#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dkt h GLU 5 N 0.00 0.41 -0.08 0.03 5.08 -2.04 -3.36 114.58 114.62 3dkt h GLU 5 Ca 0.00 -0.28 -0.02 0.00 -1.00 0.00 0.00 59.36 58.06 3dkt h GLU 5 Cb 0.00 0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.29 3dkt h GLU 5 CO 0.00 0.88 -0.02 0.27 -1.00 0.00 0.00 179.01 179.14 3dkt h PHE 6 N 0.31 0.18 -1.18 4.33 -5.15 -2.03 -3.37 116.94 110.02 3dkt h PHE 6 Ca -0.00 -0.04 -0.50 0.00 -0.20 0.00 0.00 57.97 57.23 3dkt h PHE 6 Cb 1.12 -0.04 -0.02 0.00 0.22 0.00 0.00 35.95 37.23 3dkt h PHE 6 CO 0.04 0.49 1.64 1.28 -2.00 0.00 0.00 178.31 179.76 3dkt n LEU 7 N -4.78 1.86 -3.34 2.10 4.77 -1.26 -4.70 117.00 111.64 3dkt n LEU 7 Ca -0.07 -0.22 -0.39 0.00 -0.03 0.00 0.00 56.01 55.31 3dkt n LEU 7 Cb 0.24 -1.39 -0.03 0.00 -2.33 0.00 0.00 43.42 39.91 3dkt n LEU 7 CO 0.35 -1.24 3.29 0.29 -1.33 0.00 0.00 177.39 178.75 3dkt n LYS 8 N 8.79 3.79 0.16 3.23 5.02 -1.26 -4.54 118.16 133.35 3dkt n LYS 8 Ca 0.44 -2.35 0.01 0.00 -2.02 0.00 0.00 58.31 54.39 3dkt n LYS 8 Cb 0.38 -2.79 0.30 0.00 -0.02 0.00 0.00 35.03 32.91 3dkt n LYS 8 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 3dkt h ARG 9 N 4.98 0.05 0.00 1.97 3.08 -1.84 -2.56 114.38 120.06 3dkt h ARG 9 Ca 0.85 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.88 3dkt h ARG 9 Cb 0.29 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.34 3dkt h ARG 9 CO 1.76 0.46 0.00 0.66 -1.07 0.00 0.00 179.97 181.77 3dkt h SER 10 N 0.04 0.00 0.11 7.04 4.64 -1.93 -1.73 113.55 121.72 3dkt h SER 10 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 3dkt h SER 10 Cb 0.75 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.84 3dkt h SER 10 CO 0.06 0.00 -0.23 0.49 -0.87 0.00 0.00 176.83 176.27 3dkt n PHE 11 N -2.91 0.00 -2.82 4.77 3.01 -0.97 -4.87 117.46 113.68 3dkt n PHE 11 Ca -0.01 0.00 -0.40 0.00 1.01 0.00 0.00 57.45 58.05 3dkt n PHE 11 Cb 0.17 -0.06 -0.05 0.00 -0.01 0.00 0.00 39.48 39.53 3dkt n PHE 11 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 3dkt s ALA 12 N -2.35 3.32 -0.77 4.37 0.00 -0.65 -4.93 121.76 120.74 3dkt s ALA 12 Ca 0.26 0.50 -0.05 0.00 0.00 0.00 0.00 51.96 52.67 3dkt s ALA 12 Cb 0.19 -3.16 -0.06 0.00 0.00 0.00 0.00 23.12 20.09 3dkt s ALA 12 CO 0.48 0.10 2.09 -2.30 0.00 0.00 0.00 175.76 176.12 3dkt n PRO 13 N 2.30 1.89 -4.31 0.00 -0.02 -1.26 -4.84 135.00 128.75 3dkt n PRO 13 Ca -0.01 -1.31 -0.18 0.00 -2.02 0.00 0.00 63.50 59.98 3dkt n PRO 13 Cb 0.49 -2.35 -0.14 0.00 -0.02 0.00 0.00 33.50 31.48 3dkt n PRO 13 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3dkt s LEU 14 N 0.08 2.10 0.92 2.45 1.43 -1.26 -5.08 118.68 119.32 3dkt s LEU 14 Ca 0.38 -0.32 -0.14 0.00 -1.03 0.00 0.00 54.13 53.02 3dkt s LEU 14 Cb 0.11 -0.46 0.16 0.00 0.03 0.00 0.00 46.19 46.02 3dkt s LEU 14 CO -0.03 0.04 1.24 0.42 0.23 0.00 0.00 176.35 178.25 3dkt s THR 15 N -0.59 1.98 0.06 5.49 -4.23 -1.26 -4.79 115.64 112.30 3dkt s THR 15 Ca 0.01 0.00 -0.28 0.00 -1.18 0.00 0.00 61.69 60.24 3dkt s THR 15 Cb -0.06 -2.95 -0.14 0.00 1.34 0.00 0.00 72.50 70.70 3dkt s THR 15 CO 0.00 0.00 1.44 -0.33 -0.54 0.00 0.00 174.62 175.19 3dkt h GLU 16 N -1.48 -0.81 -0.78 3.99 4.39 -2.00 -1.01 114.58 116.87 3dkt h GLU 16 Ca -0.46 0.06 0.18 0.00 0.34 0.00 0.00 59.36 59.48 3dkt h GLU 16 Cb 1.28 0.18 -0.14 0.00 -0.10 0.00 0.00 28.75 29.98 3dkt h GLU 16 CO 0.50 -0.54 0.03 0.87 -1.16 0.00 0.00 179.01 178.71 3dkt h LYS 17 N -0.84 0.10 0.94 2.33 1.79 -1.99 -1.89 116.57 117.02 3dkt h LYS 17 Ca -0.06 -0.01 -0.04 0.00 -2.18 0.00 0.00 60.65 58.36 3dkt h LYS 17 Cb 0.71 -0.02 0.00 0.00 -1.58 0.00 0.00 32.23 31.34 3dkt h LYS 17 CO -0.01 0.07 -0.49 1.96 -1.08 0.00 0.00 179.45 179.90 3dkt h GLN 18 N 0.11 -1.26 -0.40 3.15 4.20 -1.89 -0.42 115.11 118.60 3dkt h GLN 18 Ca 0.44 0.09 0.08 0.00 0.06 0.00 0.00 58.65 59.31 3dkt h GLN 18 Cb 0.79 0.29 -0.09 0.00 0.30 0.00 0.00 27.48 28.76 3dkt h GLN 18 CO -0.68 -0.84 -0.30 -1.49 -0.67 0.00 0.00 178.83 174.85 3dkt h TRP 19 N -1.31 -0.82 0.00 2.96 -0.00 -0.59 -1.12 115.95 115.07 3dkt h TRP 19 Ca -0.13 0.06 0.00 0.00 -0.00 0.00 0.00 58.89 58.82 3dkt h TRP 19 Cb 1.02 0.42 0.00 0.00 -0.00 0.00 0.00 29.16 30.60 3dkt h TRP 19 CO -0.04 -0.36 0.00 -0.56 -0.00 0.00 0.00 178.44 177.47 3dkt h GLN 20 N -0.23 0.00 -0.10 0.49 3.07 -1.29 -0.88 115.11 116.17 3dkt h GLN 20 Ca 0.18 0.00 -0.23 0.00 0.09 0.00 0.00 58.65 58.69 3dkt h GLN 20 Cb 0.52 0.00 0.01 0.00 0.08 0.00 0.00 27.48 28.09 3dkt h GLN 20 CO -0.53 0.00 -0.85 1.49 0.09 0.00 0.00 178.83 179.03 3dkt h GLU 21 N 0.00 0.75 0.04 0.06 4.57 0.14 -2.04 114.58 118.09 3dkt h GLU 21 Ca 0.00 -0.68 -0.00 0.00 -1.18 0.00 0.00 59.36 57.50 3dkt h GLU 21 Cb 0.52 0.16 0.00 0.00 -0.16 0.00 0.00 28.75 29.27 3dkt h GLU 21 CO 0.00 1.27 -0.02 0.82 -1.18 0.00 0.00 179.01 179.90 3dkt h ILE 22 N 0.46 0.98 -0.52 2.32 2.04 -0.88 -2.81 117.51 119.09 3dkt h ILE 22 Ca -0.08 -0.05 0.07 0.00 1.00 0.00 0.00 64.86 65.80 3dkt h ILE 22 Cb 1.49 1.01 -0.06 0.00 -0.74 0.00 0.00 36.82 38.52 3dkt h ILE 22 CO 0.17 0.01 0.20 0.44 0.00 0.00 0.00 178.15 178.98 3dkt h ASP 23 N -0.07 0.22 -0.02 1.72 3.32 -1.17 -2.55 116.42 117.87 3dkt h ASP 23 Ca -0.01 0.06 -0.11 0.00 0.02 0.00 0.00 57.03 56.99 3dkt h ASP 23 Cb 0.06 0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.63 3dkt h ASP 23 CO 0.01 0.15 -0.34 0.78 -1.72 0.00 0.00 179.24 178.12 3dkt h ASN 24 N 0.39 0.52 -0.16 6.45 2.35 -1.36 -0.55 115.58 123.21 3dkt h ASN 24 Ca 0.25 -0.21 -0.01 0.00 -0.55 0.00 0.00 56.30 55.79 3dkt h ASN 24 Cb 0.26 -0.14 -0.01 0.00 0.05 0.00 0.00 38.32 38.48 3dkt h ASN 24 CO -0.24 0.82 0.08 -0.09 -1.65 0.00 0.00 177.43 176.35 3dkt h ARG 25 N 0.42 0.23 -0.67 0.81 9.65 -1.22 -1.67 114.38 121.94 3dkt h ARG 25 Ca 0.05 -0.04 -0.06 0.00 -1.10 0.00 0.00 59.98 58.83 3dkt h ARG 25 Cb 0.80 -0.04 -0.03 0.00 -1.39 0.00 0.00 29.97 29.31 3dkt h ARG 25 CO 0.06 0.28 0.17 0.00 2.80 0.00 0.00 179.97 183.28 3dkt h ALA 26 N 0.94 0.89 -0.91 2.80 0.00 -1.11 -2.77 119.26 119.10 3dkt h ALA 26 Ca 0.05 