.33 -0.32 0.00 8.00 -1.26 -4.26 116.55 114.64 3k4w n ASP 234 Ca 0.29 -1.45 0.02 0.00 0.71 0.00 0.00 54.79 54.36 3k4w n ASP 234 Cb 0.96 -0.00 0.03 0.00 -0.02 0.00 0.00 41.12 42.09 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 0.04 0.44 -4.21 -1.24 1.74 -0.77 -4.84 116.66 107.83 3k4w n ARG 235 Ca 0.19 -1.36 -0.31 0.00 -0.77 0.00 0.00 57.85 55.61 3k4w n ARG 235 Cb 0.32 -0.77 -0.09 0.00 -1.02 0.00 0.00 32.46 30.91 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 -0.75 2.56 -0.10 5.56 1.75 -0.94 -0.57 119.30 126.83 3k4w s MET 236 Ca 0.08 -0.79 0.02 0.00 -1.25 0.00 0.00 55.69 53.74 3k4w s MET 236 Cb 0.07 -2.54 0.02 0.00 2.84 0.00 0.00 34.83 35.21 3k4w s MET 236 CO 0.01 0.56 -0.13 -0.51 -0.65 0.00 0.00 175.02 174.30 3k4w s LEU 237 N -2.04 1.62 0.27 4.11 1.43 -0.62 -4.40 118.68 119.05 3k4w s LEU 237 Ca 0.23 -0.37 -0.29 0.00 -1.03 0.00 0.00 54.13 52.66 3k4w s LEU 237 Cb -0.12 -0.98 -0.10 0.00 0.03 0.00 0.00 46.19 45.03 3k4w s LEU 237 CO 0.15 0.00 1.31 0.12 0.23 0.00 0.00 176.35 178.16 3k4w s PHE 238 N 0.99 3.16 -0.17 0.29 5.36 -0.61 -4.50 117.98 122.50 3k4w s PHE 238 Ca -0.07 1.32 -0.21 0.00 -0.96 0.00 0.00 56.93 57.00 3k4w s PHE 238 Cb -0.15 -3.64 0.06 0.00 -0.34 0.00 0.00 43.02 38.95 3k4w s PHE 238 CO -0.01 -1.87 0.57 0.20 -1.46 0.00 0.00 175.22 172.65 3k4w s GLY 239 N -0.14 -0.43 -0.05 13.12 0.00 -1.26 -1.03 107.32 117.54 3k4w s GLY 239 Ca 0.52 1.45 0.21 0.00 0.00 0.00 0.00 44.72 46.90 3k4w s GLY 239 CO 0.46 1.21 0.42 -1.30 0.00 0.00 0.00 173.10 173.88 3k4w n THR 240 N 2.31 0.14 -1.24 0.90 -2.24 -1.26 -4.11 114.28 108.78 3k4w n THR 240 Ca -0.15 -0.51 -0.08 0.00 -2.27 0.00 0.00 64.05 61.03 3k4w n THR 240 Cb 0.56 -0.03 -0.04 0.00 -2.10 0.00 0.00 70.33 68.72 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 -2.28 -0.13 -1.41 6.98 0.00 -0.42 -3.77 120.51 119.49 3k4w n ALA 241 Ca -0.07 0.14 -0.53 0.00 0.00 0.00 0.00 53.44 52.98 3k4w n ALA 241 Cb 0.61 -1.62 -0.06 0.00 0.00 0.00 0.00 19.45 18.38 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 -2.24 0.15 0.70 0.00 9.36 -1.16 -1.29 117.16 122.68 3k4w n TYR 242 Ca -0.08 0.99 0.07 0.00 3.32 0.00 0.00 57.90 62.20 3k4w n TYR 242 Cb 0.53 -1.97 0.21 0.00 -0.63 0.00 0.00 39.34 37.49 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 1.24 1.97 -0.23 2.98 -0.04 -1.26 -1.43 135.00 138.24 3k4w n PRO 243 Ca 0.19 -1.51 0.11 0.00 -0.04 0.00 0.00 63.50 62.24 3k4w n PRO 243 Cb 0.15 -1.35 0.39 0.00 -0.04 0.00 0.00 33.50 32.65 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 