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.72 3dkt h ALA 26 Cb 0.13 -0.26 -0.04 0.00 0.00 0.00 0.00 17.79 17.61 3dkt h ALA 26 CO -0.01 0.60 0.56 -0.09 0.00 0.00 0.00 179.25 180.31 3dkt h ARG 27 N 1.00 1.23 -0.73 0.00 2.43 -0.98 -0.86 114.38 116.48 3dkt h ARG 27 Ca 0.21 -0.11 -0.03 0.00 -0.81 0.00 0.00 59.98 59.24 3dkt h ARG 27 Cb 0.36 -0.26 -0.03 0.00 -0.42 0.00 0.00 29.97 29.62 3dkt h ARG 27 CO 0.00 0.85 0.32 0.93 -1.51 0.00 0.00 179.97 180.57 3dkt h GLU 28 N 1.25 1.05 0.01 0.20 5.08 -1.02 -1.82 114.58 119.33 3dkt h GLU 28 Ca 0.33 -0.16 -0.00 0.00 -1.00 0.00 0.00 59.36 58.52 3dkt h GLU 28 Cb -0.07 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.00 3dkt h GLU 28 CO -0.06 0.83 -0.00 0.82 -1.00 0.00 0.00 179.01 179.60 3dkt h ILE 29 N 1.04 1.28 -0.94 3.13 2.04 -1.34 -3.28 117.51 119.45 3dkt h ILE 29 Ca 0.25 -1.93 0.24 0.00 1.00 0.00 0.00 64.86 64.41 3dkt h ILE 29 Cb 0.15 2.41 -0.06 0.00 -0.74 0.00 0.00 36.82 38.58 3dkt h ILE 29 CO -0.03 0.43 0.63 -0.26 0.00 0.00 0.00 178.15 178.93 3dkt h PHE 30 N -0.99 0.41 -0.89 1.37 0.05 -1.15 -1.58 116.94 114.16 3dkt h PHE 30 Ca -0.00 0.01 -0.01 0.00 3.82 0.00 0.00 57.97 61.79 3dkt h PHE 30 Cb 0.71 -0.12 -0.04 0.00 2.00 0.00 0.00 35.95 38.50 3dkt h PHE 30 CO 0.20 0.09 0.52 1.57 -0.18 0.00 0.00 178.31 180.50 3dkt h LYS 31 N 0.29 1.22 -0.16 1.51 2.10 -1.39 -2.65 116.57 117.49 3dkt h LYS 31 Ca 0.49 -0.12 0.00 0.00 -2.00 0.00 0.00 60.65 59.02 3dkt h LYS 31 Cb 1.42 -0.25 0.00 0.00 -0.90 0.00 0.00 32.23 32.50 3dkt h LYS 31 CO -0.15 0.87 0.00 0.25 -2.00 0.00 0.00 179.45 178.42 3dkt n THR 32 N -4.38 0.23 -0.04 0.07 -2.24 -0.67 -4.47 114.28 102.78 3dkt n THR 32 Ca 0.09 -0.62 0.00 0.00 -2.27 0.00 0.00 64.05 61.26 3dkt n THR 32 Cb 0.07 1.19 0.00 0.00 -2.10 0.00 0.00 70.33 69.49 3dkt n THR 32 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3dkt n GLN 33 N 1.13 2.13 -1.76 -0.78 1.13 -0.78 -4.66 117.38 113.79 3dkt n GLN 33 Ca 0.13 -0.28 -0.33 0.00 -1.94 0.00 0.00 57.00 54.59 3dkt n GLN 33 Cb 0.50 -0.76 -0.02 0.00 0.11 0.00 0.00 30.24 30.06 3dkt n GLN 33 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 3dkt n LEU 34 N -0.38 7.07 -0.45 1.08 4.77 -1.01 -4.69 117.00 123.39 3dkt n LEU 34 Ca 0.00 -4.48 0.38 0.00 -0.03 0.00 0.00 56.01 51.88 3dkt n LEU 34 Cb 0.01 -1.23 0.63 0.00 -2.33 0.00 0.00 43.42 40.50 3dkt n LEU 34 CO 0.00 1.84 1.14 -1.22 -1.33 0.00 0.00 177.39 177.82 3dkt n TYR 35 N 0.79 0.60 -0.13 -1.77 4.02 -1.26 0.13 117.16 119.54 3dkt n TYR 35 Ca 0.53 0.61 -0.05 0.00 -0.01 0.00 0.00 57.90 58.97 3dkt n TYR 35 Cb 0.41 -1.04 0.01 0.00 -0.02 0.00 0.00 39.34 38.71 3dkt n TYR 35 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 3dkt h GLY 36 N 0.00 0.12 2.00 2.72 0.00 -1.93 -2.58 103.07 103.40 3dkt h GLY 36 Ca 0.82 0.25 0.00 0.00 0.00 0.00 0.00 47.33 48.39 3dkt h GLY 36 CO -0.40 -0.20 0.00 0.54 0.00 0.00 0.00 176.54 176.48 3dkt n ARG 37 N -5.38 0.18 0.18 4.80 1.74 0.12 -3.00 116.66 115.30 3dkt n ARG 37 Ca 0.03 0.31 0.13 0.00 -0.77 0.00 0.00 57.85 57.55 3dkt n ARG 37 Cb 0.29 -1.78 0.63 0.00 -1.02 0.00 0.00 32.46 30.59 3dkt n ARG 37 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 3dkt h LYS 38 N 0.00 0.00 0.00 5.56 1.57 -1.52 -3.35 116.57 118.83 3dkt h LYS 38 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3dkt h LYS 38 Cb 0.47 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.78 3dkt h LYS 38 CO 0.00 0.00 0.00 1.97 -0.57 0.00 0.00 179.45 180.85 3dkt n PHE 39 N -2.45 0.00 -2.33 -1.35 1.16 -1.19 -5.08 117.46 106.22 3dkt n PHE 39 Ca 0.00 0.00 -0.26 0.00 -1.87 0.00 0.00 57.45 55.32 3dkt n PHE 39 Cb 0.15 0.00 0.05 0.00 -1.61 0.00 0.00 39.48 38.07 3dkt n PHE 39 CO 0.00 0.00 0.00 0.14 -1.87 0.00 0.00 176.76 175.03 3dkt s VAL 40 N 0.00 2.97 0.27 1.97 -7.23 -1.16 -4.80 120.40 112.42 3dkt s VAL 40 Ca 0.00 -0.17 0.06 0.00 -1.81 0.00 0.00 61.98 60.06 3dkt s VAL 40 Cb 0.00 -3.22 -0.03 0.00 0.56 0.00 0.00 36.38 33.70 3dkt s VAL 40 CO 0.00 -0.22 0.37 1.51 -0.31 0.00 0.00 175.10 176.45 3dkt s ASP 41 N -4.41 6.14 -0.06 4.85 1.47 -0.94 -4.80 116.67 118.92 3dkt s ASP 41 Ca 0.57 -0.04 0.02 0.00 1.18 0.00 0.00 52.55 54.28 3dkt s ASP 41 Cb -0.11 -1.64 -0.03 0.00 -0.34 0.00 0.00 42.92 40.81 3dkt s ASP 41 CO 0.44 -0.17 -0.10 -0.69 0.68 0.00 0.00 175.17 175.33 3dkt s VAL 42 N -2.05 3.42 -0.53 2.11 1.01 -1.26 -1.35 120.40 121.75 3dkt s VAL 42 Ca 0.37 -0.59 -0.14 0.00 0.00 0.00 0.00 61.98 61.63 3dkt s VAL 42 Cb -0.09 -2.37 0.13 0.00 0.00 0.00 0.00 36.38 34.05 3dkt s VAL 42 CO 0.29 0.59 0.46 -1.61 0.00 0.00 0.00 175.10 174.84 3dkt s GLU 43 N -0.76 2.84 0.07 2.72 2.02 -0.25 -4.95 118.70 120.39 3dkt s GLU 43 Ca 0.12 -1.76 -0.03 0.00 0.02 0.00 0.00 54.97 53.32 3dkt s GLU 43 Cb -0.11 -4.18 -0.03 0.00 0.10 0.00 0.00 34.13 29.91 3dkt s GLU 43 CO 0.01 -1.29 0.00 0.41 0.02 0.00 0.00 175.26 174.42 3dkt n GLY 44 N 5.09 -0.48 3.59 -1.39 0.00 -1.26 -3.16 105.19 107.57 3dkt n GLY 44 Ca -0.11 -0.01 -0.51 0.00 0.00 0.00 0.00 46.02 45.39 3dkt n GLY 44 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3dkt n PRO 45 N 0.23 1.50 0.10 1.61 -0.02 -1.26 -4.70 135.00 132.46 3dkt n PRO 45 Ca 0.02 0.50 0.13 0.00 -2.02 0.00 0.00 63.50 62.12 3dkt n PRO 45 Cb 0.07 -2.49 0.42 0.00 -0.02 0.00 0.00 33.50 31.49 3dkt n PRO 45 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 3dkt n TYR 46 N 7.95 0.88 0.00 6.00 4.02 -0.75 -4.95 117.16 130.31 3dkt n TYR 46 Ca 0.31 0.26 0.00 0.00 -0.01 0.00 0.00 57.90 58.46 3dkt n TYR 46 Cb 0.24 -0.93 0.00 0.00 -0.02 0.00 0.00 39.34 38.63 3dkt n TYR 46 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3dkt n GLY 47 N 1.22 3.50 0.34 2.72 0.00 0.19 -4.62 105.19 108.54 3dkt n GLY 47 Ca 0.05 -1.71 0.16 0.00 0.00 0.00 0.00 46.02 44.53 3dkt n GLY 47 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 173.32 173.07 3dkt h TRP 48 N 0.00 0.00 -0.00 1.61 -0.00 -1.95 -2.67 115.95 112.93 3dkt h TRP 48 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.89 58.89 3dkt h TRP 48 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 29.16 3dkt h TRP 48 CO 0.00 0.00 -0.54 -0.85 -0.00 0.00 0.00 178.44 177.05 3dkt n GLU 49 N -2.93 2.94 -1.62 2.65 0.28 -1.26 -4.85 120.64 115.86 3dkt n GLU 49 Ca -0.02 -0.06 -0.60 0.00 -0.16 0.00 0.00 57.16 56.32 3dkt n GLU 49 Cb 0.35 -1.07 -0.08 0.00 1.43 0.00 0.00 31.44 32.07 3dkt n GLU 49 CO 0.00 0.00 0.00 0.98 -0.16 0.00 0.00 177.13 177.95 3dkt n TYR 50 N -1.19 1.33 -0.05 -1.84 9.36 -1.01 -4.88 117.16 118.89 3dkt n TYR 50 Ca 0.03 0.91 -0.06 0.00 3.32 0.00 0.00 57.90 62.10 3dkt n TYR 50 Cb 0.19 -2.23 -0.07 0.00 -0.63 0.00 0.00 39.34 36.60 3dkt n TYR 50 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 3dkt n ALA 51 N 2.95 1.77 -3.32 2.98 0.00 -1.26 -4.91 120.51 118.72 3dkt n ALA 51 Ca 0.23 -0.58 -0.15 0.00 0.00 0.00 0.00 53.44 52.95 3dkt n ALA 51 Cb 0.07 0.10 -0.06 0.00 0.00 0.00 0.00 19.45 19.57 3dkt n ALA 51 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3dkt s ALA 52 N -2.23 -1.27 -0.24 0.00 0.00 -1.26 -1.64 121.76 115.13 3dkt s ALA 52 Ca -0.08 0.67 -0.10 0.00 0.00 0.00 0.00 51.96 52.45 3dkt s ALA 52 Cb 0.03 0.22 -0.05 0.00 0.00 0.00 0.00 23.12 23.32 3dkt s ALA 52 CO 0.35 -0.41 0.14 -1.58 0.00 0.00 0.00 175.76 174.26 3dkt s HIS 53 N -1.92 3.28 0.39 0.00 2.46 -1.19 -4.83 115.29 113.50 3dkt s HIS 53 Ca -0.08 0.15 -0.27 0.00 0.47 0.00 0.00 55.06 55.33 3dkt s HIS 53 Cb -0.01 -2.25 -0.09 0.00 -0.13 0.00 0.00 32.58 30.09 3dkt s HIS 53 CO 0.02 0.03 1.38 -2.14 -2.47 0.00 0.00 174.74 171.56 3dkt s PRO 54 N 1.05 4.01 -0.08 2.88 0.02 -1.26 -1.58 135.00 140.04 3dkt s PRO 54 Ca 0.07 2.33 0.21 0.00 0.02 0.00 0.00 61.00 63.62 3dkt s PRO 54 Cb -0.14 -2.85 -0.31 0.00 0.02 0.00 0.00 34.50 31.23 3dkt s PRO 54 CO 0.04 -0.52 0.35 1.28 -0.33 0.00 0.00 177.00 177.82 3dkt n LEU 55 N 0.26 0.01 -0.59 -5.54 4.77 -0.50 -4.86 117.00 110.55 3dkt n LEU 55 Ca 0.03 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.01 3dkt n LEU 55 Cb 0.42 0.16 0.00 0.00 -2.33 0.00 0.00 43.42 41.67 3dkt n LEU 55 CO 0.59 0.16 0.00 0.61 -1.33 0.00 0.00 177.39 177.42 3dkt n GLY 56 N 1.42 0.72 3.24 -0.72 0.00 -1.21 -5.04 105.19 103.60 3dkt n GLY 56 Ca -0.14 -0.47 -0.10 0.00 0.00 0.00 0.00 46.02 45.32 3dkt n GLY 56 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3dkt s GLU 57 N -3.52 1.09 0.20 1.61 2.02 -1.26 -5.03 118.70 113.81 3dkt s GLU 57 Ca 0.00 -1.41 0.08 0.00 0.02 0.00 0.00 54.97 53.65 3dkt s GLU 57 Cb 0.00 0.30 -0.04 0.00 0.10 0.00 0.00 34.13 34.49 3dkt s GLU 57 CO 0.00 -0.36 0.02 0.08 0.02 0.00 0.00 175.26 175.02 3dkt s VAL 58 N -4.06 3.72 -0.52 2.63 1.01 -1.26 -1.62 120.40 120.30 3dkt s VAL 58 Ca 0.26 -1.54 0.02 0.00 0.00 0.00 0.00 61.98 60.72 3dkt s VAL 58 Cb 0.06 -2.91 0.13 0.00 0.00 0.00 0.00 36.38 33.66 3dkt s VAL 58 CO 0.04 -0.19 0.28 -0.70 0.00 0.00 0.00 175.10 174.53 3dkt s GLU 59 N -3.20 2.09 0.29 2.72 2.56 0.17 -4.85 118.70 118.48 3dkt s GLU 59 Ca 0.29 -2.47 -0.28 0.00 0.00 0.00 0.00 54.97 52.51 3dkt s GLU 59 Cb -0.08 -3.44 -0.14 0.00 2.00 0.00 0.00 34.13 32.47 3dkt s GLU 59 CO 0.19 -1.11 1.05 0.28 -0.56 0.00 0.00 175.26 175.12 3dkt n VAL 60 N 3.43 1.97 -2.51 3.70 0.31 -1.26 -1.83 118.33 122.14 3dkt n VAL 60 Ca 0.05 -0.49 0.01 0.00 -0.01 0.00 0.00 64.34 63.90 3dkt n VAL 60 Cb 0.35 -1.08 0.02 0.00 -0.91 0.00 0.00 33.84 32.22 3dkt n VAL 60 CO 0.00 0.00 0.00 0.18 -1.32 0.00 0.00 176.83 175.69 3dkt n LEU 61 N 1.18 0.61 -3.84 7.52 4.32 0.30 -4.89 117.00 122.20 3dkt n LEU 61 Ca 0.09 -2.35 -0.12 0.00 -0.02 0.00 0.00 56.01 53.61 3dkt n LEU 61 Cb 0.32 0.13 -0.10 0.00 -1.62 0.00 0.00 43.42 42.15 3dkt n LEU 61 CO 0.60 0.89 -0.13 -0.94 -1.22 0.00 0.00 177.39 176.60 3dkt s SER 62 N -2.21 -0.06 0.84 -1.43 1.04 -1.24 -4.87 113.70 105.76 3dkt s SER 62 Ca 0.25 -0.04 -0.12 0.00 0.48 0.00 0.00 55.95 56.51 3dkt s SER 62 Cb 0.31 0.26 0.10 0.00 0.10 0.00 0.00 66.02 66.79 3dkt s SER 62 CO -0.11 -0.33 1.15 -1.81 0.98 0.00 0.00 173.24 173.12 3dkt s ASP 63 N -1.12 4.20 0.00 7.02 1.11 -1.26 -4.92 116.67 121.71 3dkt s ASP 63 Ca -0.12 0.91 0.29 0.00 0.18 0.00 0.00 52.55 53.81 3dkt s ASP 63 Cb -0.06 -1.47 1.70 0.00 1.07 0.00 0.00 42.92 44.15 3dkt s ASP 63 CO 0.02 -2.11 2.07 -0.62 1.18 0.00 0.00 175.17 175.71 3dkt n GLU 64 N -3.47 0.83 0.17 8.23 4.71 -1.26 -2.82 120.64 127.04 3dkt n GLU 64 Ca 0.07 0.00 0.03 0.00 -0.01 0.00 0.00 57.16 57.25 3dkt n GLU 64 Cb 0.60 -1.50 0.31 0.00 -1.01 0.00 0.00 31.44 29.84 3dkt n GLU 64 CO 0.00 0.00 0.00 -0.91 0.09 0.00 0.00 177.13 176.31 3dkt h ASN 65 N 0.00 0.00 -3.47 1.62 2.35 -2.03 -3.43 115.58 110.61 3dkt h ASN 65 Ca 0.00 0.00 -0.52 0.00 -0.55 0.00 0.00 56.30 55.23 3dkt h ASN 65 Cb 0.04 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.40 3dkt h ASN 65 CO 0.00 0.44 -0.05 -1.61 -1.65 0.00 0.00 177.43 174.56 3dkt s GLU 66 N -3.83 3.79 -0.20 0.81 2.02 -1.13 -5.02 118.70 115.14 3dkt s GLU 66 Ca -0.01 0.30 -0.19 0.00 0.02 0.00 0.00 54.97 55.08 3dkt s GLU 66 Cb 0.13 -2.57 -0.20 0.00 0.10 0.00 0.00 34.13 31.59 3dkt s GLU 66 CO 0.72 0.20 0.21 1.55 0.02 0.00 0.00 175.26 177.96 3dkt n VAL 67 N -0.58 1.57 -2.64 2.63 3.14 -1.26 -4.55 118.33 116.64 3dkt n VAL 67 Ca 0.01 -0.12 -0.42 0.00 -2.96 0.00 0.00 64.34 60.84 3dkt n VAL 67 Cb 0.53 -2.00 -0.02 0.00 -1.06 0.00 0.00 33.84 31.30 3dkt n VAL 67 CO 0.00 0.00 0.00 0.68 -6.46 0.00 0.00 176.83 171.05 3dkt s VAL 68 N -2.39 4.16 0.54 1.55 -7.23 -1.26 -5.00 120.40 110.76 3dkt s VAL 68 Ca -0.28 -1.38 -0.18 0.00 -1.81 0.00 0.00 61.98 58.33 3dkt s VAL 68 Cb 0.06 -5.07 -0.06 0.00 0.56 0.00 0.00 36.38 31.88 3dkt s VAL 68 CO 0.61 -1.90 1.06 -0.54 -0.31 0.00 0.00 175.10 174.02 3dkt s LYS 69 N 4.23 3.54 0.14 4.82 -0.14 -1.26 -5.03 119.74 126.03 3dkt s LYS 69 Ca 0.47 1.31 -0.25 0.00 -1.36 0.00 0.00 55.97 56.14 3dkt s LYS 69 Cb 0.01 -2.06 0.07 0.00 -1.68 0.00 0.00 37.83 34.17 3dkt s LYS 69 CO -0.03 -0.64 1.00 1.67 -0.76 0.00 0.00 175.35 176.58 3dkt s TRP 70 N -2.17 -0.11 0.11 3.18 1.48 -1.26 -5.08 118.94 115.09 3dkt s TRP 70 Ca 0.66 -0.18 -0.05 0.00 -1.06 0.00 0.00 56.10 55.48 3dkt s TRP 