2.53 0.66 -6.14 0.54 2.86 -1.49 -3.42 114.93 110.46 3k4w h MET 244 Ca 0.00 -0.04 -0.62 0.00 -2.06 0.00 0.00 59.70 56.98 3k4w h MET 244 Cb 0.57 -0.15 -0.29 0.00 0.06 0.00 0.00 31.60 31.80 3k4w h MET 244 CO 0.00 0.44 -0.86 0.00 1.06 0.00 0.00 176.91 177.55 3k4w s PRO 246 N -0.61 4.27 0.17 0.00 0.04 -1.26 -3.83 135.00 133.78 3k4w s PRO 246 Ca 0.08 2.26 -0.14 0.00 0.04 0.00 0.00 61.00 63.24 3k4w s PRO 246 Cb -0.08 -3.16 0.08 0.00 0.04 0.00 0.00 34.50 31.38 3k4w s PRO 246 CO -0.00 -0.47 1.82 -0.07 0.04 0.00 0.00 177.00 178.31 3k4w h LEU 247 N 6.01 0.50 0.30 -3.56 3.38 -1.95 -2.10 115.31 117.88 3k4w h LEU 247 Ca -0.44 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.52 3k4w h LEU 247 Cb 1.21 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 41.86 3k4w h LEU 247 CO 0.84 0.35 -0.14 0.50 0.09 0.00 0.00 178.44 180.08 3k4w h LYS 248 N 0.60 -0.38 -0.02 1.13 3.64 -1.92 -1.84 116.57 117.78 3k4w h LYS 248 Ca 0.19 0.03 -0.12 0.00 -1.27 0.00 0.00 60.65 59.48 3k4w h LYS 248 Cb -0.00 0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.89 3k4w h LYS 248 CO -0.08 -0.07 -0.52 0.93 -2.27 0.00 0.00 179.45 177.44 3k4w h GLU 249 N -0.74 0.06 -0.10 1.90 3.07 -1.98 -1.31 114.58 115.49 3k4w h GLU 249 Ca -0.04 -0.04 -0.04 0.00 -0.50 0.00 0.00 59.36 58.75 3k4w h GLU 249 Cb 0.50 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.41 3k4w h GLU 249 CO 0.07 0.57 -0.09 -0.92 -1.40 0.00 0.00 179.01 177.24 3k4w h TYR 250 N 0.05 0.27 -0.20 4.33 3.20 -1.42 -2.76 116.97 120.45 3k4w h TYR 250 Ca -0.00 -0.08 -0.02 0.00 3.14 0.00 0.00 58.73 61.77 3k4w h TYR 250 Cb 0.94 -0.06 -0.01 0.00 1.54 0.00 0.00 36.73 39.15 3k4w h TYR 250 CO 0.00 0.64 0.06 1.15 -1.64 0.00 0.00 178.16 178.38 3k4w h THR 251 N -0.18 1.19 -0.05 1.81 2.02 -1.28 0.66 112.91 117.07 3k4w h THR 251 Ca 0.02 -0.61 0.04 0.00 0.77 0.00 0.00 66.41 66.62 3k4w h THR 251 Cb 0.59 1.22 -0.06 0.00 -1.74 0.00 0.00 68.15 68.17 3k4w h THR 251 CO 0.02 0.19 -0.35 -0.33 0.37 0.00 0.00 175.52 175.43 3k4w h GLU 252 N 0.14 -0.45 -0.04 6.66 5.08 -1.33 -0.79 114.58 123.85 3k4w h GLU 252 Ca 0.06 0.03 0.04 0.00 -1.00 0.00 0.00 59.36 58.49 3k4w h GLU 252 Cb 0.24 0.10 -0.06 0.00 0.50 0.00 0.00 28.75 29.54 3k4w h GLU 252 CO -0.00 -0.30 -0.35 2.35 -1.00 0.00 0.00 179.01 179.71 3k4w h TRP 253 N -0.47 -0.96 -0.57 4.33 7.01 -1.43 -2.98 115.95 120.88 3k4w h TRP 253 Ca 0.07 0.03 0.12 0.00 2.11 0.00 0.00 58.89 61.22 3k4w h TRP 253 Cb 0.58 0.43 -0.10 0.00 -2.10 0.00 0.00 29.16 27.96 3k4w h TRP 253 CO -0.39 -0.43 -0.06 0.35 -2.79 