70 Cb -0.17 0.63 0.02 0.00 -1.16 0.00 0.00 33.47 32.79 3dkt s TRP 70 CO 0.28 -0.78 0.25 0.41 -4.06 0.00 0.00 176.95 173.06 3dkt n GLY 71 N -0.48 1.60 3.64 3.67 0.00 -1.26 -0.54 105.19 111.82 3dkt n GLY 71 Ca -0.06 -1.07 -0.24 0.00 0.00 0.00 0.00 46.02 44.64 3dkt n GLY 71 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dkt s LEU 72 N 0.00 3.20 -0.36 0.99 1.02 -0.76 -4.79 118.68 117.97 3dkt s LEU 72 Ca 0.05 -0.57 -0.17 0.00 0.02 0.00 0.00 54.13 53.47 3dkt s LEU 72 Cb -0.01 -1.78 -0.00 0.00 0.02 0.00 0.00 46.19 44.42 3dkt s LEU 72 CO 0.03 0.04 0.43 -0.60 0.02 0.00 0.00 176.35 176.26 3dkt s ARG 73 N -3.38 3.48 0.11 1.70 6.06 -1.26 0.41 118.95 126.07 3dkt s ARG 73 Ca 0.29 -0.41 -0.31 0.00 -2.50 0.00 0.00 55.73 52.80 3dkt s ARG 73 Cb -0.07 -3.84 -0.10 0.00 0.06 0.00 0.00 34.95 30.99 3dkt s ARG 73 CO 0.19 -0.63 1.82 0.15 -2.50 0.00 0.00 175.30 174.33 3dkt s LYS 74 N 2.16 4.14 0.46 5.12 1.02 -0.64 -4.94 119.74 127.06 3dkt s LYS 74 Ca 0.14 2.58 0.02 0.00 0.02 0.00 0.00 55.97 58.72 3dkt s LYS 74 Cb -0.16 -3.63 -0.01 0.00 -0.52 0.00 0.00 37.83 33.51 3dkt s LYS 74 CO 0.13 -0.84 0.06 -1.13 -0.92 0.00 0.00 175.35 172.65 3dkt n SER 75 N 5.78 2.45 -3.37 2.83 3.41 -1.26 -1.42 113.62 122.04 3dkt n SER 75 Ca 0.18 -3.18 -0.27 0.00 -0.26 0.00 0.00 58.87 55.34 3dkt n SER 75 Cb 0.38 0.64 -0.10 0.00 -0.26 0.00 0.00 64.21 64.88 3dkt n SER 75 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 3dkt n LEU 76 N 0.00 -0.30 -4.44 1.04 0.00 -0.62 -4.77 117.00 107.91 3dkt n LEU 76 Ca -0.14 -4.44 -0.49 0.00 0.00 0.00 0.00 56.01 50.94 3dkt n LEU 76 Cb 0.62 0.53 -0.03 0.00 0.00 0.00 0.00 43.42 44.54 3dkt n LEU 76 CO 0.33 1.89 0.15 -0.81 0.00 0.00 0.00 177.39 178.95 3dkt n PRO 77 N 2.61 0.22 -3.25 1.96 -0.04 -1.26 -3.18 135.00 132.07 3dkt n PRO 77 Ca 0.29 0.08 -0.34 0.00 -0.04 0.00 0.00 63.50 63.49 3dkt n PRO 77 Cb 0.48 -1.20 -0.06 0.00 -0.04 0.00 0.00 33.50 32.69 3dkt n PRO 77 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 3dkt s LEU 78 N 2.28 4.22 0.03 1.53 1.43 -0.65 -4.86 118.68 122.67 3dkt s LEU 78 Ca 0.66 1.18 -0.30 0.00 -1.03 0.00 0.00 54.13 54.64 3dkt s LEU 78 Cb -0.93 -3.67 -0.04 0.00 0.03 0.00 0.00 46.19 41.58 3dkt s LEU 78 CO 0.56 -0.04 0.96 -0.63 0.23 0.00 0.00 176.35 177.43 3dkt s ILE 79 N -1.71 4.76 -0.16 -0.59 1.09 0.94 -4.81 121.20 120.72 3dkt s ILE 79 Ca 0.46 2.03 -0.08 0.00 -1.10 0.00 0.00 60.65 61.96 3dkt s ILE 79 Cb -0.13 -4.31 -0.04 0.00 -1.06 0.00 0.00 42.46 36.92 3dkt s ILE 79 CO 0.19 0.21 0.12 -0.70 -0.10 0.00 0.00 174.94 174.67 3dkt s GLU 80 N 0.67 3.82 0.23 2.79 2.12 -1.26 -1.78 118.70 125.30 3dkt s GLU 80 Ca 0.50 -0.21 0.11 0.00 0.36 0.00 0.00 54.97 55.73 3dkt s GLU 80 Cb -0.22 -3.28 -0.05 0.00 0.26 0.00 0.00 34.13 30.85 3dkt s GLU 80 CO 0.28 0.50 -0.17 -0.48 -0.54 0.00 0.00 175.26 174.85 3dkt s LEU 81 N -0.24 2.67 -0.29 2.70 2.34 -1.04 -5.01 118.68 119.81 3dkt s LEU 81 Ca 0.10 -0.86 0.03 0.00 0.06 0.00 0.00 54.13 53.46 3dkt s LEU 81 Cb -0.12 -1.29 0.16 0.00 -0.56 0.00 0.00 46.19 44.39 3dkt s LEU 81 CO 0.01 0.07 0.43 -0.60 -1.06 0.00 0.00 176.35 175.20 3dkt s ARG 82 N -3.15 0.44 -0.44 1.48 6.06 -1.26 -3.32 118.95 118.77 3dkt s ARG 82 Ca 0.26 0.15 -0.07 0.00 -2.50 0.00 0.00 55.73 53.57 3dkt s ARG 82 Cb -0.07 -0.25 0.10 0.00 0.06 0.00 0.00 34.95 34.80 3dkt s ARG 82 CO 0.14 -1.04 0.28 0.00 -2.50 0.00 0.00 175.30 172.17 3dkt s ALA 83 N 2.54 3.29 0.58 6.12 0.00 -0.97 -4.90 121.76 128.41 3dkt s ALA 83 Ca 0.10 -2.41 -0.14 0.00 0.00 0.00 0.00 51.96 49.51 3dkt s ALA 83 Cb -0.12 -2.65 -0.05 0.00 0.00 0.00 0.00 23.12 20.29 3dkt s ALA 83 CO -0.29 -1.79 1.01 0.95 0.00 0.00 0.00 175.76 175.64 3dkt s THR 84 N 1.32 4.56 0.20 0.00 -4.23 -1.26 -2.12 115.64 114.11 3dkt s THR 84 Ca 0.05 1.02 -0.21 0.00 -1.18 0.00 0.00 61.69 61.37 3dkt s THR 84 Cb -0.24 -3.76 0.05 0.00 1.34 0.00 0.00 72.50 69.88 3dkt s THR 84 CO -0.01 -0.91 0.60 0.72 -0.54 0.00 0.00 174.62 174.49 3dkt s PHE 85 N -2.90 -0.35 0.01 3.99 -0.12 -0.72 -4.97 117.98 112.92 3dkt s PHE 85 Ca 0.57 0.04 0.08 0.00 -0.05 0.00 0.00 56.93 57.58 3dkt s PHE 85 Cb -0.11 0.55 -0.02 0.00 -0.63 0.00 0.00 43.02 42.81 3dkt s PHE 85 CO 0.43 -0.96 -0.26 0.95 -0.05 0.00 0.00 175.22 175.34 3dkt s THR 86 N -3.82 2.10 -0.00 -4.49 -4.23 -1.26 -2.20 115.64 101.73 3dkt s THR 86 Ca 0.05 -1.22 0.05 0.00 -1.18 0.00 0.00 61.69 59.39 3dkt s THR 86 Cb -0.02 -1.76 -0.01 0.00 1.34 0.00 0.00 72.50 72.05 3dkt s THR 86 CO -0.06 0.50 -0.14 -0.76 -0.54 0.00 0.00 174.62 173.62 3dkt s LEU 87 N -0.86 2.05 -0.28 4.79 1.43 -0.58 -4.74 118.68 120.50 3dkt s LEU 87 Ca 0.11 -0.29 -0.29 0.00 -1.03 0.00 0.00 54.13 52.63 3dkt s LEU 87 Cb -0.10 -0.72 0.01 0.00 0.03 0.00 0.00 46.19 45.40 3dkt s LEU 87 CO 0.00 0.16 1.19 -0.62 0.23 0.00 0.00 176.35 177.31 3dkt s ASP 88 N -0.46 6.84 0.05 2.29 3.68 -1.26 -1.02 116.67 126.79 3dkt s ASP 88 Ca 0.05 1.24 -0.35 0.00 2.13 0.00 0.00 52.55 55.62 3dkt s ASP 88 Cb -0.06 -2.54 -0.20 0.00 -1.45 0.00 0.00 42.92 38.68 3dkt s ASP 88 CO -0.00 -0.93 1.47 0.25 0.13 0.00 0.00 175.17 176.09 3dkt h LEU 89 N 10.30 -1.06 0.00 -1.34 5.85 -1.83 -2.13 115.31 125.10 3dkt h LEU 89 Ca -0.24 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.52 3dkt h LEU 89 Cb 1.08 0.27 0.00 0.00 0.37 0.00 0.00 40.66 42.39 3dkt h LEU 89 CO 1.02 -0.72 0.00 1.87 -0.34 0.00 0.00 178.44 180.27 3dkt n TRP 90 N -5.61 0.00 -0.12 1.25 -0.00 -1.26 -1.01 117.44 110.69 3dkt n TRP 90 Ca -0.16 0.00 -0.19 0.00 -0.00 0.00 0.00 57.50 57.15 3dkt n TRP 90 Cb 0.49 0.00 -0.10 0.00 -0.00 0.00 0.00 31.31 31.70 3dkt n TRP 90 CO 0.00 0.00 0.00 -1.91 -0.00 0.00 0.00 177.69 175.78 3dkt n GLU 91 N -0.83 0.57 0.10 5.87 4.07 -0.84 -4.25 120.64 125.33 3dkt n GLU 91 Ca 0.00 0.16 0.01 0.00 -0.06 0.00 0.00 57.16 57.27 3dkt n GLU 91 Cb 0.00 -1.44 0.32 0.00 -0.06 0.00 0.00 31.44 30.26 3dkt n GLU 91 CO 0.00 0.00 0.00 -0.07 -0.06 0.00 0.00 177.13 177.00 3dkt h LEU 92 N -0.24 0.25 -1.62 4.31 3.38 -0.63 -0.43 115.31 120.34 3dkt h LEU 92 Ca -0.55 -0.07 0.31 0.00 0.09 0.00 