0.00 0.00 178.44 175.12 3k4w h PHE 254 N -0.48 -0.15 0.00 2.65 3.57 -0.47 -1.07 116.94 120.99 3k4w h PHE 254 Ca 0.07 0.05 0.00 0.00 3.53 0.00 0.00 57.97 61.61 3k4w h PHE 254 Cb 0.58 0.15 0.00 0.00 2.79 0.00 0.00 35.95 39.47 3k4w h PHE 254 CO -0.38 -0.19 0.36 -0.07 -2.23 0.00 0.00 178.31 175.80 3k4w h LEU 255 N 0.07 0.00 -2.29 0.59 3.38 -1.00 -1.14 115.31 114.92 3k4w h LEU 255 Ca 0.29 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.26 3k4w h LEU 255 Cb 0.46 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.21 3k4w h LEU 255 CO -0.53 0.00 0.00 0.35 0.09 0.00 0.00 178.44 178.35 3k4w n THR 256 N -2.86 0.56 -2.24 0.22 -2.24 -0.41 -4.98 114.28 102.33 3k4w n THR 256 Ca -0.02 -0.75 -0.36 0.00 -2.27 0.00 0.00 64.05 60.65 3k4w n THR 256 Cb 0.41 0.86 0.00 0.00 -2.10 0.00 0.00 70.33 69.49 3k4w n THR 256 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3k4w s LEU 257 N -1.41 3.84 -0.96 3.22 1.43 -0.43 -4.91 118.68 119.45 3k4w s LEU 257 Ca 0.40 2.25 -0.20 0.00 -1.03 0.00 0.00 54.13 55.55 3k4w s LEU 257 Cb 0.23 -4.45 -0.10 0.00 0.03 0.00 0.00 46.19 41.89 3k4w s LEU 257 CO 0.31 -1.13 2.01 -0.81 0.23 0.00 0.00 176.35 176.96 3k4w n PRO 258 N -1.01 1.87 -5.04 1.29 -0.04 -1.26 -4.86 135.00 125.94 3k4w n PRO 258 Ca 0.10 -2.06 -0.30 0.00 -0.04 0.00 0.00 63.50 61.20 3k4w n PRO 258 Cb 0.50 -3.03 -0.17 0.00 -0.04 0.00 0.00 33.50 30.76 3k4w n PRO 258 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 3k4w s ILE 259 N 4.59 1.80 0.65 0.52 1.01 -1.26 -4.95 121.20 123.56 3k4w s ILE 259 Ca 0.55 -0.87 -0.16 0.00 0.00 0.00 0.00 60.65 60.17 3k4w s ILE 259 Cb 0.14 -1.57 -0.00 0.00 0.01 0.00 0.00 42.46 41.04 3k4w s ILE 259 CO 0.06 0.50 1.14 -1.59 0.00 0.00 0.00 174.94 175.06 3k4w s LYS 260 N 0.39 2.74 0.23 2.79 -2.85 -1.26 -4.70 119.74 117.09 3k4w s LYS 260 Ca -0.17 1.55 -0.06 0.00 -1.00 0.00 0.00 55.97 56.29 3k4w s LYS 260 Cb -0.17 -1.93 0.34 0.00 -2.06 0.00 0.00 37.83 34.01 3k4w s LYS 260 CO 0.07 -1.33 1.81 -1.35 0.10 0.00 0.00 175.35 174.66 3k4w h PRO 261 N 0.20 0.76 -0.38 1.78 0.11 -1.99 -0.89 132.00 131.58 3k4w h PRO 261 Ca -0.48 -0.05 -0.13 0.00 0.11 0.00 0.00 66.00 65.46 3k4w h PRO 261 Cb 1.26 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 32.19 3k4w h PRO 261 CO 0.53 0.50 -0.27 -0.44 -0.21 0.00 0.00 178.00 178.12 3k4w h ASP 262 N 0.78 0.83 -0.62 -2.05 3.32 -2.01 -1.99 116.42 114.68 3k4w h ASP 262 Ca 0.37 -0.32 -0.01 0.00 0.02 0.00 0.00 57.03 57.08 3k4w h ASP 262 Cb 0.29 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.58 3k4w h ASP 262 CO -0.22 1.05 0.35 0.00 -1.72 0.00 0.00 179.24 178.70 3k4w h ALA 263 N 1.00 1.41 -0.14 3.45 0.00 -1.75 -2.81 119.26 120.43 3k4w h ALA 263 Ca 0.08 -0.10 -0.15 0.00 0.00 0.00 0.00 54.91 54.74 3k4w h ALA 263 Cb 0.80 -0.26 0.01 0.00 0.00 0.00 0.00 17.79 18.34 3k4w h ALA 263 CO 0.07 0.49 -0.50 1.98 0.00 0.00 0.00 179.25 181.29 3k4w h MET 264 N 0.89 0.59 -0.64 0.00 1.85 -0.63 -1.18 114.93 115.82 3k4w h MET 264 Ca 0.23 -0.44 0.08 0.00 -0.61 0.00 0.00 59.70 58.95 3k4w h MET 264 Cb 0.02 0.08 -0.06 0.00 0.43 0.00 0.00 31.60 32.07 3k4w h MET 264 CO -0.04 1.06 0.31 0.93 -0.40 0.00 0.00 176.91 178.78 3k4w h GLU 265 N 0.24 0.54 -0.20 0.39 5.08 -1.33 -0.19 114.58 119.10 3k4w h GLU 265 Ca -0.02 -0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.30 3k4w h GLU 265 Cb 1.12 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 30.24 3k4w h GLU 265 CO 0.11 0.36 0.09 0.87 -1.00 0.00 0.00 179.01 179.44 3k4w h LYS 266 N 0.55 0.29 -0.45 2.33 1.57 -1.18 -1.47 116.57 118.21 3k4w h LYS 266 Ca 0.30 -0.04 -0.10 0.00 -1.87 0.00 0.00 60.65 58.95 3k4w h LYS 266 Cb 0.29 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.53 3k4w h LYS 266 CO -0.24 0.31 -0.10 0.82 -0.57 0.00 0.00 179.45 179.67 3k4w h ILE 267 N 0.19 1.27 -0.53 1.86 2.04 -1.01 0.21 117.51 121.53 3k4w h ILE 267 Ca 0.07 -1.21 -0.08 0.00 1.00 0.00 0.00 64.86 64.64 3k4w h ILE 267 Cb 0.12 1.14 -0.02 0.00 -0.74 0.00 0.00 36.82 37.32 3k4w h ILE 267 CO -0.01 0.41 0.03 -0.07 0.00 0.00 0.00 178.15 178.52 3k4w h LEU 268 N 0.69 0.90 0.00 1.44 3.38 -0.99 -1.62 115.31 119.10 3k4w h LEU 268 Ca 0.11 -0.29 0.00 0.00 0.09 0.00 0.00 57.88 57.79 3k4w h LEU 268 Cb 0.64 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.15 3k4w h LEU 268 CO 0.04 0.97 0.00 0.00 0.09 0.00 0.00 178.44 179.54 3k4w n HIS 269 N -4.31 0.00 -0.05 1.13 1.44 -0.62 -1.56 115.22 111.25 3k4w n HIS 269 Ca 0.02 0.00 -0.11 0.00 -2.01 0.00 0.00 57.72 55.62 3k4w n HIS 269 Cb 0.31 0.00 -0.05 0.00 0.12 0.00 0.00 29.99 30.36 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 0.29 0.91 -1.39 0.00 -0.31 0.17 103.07 102.74 3k4w h GLY 270 Ca 0.00 -0.17 0.01 0.00 0.00 0.00 0.00 47.33 47.17 3k4w h GLY 270 CO 0.00 0.16 0.17 3.43 0.00 0.00 0.00 176.54 180.30 3k4w h ASN 271 N 0.10 0.27 -0.67 0.19 2.35 -0.94 -2.34 115.58 114.54 3k4w h ASN 271 Ca 0.06 0.01 -0.01 0.00 -0.55 0.00 0.00 56.30 55.80 3k4w h ASN 271 Cb 0.23 -0.05 -0.03 0.00 0.05 0.00 0.00 38.32 38.51 3k4w h ASN 271 CO -0.00 0.20 0.38 0.00 -1.65 0.00 0.00 177.43 176.35 3k4w h ALA 