0.00 57.88 57.66 3dkt h LEU 92 Cb 1.74 -0.07 -0.08 0.00 0.09 0.00 0.00 40.66 42.34 3dkt h LEU 92 CO -0.16 0.49 0.76 0.44 0.09 0.00 0.00 178.44 180.05 3dkt h ASP 93 N 0.24 0.25 0.43 -0.43 3.32 -1.47 0.14 116.42 118.91 3dkt h ASP 93 Ca 0.04 0.05 -0.03 0.00 0.02 0.00 0.00 57.03 57.12 3dkt h ASP 93 Cb 0.53 0.02 -0.00 0.00 0.22 0.00 0.00 39.33 40.09 3dkt h ASP 93 CO 0.04 0.03 -0.14 0.78 -1.72 0.00 0.00 179.24 178.23 3dkt h ASN 94 N 0.21 0.00 -0.64 6.45 2.35 -1.24 -1.96 115.58 120.75 3dkt h ASN 94 Ca 0.60 0.00 0.08 0.00 -0.55 0.00 0.00 56.30 56.43 3dkt h ASN 94 Cb 1.89 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 40.20 3dkt h ASN 94 CO -0.19 0.14 0.31 0.25 -1.65 0.00 0.00 177.43 176.28 3dkt h LEU 95 N 0.00 0.40 -1.17 1.61 5.85 -0.78 -1.61 115.31 119.60 3dkt h LEU 95 Ca -0.00 0.05 -0.08 0.00 0.84 0.00 0.00 57.88 58.69 3dkt h LEU 95 Cb 0.39 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.39 3dkt h LEU 95 CO 0.02 0.25 -0.40 -0.08 -0.34 0.00 0.00 178.44 177.88 3dkt h GLU 96 N 0.55 0.00 0.00 1.25 4.57 -1.47 -2.40 114.58 117.08 3dkt h GLU 96 Ca 0.30 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.48 3dkt h GLU 96 Cb 0.29 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.88 3dkt h GLU 96 CO -0.24 0.40 0.00 0.54 -1.18 0.00 0.00 179.01 178.54 3dkt n ARG 97 N -3.95 0.18 0.00 1.92 1.74 -0.75 -4.87 116.66 110.93 3dkt n ARG 97 Ca -0.02 0.38 0.00 0.00 -0.77 0.00 0.00 57.85 57.44 3dkt n ARG 97 Cb 0.45 -1.82 0.00 0.00 -1.02 0.00 0.00 32.46 30.06 3dkt n ARG 97 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3dkt n GLY 98 N 0.17 1.08 3.68 -0.13 0.00 -0.90 -5.10 105.19 103.99 3dkt n GLY 98 Ca 0.03 0.00 -0.55 0.00 0.00 0.00 0.00 46.02 45.49 3dkt n GLY 98 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 3dkt n LYS 99 N 0.00 1.33 0.26 1.61 4.81 -0.68 -4.91 118.16 120.58 3dkt n LYS 99 Ca 0.00 0.48 -0.11 0.00 -0.87 0.00 0.00 58.31 57.82 3dkt n LYS 99 Cb 0.00 -2.23 -0.05 0.00 0.02 0.00 0.00 35.03 32.77 3dkt n LYS 99 CO 0.00 0.00 0.00 -1.35 1.17 0.00 0.00 177.40 177.22 3dkt h PRO 100 N 7.99 -0.67 -5.14 1.64 0.11 -1.89 -3.40 132.00 130.65 3dkt h PRO 100 Ca -0.45 0.05 -0.64 0.00 0.11 0.00 0.00 66.00 65.06 3dkt h PRO 100 Cb 1.31 0.15 -0.15 0.00 0.11 0.00 0.00 31.00 32.42 3dkt h PRO 100 CO 0.97 -0.45 -0.17 0.54 -0.21 0.00 0.00 178.00 178.68 3dkt s ASN 101 N -3.77 6.27 -0.03 -2.05 4.22 -1.26 -5.06 114.94 113.26 3dkt s ASN 101 Ca -0.10 0.07 -0.05 0.00 -2.14 0.00 0.00 52.86 50.64 3dkt s ASN 101 Cb 0.01 -2.23 -0.04 0.00 1.28 0.00 0.00 41.25 40.27 3dkt s ASN 101 CO 0.30 -0.32 0.20 -0.69 -2.04 0.00 0.00 177.10 174.55 3dkt s VAL 102 N 2.18 5.41 -0.91 3.54 1.01 -1.26 -5.01 120.40 125.36 3dkt s VAL 102 Ca 0.16 0.04 -0.24 0.00 0.00 0.00 0.00 61.98 61.93 3dkt s VAL 102 Cb -0.16 -3.52 -0.00 0.00 0.00 0.00 0.00 36.38 32.70 3dkt s VAL 102 CO 0.11 0.41 1.70 -0.62 0.00 0.00 0.00 175.10 176.70 3dkt s ASP 103 N -1.64 5.76 -0.51 3.32 2.15 -1.26 -4.77 116.67 119.72 3dkt s ASP 103 Ca 0.24 -0.86 0.06 0.00 0.43 0.00 0.00 52.55 52.43 3dkt s ASP 103 Cb -0.13 -2.56 0.37 0.00 -0.30 0.00 0.00 42.92 40.30 3dkt s ASP 103 CO 0.14 -2.17 0.98 0.00 -0.17 0.00 0.00 175.17 173.96 3dkt n LEU 104 N 11.55 4.14 0.12 -1.34 -0.00 -1.26 -4.74 117.00 125.47 3dkt n LEU 104 Ca 0.33 -5.40 -0.02 0.00 -0.00 0.00 0.00 56.01 50.92 3dkt n LEU 104 Cb 0.49 -0.38 0.11 0.00 -0.00 0.00 0.00 43.42 43.64 3dkt n LEU 104 CO 0.64 2.28 0.43 0.77 -0.00 0.00 0.00 177.39 181.51 3dkt h SER 105 N 2.86 0.00 -1.00 1.45 4.64 -1.97 -2.80 113.55 116.72 3dkt h SER 105 Ca 0.17 0.00 0.20 0.00 -0.47 0.00 0.00 61.79 61.69 3dkt h SER 105 Cb 0.70 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 62.69 3dkt h SER 105 CO 0.79 0.68 0.61 -1.28 -0.87 0.00 0.00 176.83 176.76 3dkt h SER 106 N 0.00 0.73 0.07 4.97 0.87 -1.85 -2.15 113.55 116.18 3dkt h SER 106 Ca -0.01 0.09 -0.13 0.00 -1.23 0.00 0.00 61.79 60.51 3dkt h SER 106 Cb 1.24 -0.04 0.01 0.00 -0.44 0.00 0.00 62.40 63.18 3dkt h SER 106 CO 0.09 0.25 -0.55 0.25 -0.53 0.00 0.00 176.83 176.35 3dkt h LEU 107 N 0.71 0.36 -0.77 2.23 5.85 -1.82 -3.20 115.31 118.66 3dkt h LEU 107 Ca 0.57 -0.89 0.17 0.00 0.84 0.00 0.00 57.88 58.57 3dkt h LEU 107 Cb 0.97 -0.12 -0.14 0.00 0.37 0.00 0.00 40.66 41.74 3dkt h LEU 107 CO -0.36 1.22 -0.08 -0.33 -0.34 0.00 0.00 178.44 178.56 3dkt h GLU 108 N -0.44 0.05 0.33 1.25 5.08 -1.14 -0.07 114.58 119.64 3dkt h GLU 108 Ca -0.09 -0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.25 3dkt h GLU 108 Cb 1.37 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.61 3dkt h GLU 108 CO 0.10 0.03 -0.16 0.93 -1.00 0.00 0.00 179.01 178.92 3dkt h GLU 109 N 0.05 -0.43 -0.87 2.33 5.08 -1.57 -2.26 114.58 116.91 3dkt h GLU 109 Ca 0.40 0.03 0.17 0.00 -1.00 0.00 0.00 59.36 58.96 3dkt h GLU 109 Cb 0.69 0.10 -0.10 0.00 0.50 0.00 0.00 28.75 29.93 3dkt h GLU 109 CO -0.73 -0.17 0.43 1.15 -1.00 0.00 0.00 179.01 178.69 3dkt h THR 110 N -0.63 0.65 -0.04 1.13 2.02 -1.33 0.11 112.91 114.83 3dkt h THR 110 Ca -0.05 -0.19 0.01 0.00 0.77 0.00 0.00 66.41 66.96 3dkt h THR 110 Cb 0.45 0.04 -0.02 0.00 -1.74 0.00 0.00 68.15 66.89 3dkt h THR 110 CO 0.07 0.10 -0.05 0.58 0.37 0.00 0.00 175.52 176.60 3dkt h VAL 111 N 0.56 0.87 -0.40 3.16 2.07 -0.86 -1.38 116.25 120.27 3dkt h VAL 111 Ca 0.50 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 68.01 3dkt h VAL 111 Cb 0.79 0.87 -0.02 0.00 -1.52 0.00 0.00 31.29 31.40 3dkt h VAL 111 CO -0.41 0.00 0.23 0.03 0.02 0.00 0.00 177.57 177.44 3dkt h ARG 112 N -0.06 0.53 -0.27 1.57 3.08 -0.28 0.16 114.38 119.12 3dkt h ARG 112 Ca 0.03 -0.04 -0.17 0.00 0.07 0.00 0.00 59.98 59.87 3dkt h ARG 112 Cb 0.11 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.05 3dkt h ARG 112 CO -0.08 0.38 -0.51 0.87 -1.07 0.00 0.00 179.97 179.57 3dkt h LYS 113 N 0.54 0.82 -0.42 0.04 1.79 -0.46 0.37 116.57 119.24 3dkt h LYS 113 Ca 0.14 -0.52 0.00 0.00 -2.18 0.00 0.00 60.65 58.10 3dkt h LYS 113 Cb -0.01 0.06 -0.02 0.00 -1.58 0.00 0.00 32.23 30.68 3dkt h LYS 113 CO -0.03 1.15 0.28 0.28 -1.08 0.00 0.00 179.45 180.05 3dkt h VAL 114 N 0.58 1.11 -0.12 0.50 2.07 -0.67 -1.30 116.25 118.42 3dkt h VAL 114 Ca 0.01 -0.20 0.05 0.00 0.82 0.00 0.00 66.70 67.38 3dkt h VAL 114 Cb 1.11 0.49 -0.06 0.00 -1.52 0.00 0.00 31.29 31.31 3dkt h VAL 114 CO 0.11 0.10 -0.27 0.00 0.02 0.00 0.00 177.57 177.54 3dkt h ALA 115 N 1.15 -0.28 -0.79 1.67 0.00 -0.60 -1.42 119.26 118.99 3dkt h ALA 115 Ca 0.15 0.03 0.15 0.00 0.00 0.00 0.00 54.91 55.24 3dkt h ALA 115 Cb -0.07 0.51 -0.10 0.00 0.00 0.00 0.00 17.79 18.14 3dkt h ALA 115 CO -0.03 -0.74 0.36 0.93 0.00 0.00 0.00 179.25 179.76 3dkt h GLU 116 N -0.35 0.49 0.38 0.00 5.08 -0.71 -2.07 114.58 117.40 3dkt h GLU 116 Ca 0.10 -0.03 -0.00 0.00 -1.00 0.00 0.00 59.36 58.42 3dkt h GLU 116 Cb 0.49 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.60 3dkt h GLU 116 CO -0.32 0.33 -0.43 0.35 -1.00 0.00 0.00 179.01 177.94 3dkt h PHE 117 N 0.51 -1.18 -0.16 4.33 3.57 -0.19 -1.22 116.94 122.60 3dkt h PHE 117 Ca 0.44 0.01 0.03 0.00 3.53 0.00 0.00 57.97 61.98 3dkt h PHE 117 Cb 0.66 0.47 -0.02 0.00 2.79 0.00 0.00 35.95 39.84 3dkt h PHE 117 CO -0.14 -0.58 -0.00 1.49 -2.23 0.00 0.00 178.31 176.85 3dkt h GLU 118 N -0.84 0.05 -0.96 1.11 4.81 -0.75 -1.45 114.58 116.55 3dkt h GLU 118 Ca -0.03 -0.00 0.10 0.00 -0.13 0.00 0.00 59.36 59.30 3dkt h GLU 118 Cb 0.76 -0.01 -0.08 0.00 0.63 0.00 0.00 28.75 30.05 3dkt h GLU 118 CO -0.10 0.03 0.60 -0.44 -0.73 0.00 0.00 179.01 178.38 3dkt h ASP 119 N 0.05 0.89 -0.72 1.04 3.32 -1.31 0.94 116.42 120.63 3dkt h ASP 119 Ca 0.07 0.04 0.14 0.00 0.02 0.00 0.00 57.03 57.30 3dkt h ASP 119 Cb 0.09 -0.14 -0.09 0.00 0.22 0.00 0.00 39.33 39.41 3dkt h ASP 119 CO -0.13 0.50 0.27 -0.33 -1.72 0.00 0.00 179.24 177.83 3dkt h GLU 120 N 0.98 0.40 0.00 3.56 4.39 -0.15 0.22 114.58 123.98 3dkt h GLU 120 Ca 0.46 -0.02 -0.16 0.00 0.34 0.00 0.00 59.36 59.98 3dkt h GLU 120 Cb 0.40 -0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 28.94 3dkt h GLU 120 CO -0.24 0.26 -0.74 0.28 -1.16 0.00 0.00 179.01 177.41 3dkt h VAL 121 N 0.41 1.52 -0.01 3.13 2.07 -0.41 0.11 116.25 123.07 3dkt h VAL 121 Ca 0.39 -2.54 -0.18 0.00 0.82 0.00 0.00 66.70 65.19 3dkt h VAL 121 Cb 0.59 2.38 -0.01 0.00 -1.52 0.00 0.00 31.29 32.72 3dkt h VAL 121 CO -0.40 0.72 -0.80 0.40 0.02 0.00 0.00 177.57 177.51 3dkt h ILE 122 N 0.00 1.48 0.00 4.57 2.04 -0.57 -2.69 117.51 122.34 3dkt h ILE 122 Ca -0.01 -2.48 -0.27 0.00 1.00 0.00 0.00 64.86 63.10 3dkt h ILE 122 Cb 1.32 2.36 -0.05 0.00 -0.74 0.00 0.00 36.82 39.71 3dkt h ILE 122 CO 0.10 0.72 -1.97 0.49 0.00 0.00 0.00 178.15 177.49 3dkt n PHE 123 N -3.70 0.47 -0.00 1.37 3.01 0.72 -2.00 117.46 117.33 3dkt n PHE 123 Ca -0.03 0.17 0.00 0.00 1.01 0.00 0.00 57.45 58.60 3dkt n PHE 123 Cb 0.76 -1.02 0.00 0.00 -0.01 0.00 0.00 39.48 39.21 3dkt n PHE 123 CO 0.00 0.00 0.00 2.89 1.01 0.00 0.00 176.76 180.66 3dkt n ARG 124 N -2.81 3.85 -0.09 -1.08 1.85 0.27 -1.65 116.66 116.99 3dkt n ARG 124 Ca -0.21 0.00 0.01 0.00 -1.00 0.00 0.00 57.85 56.65 3dkt n ARG 124 Cb 1.01 -0.32 -0.01 0.00 -1.05 0.00 0.00 32.46 32.09 3dkt n ARG 124 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 3dkt n GLY 125 N 0.00 -2.65 3.65 2.89 0.00 -0.52 -2.79 105.19 105.78 3dkt n GLY 125 Ca 0.00 -1.42 -0.38 0.00 0.00 0.00 0.00 46.02 44.22 3dkt n GLY 125 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dkt h GLU 127 N 7.58 0.05 0.00 0.00 5.08 -1.88 -2.76 114.58 122.66 3dkt h GLU 127 Ca -0.36 -0.02 -0.04 0.00 -1.00 0.00 0.00 59.36 57.94 3dkt h GLU 127 Cb 1.17 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.41 3dkt h GLU 127 CO 0.68 0.40 -0.21 0.87 -1.00 0.00 0.00 179.01 179.74 3dkt h LYS 128 N 0.05 0.00 0.00 2.33 1.57 -1.94 -2.97 116.57 115.61 3dkt h LYS 128 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 3dkt h LYS 128 Cb 0.65 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.96 3dkt h LYS 128 CO 0.05 0.21 -1.42 -1.13 -0.57 0.00 0.00 179.45 176.59 3dkt n SER 129 N -4.17 0.44 0.00 0.86 3.41 -1.08 -4.98 113.62 108.10 3dkt n SER 129 Ca -0.02 -0.07 0.00 0.00 -0.26 0.00 0.00 58.87 58.52 3dkt n SER 129 Cb 0.28 1.23 0.00 0.00 -0.26 0.00 0.00 64.21 65.46 3dkt n SER 129 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3dkt n GLY 130 N 1.29 1.04 3.46 5.00 0.00 -1.06 -4.53 105.19 110.40 3dkt n GLY 130 Ca -0.01 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.64 3dkt n GLY 130 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dkt s VAL 131 N -2.00 4.44 -0.33 1.61 0.11 -1.09 -5.05 120.40 118.09 3dkt s VAL 131 Ca 0.00 -0.14 -0.24 0.00 -2.93 0.00 0.00 61.98 58.66 3dkt s VAL 131 Cb 0.00 -3.09 0.01 0.00 -1.53 0.00 0.00 36.38 31.77 3dkt s VAL 131 CO 0.00 0.32 0.85 -0.75 -3.33 0.00 0.00 175.10 172.19 3dkt s LYS 132 N 1.63 3.90 1.40 1.54 2.20 -1.26 -3.50 119.74 125.64 3dkt s LYS 132 Ca 0.06 0.58 -0.21 0.00 -0.36 0.00 0.00 55.97 56.04 3dkt s LYS 132 Cb -0.15 -3.76 0.36 0.00 -1.51 0.00 0.00 37.83 32.76 3dkt s LYS 132 CO 0.05 -0.80 0.94 0.20 -0.36 0.00 0.00 175.35 175.38 3dkt s GLY 133 N 1.72 1.43 0.13 5.54 0.00 -1.12 -4.57 107.32 110.45 3dkt s GLY 133 Ca 0.35 -0.70 -0.13 0.00 0.00 0.00 0.00 44.72 44.24 3dkt s GLY 133 CO 0.15 0.27 1.48 1.41 0.00 0.00 0.00 173.10 176.41 3dkt h LEU 134 N -3.35 0.87 0.00 0.66 3.38 -0.85 -3.22 115.31 112.80 3dkt h LEU 134 Ca -0.47 -0.43 0.00 0.00 0.09 0.00 0.00 57.88 57.07 3dkt h LEU 134 Cb 1.34 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 41.85 3dkt h LEU 134 CO 0.32 1.11 -0.00 0.18 0.09 0.00 0.00 178.44 180.14 3dkt n LEU 135 N -4.21 0.30 0.00 1.67 4.77 -0.66 -3.31 117.00 115.56 3dkt n LEU 135 Ca -0.02 0.53 0.11 0.00 -0.03 0.00 0.00 56.01 56.60 3dkt n LEU 135 Cb 0.46 -0.43 0.55 0.00 -2.33 0.00 0.00 43.42 41.67 3dkt n LEU 135 CO 0.45 -0.07 0.88 -1.20 -1.33 0.00 0.00 177.39 176.13 3dkt n SER 136 N -1.78 0.00 -4.52 -1.43 7.64 -1.21 -4.45 113.62 107.86 3dkt n SER 136 Ca 0.06 0.19 -0.43 0.00 1.01 0.00 0.00 58.87 59.70 3dkt n SER 136 Cb 0.37 -0.38 -0.00 0.00 -1.01 0.00 0.00 