272 N 1.14 0.86 -0.97 -0.83 0.00 -1.67 -2.45 119.26 115.34 3k4w h ALA 272 Ca 0.12 -0.10 0.15 0.00 0.00 0.00 0.00 54.91 55.08 3k4w h ALA 272 Cb 0.01 -0.27 -0.09 0.00 0.00 0.00 0.00 17.79 17.44 3k4w h ALA 272 CO -0.06 0.37 0.61 0.93 0.00 0.00 0.00 179.25 181.10 3k4w h GLU 273 N 0.92 0.79 -0.15 0.00 5.08 -0.45 -0.34 114.58 120.43 3k4w h GLU 273 Ca 0.24 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.54 3k4w h GLU 273 Cb 0.03 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 29.09 3k4w h GLU 273 CO -0.04 0.52 0.05 -0.09 -1.00 0.00 0.00 179.01 178.45 3k4w h ARG 274 N 0.81 0.22 -0.79 2.33 2.43 -1.01 0.21 114.38 118.58 3k4w h ARG 274 Ca 0.51 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.62 3k4w h ARG 274 Cb 0.72 -0.03 -0.04 0.00 -0.42 0.00 0.00 29.97 30.20 3k4w h ARG 274 CO -0.28 0.34 0.44 -0.07 -1.51 0.00 0.00 179.97 178.88 3k4w h LEU 275 N 0.07 0.99 -0.97 3.80 3.38 -0.95 0.17 115.31 121.79 3k4w h LEU 275 Ca 0.05 -0.09 -0.03 0.00 0.09 0.00 0.00 57.88 57.89 3k4w h LEU 275 Cb 0.20 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.67 3k4w h LEU 275 CO -0.00 0.80 0.31 -0.07 0.09 0.00 0.00 178.44 179.56 3k4w h LEU 276 N 1.10 0.96 -0.23 1.67 3.38 -0.83 -1.43 115.31 119.93 3k4w h LEU 276 Ca 0.28 -0.13 -0.06 0.00 0.09 0.00 0.00 57.88 58.06 3k4w h LEU 276 Cb 0.02 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 3k4w h LEU 276 CO -0.05 0.84 -0.10 0.00 0.09 0.00 0.00 178.44 179.22 3k4w h ALA 277 N 1.31 0.33 -0.61 1.53 0.00 0.08 -2.49 119.26 119.39 3k4w h ALA 277 Ca 0.25 -0.29 0.12 0.00 0.00 0.00 0.00 54.91 54.98 3k4w h ALA 277 Cb 0.16 -0.08 -0.09 0.00 0.00 0.00 0.00 17.79 17.77 3k4w h ALA 277 CO -0.03 0.17 0.08 0.37 0.00 0.00 0.00 179.25 179.84 3k4w h GLN 278 N 0.20 0.19 -0.14 0.00 4.15 -0.39 -2.88 115.11 116.24 3k4w h GLN 278 Ca 0.05 -0.01 -0.12 0.00 0.77 0.00 0.00 58.65 59.34 3k4w h GLN 278 Cb 0.59 -0.04 -0.01 0.00 0.21 0.00 0.00 27.48 28.23 3k4w h GLN 278 CO 0.03 0.13 -0.45 0.00 -1.93 0.00 0.00 178.83 176.61 3k4w h ALA 279 N 1.52 0.97 0.00 3.38 0.00 -0.88 -0.79 119.26 123.46 3k4w h ALA 279 Ca 0.33 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.79 3k4w h ALA 279 Cb 0.51 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.21 3k4w h ALA 279 CO -0.46 0.63 0.00 0.41 0.00 0.00 0.00 179.25 179.83 3k4w n GLY 280 N -0.04 -0.02 3.59 0.00 0.00 -0.97 -4.85 105.19 102.88 3k4w n GLY 280 Ca -0.02 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 3k4w n GLY 280 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86