64.21 63.19 3dkt n SER 136 CO 0.00 0.00 0.00 -0.36 -3.01 0.00 0.00 175.04 171.67 3dkt s PHE 137 N -2.76 3.09 0.22 1.43 0.40 -1.21 -4.82 117.98 114.32 3dkt s PHE 137 Ca 0.17 -1.79 -0.08 0.00 -0.60 0.00 0.00 56.93 54.63 3dkt s PHE 137 Cb 0.16 -4.55 0.17 0.00 0.51 0.00 0.00 43.02 39.31 3dkt s PHE 137 CO 0.39 -1.63 1.83 1.49 0.70 0.00 0.00 175.22 178.01 3dkt h GLU 138 N 7.56 1.14 0.00 0.44 4.57 -1.92 -2.48 114.58 123.90 3dkt h GLU 138 Ca 0.37 -0.14 0.00 0.00 -1.18 0.00 0.00 59.36 58.41 3dkt h GLU 138 Cb 0.88 -0.22 0.00 0.00 -0.16 0.00 0.00 28.75 29.25 3dkt h GLU 138 CO 1.35 0.85 0.11 0.39 -1.18 0.00 0.00 179.01 180.53 3dkt n GLU 139 N -4.39 0.12 -1.43 1.92 4.71 -1.26 -1.11 120.64 119.19 3dkt n GLU 139 Ca 0.08 0.61 -0.21 0.00 -0.01 0.00 0.00 57.16 57.63 3dkt n GLU 139 Cb 0.10 -2.00 0.10 0.00 -1.01 0.00 0.00 31.44 28.63 3dkt n GLU 139 CO 0.00 0.00 0.00 0.54 0.09 0.00 0.00 177.13 177.76 3dkt n ARG 140 N -2.15 2.76 -4.52 3.49 5.12 -0.93 -4.96 116.66 115.47 3dkt n ARG 140 Ca -0.01 -3.59 -0.34 0.00 -1.93 0.00 0.00 57.85 51.98 3dkt n ARG 140 Cb 0.14 -2.13 -0.12 0.00 -1.16 0.00 0.00 32.46 29.19 3dkt n ARG 140 CO 0.00 0.00 0.00 0.21 -1.93 0.00 0.00 177.63 175.91 3dkt s LYS 141 N -3.54 3.30 0.15 5.56 2.20 -0.26 0.85 119.74 127.99 3dkt s LYS 141 Ca 0.53 -0.54 0.05 0.00 -0.36 0.00 0.00 55.97 55.65 3dkt s LYS 141 Cb 0.44 -2.77 -0.04 0.00 -1.51 0.00 0.00 37.83 33.95 3dkt s LYS 141 CO 0.01 0.40 -0.11 -1.50 -0.36 0.00 0.00 175.35 173.80 3dkt s ILE 142 N -0.10 1.24 0.15 5.43 1.10 -0.84 -4.93 121.20 123.26 3dkt s ILE 142 Ca 0.01 -2.02 -0.24 0.00 -0.51 0.00 0.00 60.65 57.90 3dkt s ILE 142 Cb -0.13 -1.81 -0.08 0.00 0.15 0.00 0.00 42.46 40.59 3dkt s ILE 142 CO 0.03 -0.68 0.73 -1.61 -2.11 0.00 0.00 174.94 171.29 3dkt s GLU 143 N -3.57 4.46 0.01 3.50 0.41 -1.26 -2.24 118.70 120.02 3dkt s GLU 143 Ca 0.16 1.04 0.01 0.00 -0.41 0.00 0.00 54.97 55.78 3dkt s GLU 143 Cb 0.01 -3.22 -0.01 0.00 -1.78 0.00 0.00 34.13 29.13 3dkt s GLU 143 CO 0.02 0.57 -0.04 0.00 -0.49 0.00 0.00 175.26 175.31 3dkt n GLY 145 N 2.45 -0.46 0.00 0.00 0.00 -1.26 -4.59 105.19 101.33 3dkt n GLY 145 Ca -0.16 -1.31 0.00 0.00 0.00 0.00 0.00 46.02 44.55 3dkt n GLY 145 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3dkt n SER 146 N 0.00 0.00 -4.86 1.61 7.64 -1.26 -4.88 113.62 111.87 3dkt n SER 146 Ca 0.00 -0.62 -0.31 0.00 1.01 0.00 0.00 58.87 58.95 3dkt n SER 146 Cb 0.00 0.00 -0.02 0.00 -1.01 0.00 0.00 64.21 63.18 3dkt n SER 146 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 3dkt s THR 147 N 0.00 4.63 0.20 0.44 2.01 -1.26 -4.84 115.64 116.81 3dkt s THR 147 Ca 0.00 1.02 -0.20 0.00 0.31 0.00 0.00 61.69 62.83 3dkt s THR 147 Cb 0.00 -3.78 0.15 0.00 0.01 0.00 0.00 72.50 68.88 3dkt s THR 147 CO 0.00 -0.87 1.58 -0.65 -0.69 0.00 0.00 174.62 173.99 3dkt h PRO 148 N 0.42 -0.12 -0.64 4.92 0.11 -1.95 -2.12 132.00 132.63 3dkt h PRO 148 Ca -0.46 0.01 0.12 0.00 0.11 0.00 0.00 66.00 65.79 3dkt h PRO 148 Cb 1.19 0.03 -0.04 0.00 0.11 0.00 0.00 31.00 32.29 3dkt h PRO 148 CO 0.62 -0.08 0.43 0.87 -0.21 0.00 0.00 178.00 179.63 3dkt h LYS 149 N -0.12 0.33 0.00 1.05 1.57 -1.99 -0.55 116.57 116.86 3dkt h LYS 149 Ca 0.26 -0.02 -0.06 0.00 -1.87 0.00 0.00 60.65 58.96 3dkt h LYS 149 Cb 0.56 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.79 3dkt h LYS 149 CO -0.75 0.22 -0.28 -0.44 -0.57 0.00 0.00 179.45 177.62 3dkt h ASP 150 N 0.34 0.00 0.01 0.86 3.32 -1.75 -2.29 116.42 116.90 3dkt h ASP 150 Ca 0.30 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.35 3dkt h ASP 150 Cb 0.73 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.28 3dkt h ASP 150 CO -0.08 0.28 -0.00 0.25 -1.72 0.00 0.00 179.24 177.97 3dkt h LEU 151 N 0.00 -0.01 -0.83 1.55 5.85 -0.85 -2.42 115.31 118.60 3dkt h LEU 151 Ca -0.00 -0.54 0.17 0.00 0.84 0.00 0.00 57.88 58.35 3dkt h LEU 151 Cb 0.85 0.00 -0.16 0.00 0.37 0.00 0.00 40.66 41.73 3dkt h LEU 151 CO 0.04 0.75 -0.17 -0.07 -0.34 0.00 0.00 178.44 178.64 3dkt h LEU 152 N -0.99 -0.71 -0.22 2.25 -0.00 -1.49 0.34 115.31 114.49 3dkt h LEU 152 Ca -0.00 0.24 0.06 0.00 -0.00 0.00 0.00 57.88 58.18 3dkt h LEU 152 Cb 0.55 0.49 -0.06 0.00 -0.00 0.00 0.00 40.66 41.64 3dkt h LEU 152 CO 0.00 -0.27 -0.17 -0.08 -0.00 0.00 0.00 178.44 177.93 3dkt h GLU 153 N 0.01 -0.16 0.03 1.13 4.81 -1.47 -1.88 114.58 117.04 3dkt h GLU 153 Ca 0.41 0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.67 3dkt h GLU 153 Cb 0.65 0.04 -0.05 0.00 0.63 0.00 0.00 28.75 30.01 3dkt h GLU 153 CO -0.83 -0.11 -0.47 0.00 -0.73 0.00 0.00 179.01 176.87 3dkt h ALA 154 N 0.96 -0.81 -0.27 2.92 0.00 -0.50 -1.59 119.26 119.96 3dkt h ALA 154 Ca 0.13 -0.07 0.03 0.00 0.00 0.00 0.00 54.91 55.00 3dkt h ALA 154 Cb 0.36 0.83 -0.05 0.00 0.00 0.00 0.00 17.79 18.93 3dkt h ALA 154 CO -0.32 -1.03 -0.30 0.82 0.00 0.00 0.00 179.25 178.41 3dkt h ILE 155 N -0.64 0.00 -0.95 0.00 2.04 -0.57 0.15 117.51 117.53 3dkt h ILE 155 Ca 0.03 0.00 0.10 0.00 1.00 0.00 0.00 64.86 65.99 3dkt h ILE 155 Cb 0.70 0.00 -0.07 0.00 -0.74 0.00 0.00 36.82 36.71 3dkt h ILE 155 CO -0.32 0.00 0.61 -0.37 0.00 0.00 0.00 178.15 178.06 3dkt h VAL 156 N -0.18 0.97 -0.71 1.67 -1.51 -1.26 0.30 116.25 115.53 3dkt h VAL 156 Ca 0.05 -0.33 -0.01 0.00 -1.23 0.00 0.00 66.70 65.18 3dkt h VAL 156 Cb 0.30 -0.08 -0.03 0.00 -2.13 0.00 0.00 31.29 29.34 3dkt h VAL 156 CO -0.35 0.18 0.42 0.03 -1.23 0.00 0.00 177.57 176.62 3dkt h ARG 157 N 0.97 0.97 0.50 5.19 3.08 -0.21 -2.48 114.38 122.40 3dkt h ARG 157 Ca 0.44 -0.09 -0.02 0.00 0.07 0.00 0.00 59.98 60.38 3dkt h ARG 157 Cb 0.39 -0.20 -0.00 0.00 0.08 0.00 0.00 29.97 30.24 3dkt h ARG 157 CO -0.20 0.69 -0.30 0.00 -1.07 0.00 0.00 179.97 179.10 3dkt h ALA 158 N 1.22 -0.76 -0.69 0.04 0.00 0.22 -0.91 119.26 118.38 3dkt h ALA 158 Ca 0.25 -0.15 0.20 0.00 0.00 0.00 0.00 54.91 55.21 3dkt h ALA 158 Cb -0.02 0.36 -0.03 0.00 0.00 0.00 0.00 17.79 18.10 3dkt h ALA 158 CO -0.05 -0.94 0.76 -0.07 0.00 0.00 0.00 179.25 178.95 3dkt h LEU 159 N -0.75 0.00 0.00 0.00 -0.00 -0.78 0.24 115.31 114.02 3dkt h LEU 159 Ca -0.06 0.00 -0.23 0.00 -0.00 0.00 0.00 57.88 57.59 3dkt h LEU 159 Cb 0.61 0.00 -0.04 0.00 -0.00 0.00 0.00 40.66 41.23 3dkt h LEU 159 CO 0.07 0.00 -1.24 0.28 -0.00 0.00 0.00 178.44 177.55 3dkt h SER 160 N 0.00 0.00 0.07 -0.43 0.02 -0.71 -1.85 113.55 110.65 3dkt h SER 160 Ca 0.33 0.00 -0.16 0.00 -0.84 0.00 0.00 61.79 61.12 3dkt h SER 160 Cb 1.84 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 64.37 3dkt h SER 160 CO -0.00 0.95 -0.57 0.40 -1.14 0.00 0.00 176.83 176.47 3dkt h ILE 161 N 0.00 1.33 0.68 3.27 5.03 0.05 -2.98 117.51 124.89 3dkt h ILE 161 Ca -0.11 -1.83 -0.03 0.00 -0.12 0.00 0.00 64.86 62.76 3dkt h ILE 161 Cb 1.82 1.82 0.01 0.00 -3.03 0.00 0.00 36.82 37.44 3dkt h ILE 161 CO 0.10 0.57 -0.33 -0.26 -0.68 0.00 0.00 178.15 177.55 3dkt h PHE 162 N 0.39 -0.85 -1.58 1.37 0.05 -1.41 -3.10 116.94 111.81 3dkt h PHE 162 Ca 0.00 -0.02 0.48 0.00 3.82 0.00 0.00 57.97 62.26 3dkt h PHE 162 Cb 1.11 0.28 -0.10 0.00 2.00 0.00 0.00 35.95 39.24 3dkt h PHE 162 CO 0.04 -0.51 1.09 1.03 -0.18 0.00 0.00 178.31 179.78 3dkt h SER 163 N -1.01 0.11 -0.04 2.17 0.87 -1.28 0.95 113.55 115.34 3dkt h SER 163 Ca -0.09 0.07 0.00 0.00 -1.23 0.00 0.00 61.79 60.53 3dkt h SER 163 Cb 0.73 0.06 0.00 0.00 -0.44 0.00 0.00 62.40 62.75 3dkt h SER 163 CO 0.15 -0.09 0.00 2.29 -0.53 0.00 0.00 176.83 178.66 3dkt n LYS 164 N -4.32 1.97 0.00 2.24 2.85 -1.13 -3.50 118.16 116.26 3dkt n LYS 164 Ca 0.39 -1.41 0.06 0.00 -1.05 0.00 0.00 58.31 56.30 3dkt n LYS 164 Cb 1.65 -1.47 -0.04 0.00 -0.65 0.00 0.00 35.03 34.52 3dkt n LYS 164 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 3dkt n ASP 165 N 0.71 0.87 0.00 -5.58 8.00 0.32 -4.97 116.55 115.90 3dkt n ASP 165 Ca 0.17 -0.94 0.00 0.00 0.71 0.00 0.00 54.79 54.73 3dkt n ASP 165 Cb 0.46 0.80 0.00 0.00 -0.02 0.00 0.00 41.12 42.36 3dkt n ASP 165 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3dkt n GLY 166 N 1.18 0.79 3.62 0.44 0.00 -0.52 -5.00 105.19 105.70 3dkt n GLY 166 Ca 0.03 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.62 3dkt n GLY 166 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3dkt s ILE 167 N -3.09 4.28 -0.17 -0.61 -1.09 -1.12 -4.98 121.20 114.42 3dkt s ILE 167 Ca 0.00 1.39 -0.07 0.00 -2.23 0.00 0.00 60.65 59.74 3dkt s ILE 167 Cb 0.00 -4.45 0.07 0.00 -1.58 0.00 0.00 42.46 36.50 3dkt s ILE 167 CO 0.00 -0.74 0.39 -0.70 -1.23 0.00 0.00 174.94 172.66 3dkt s GLU 168 N 4.17 0.32 0.00 2.79 2.12 -1.26 -4.31 118.70 122.53 3dkt s GLU 168 Ca 0.49 0.87 0.00 0.00 0.36 0.00 0.00 54.97 56.69 3dkt s GLU 168 Cb -0.11 0.12 0.00 0.00 0.26 0.00 0.00 34.13 34.40 3dkt s GLU 168 CO 0.25 -0.21 0.00 0.41 -0.54 0.00 0.00 175.26 175.17 3dkt n GLY 169 N 4.87 5.43 3.77 -1.50 0.00 -1.26 -4.77 105.19 111.72 3dkt n GLY 169 Ca -0.15 -1.31 -0.39 0.00 0.00 0.00 0.00 46.02 44.17 3dkt n GLY 169 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3dkt s PRO 170 N 1.65 4.21 -0.00 1.61 0.02 -1.26 -4.89 135.00 136.34 3dkt s PRO 170 Ca 0.00 1.80 -0.01 0.00 0.02 0.00 0.00 61.00 62.81 3dkt s PRO 170 Cb 0.00 -2.78 -0.04 0.00 0.02 0.00 0.00 34.50 31.70 3dkt s PRO 170 CO 0.00 -0.17 0.09 0.71 -0.33 0.00 0.00 177.00 177.30 3dkt s TYR 171 N -1.39 3.31 0.02 6.54 1.51 -1.26 -1.32 117.35 124.76 3dkt s TYR 171 Ca 0.54 0.22 0.06 0.00 -1.01 0.00 0.00 57.07 56.88 3dkt s TYR 171 Cb -0.30 -1.75 -0.02 0.00 -0.11 0.00 0.00 41.96 39.78 3dkt s TYR 171 CO 0.38 0.56 -0.17 0.99 -1.11 0.00 0.00 175.55 176.20 3dkt s THR 172 N -1.21 1.37 -0.39 -0.71 2.01 -0.16 -2.67 115.64 113.89 3dkt s THR 172 Ca 0.23 -0.97 -0.09 0.00 0.31 0.00 0.00 61.69 61.16 3dkt s THR 172 Cb -0.12 -1.19 0.06 0.00 0.01 0.00 0.00 72.50 71.25 3dkt s THR 172 CO 0.14 0.20 0.22 -0.22 -0.69 0.00 0.00 174.62 174.27 3dkt s LEU 173 N -0.90 4.88 -0.05 4.42 1.98 -0.57 -2.44 118.68 126.00 3dkt s LEU 173 Ca 0.05 -1.28 -0.16 0.00 -2.89 0.00 0.00 54.13 49.85 3dkt s LEU 173 Cb -0.08 -1.98 -0.05 0.00 0.66 0.00 0.00 46.19 44.74 3dkt s LEU 173 CO 0.01 -0.46 0.44 -0.69 -1.89 0.00 0.00 176.35 173.76 3dkt s VAL 174 N 1.47 5.08 -0.23 1.68 1.01 0.21 -0.13 120.40 129.49 3dkt s VAL 174 Ca 0.02 0.90 -0.20 0.00 0.00 0.00 0.00 61.98 62.69 3dkt s VAL 174 Cb -0.21 -3.76 0.06 0.00 0.00 0.00 0.00 36.38 32.46 3dkt s VAL 174 CO 0.04 0.46 0.61 -0.51 0.00 0.00 0.00 175.10 175.70 3dkt s ILE 175 N -0.30 -0.00 0.23 2.22 -1.16 -0.74 -0.36 121.20 121.10 3dkt s ILE 175 Ca 0.25 0.00 -0.31 0.00 -0.51 0.00 0.00 60.65 60.07 3dkt s ILE 175 Cb -0.16 -0.86 -0.13 0.00 0.61 0.00 0.00 42.46 41.92 3dkt s ILE 175 CO 0.12 0.00 1.42 -3.20 -2.81 0.00 0.00 174.94 170.47 3dkt n ASN 176 N 2.93 2.77 -0.05 4.50 5.15 -0.65 -1.52 115.26 128.38 3dkt n ASN 176 Ca -0.15 1.14 -0.08 0.00 -0.60 0.00 0.00 54.58 54.89 3dkt n ASN 176 Cb 0.56 -1.43 -0.02 0.00 -0.53 0.00 0.00 39.78 38.36 3dkt n ASN 176 CO 0.00 0.00 0.00 0.74 1.40 0.00 0.00 177.26 179.40 3dkt h THR 177 N 3.09 0.71 -0.32 -0.44 2.02 -1.57 -2.17 112.91 114.23 3dkt h THR 177 Ca -0.45 0.00 -0.09 0.00 0.77 0.00 0.00 66.41 66.64 3dkt h THR 177 Cb 1.27 0.71 -0.01 0.00 -1.74 0.00 0.00 68.15 68.39 3dkt h THR 177 CO 0.77 0.00 -0.15 0.44 0.37 0.00 0.00 175.52 176.95 3dkt h ASP 178 N -0.05 0.69 -1.01 4.18 3.32 -1.90 -2.46 116.42 119.19 3dkt h ASP 178 Ca 0.11 -0.40 0.24 0.00 0.02 0.00 0.00 57.03 57.00 3dkt h ASP 178 Cb 0.22 -0.19 -0.10 0.00 0.22 0.00 0.00 39.33 39.48 3dkt h ASP 178 CO -0.26 0.94 0.63 0.03 -1.72 0.00 0.00 179.24 178.87 3dkt h ARG 179 N 0.44 0.51 -0.05 3.56 3.08 -1.84 -0.13 114.38 119.95 3dkt h ARG 179 Ca 0.07 -0.03 -0.19 0.00 0.07 0.00 0.00 59.98 59.90 3dkt h ARG 179 Cb 0.68 -0.11 -0.00 0.00 0.08 0.00 0.00 29.97 30.61 3dkt h ARG 179 CO 0.05 0.34 -0.79 2.35 -1.07 0.00 0.00 179.97 180.84 3dkt h TRP 180 N 0.52 0.53 -0.70 3.04 7.01 -0.95 -1.96 115.95 123.43 3dkt h TRP 180 Ca 0.59 -0.25 0.04 0.00 2.11 0.00 0.00 58.89 61.37 3dkt h TRP 180 Cb 1.27 -0.07 -0.04 0.00 -2.10 0.00 0.00 29.16 28.21 3dkt h TRP 180 CO -0.00 1.02 0.46 0.82 -2.79 0.00 0.00 178.44 177.95 3dkt h ILE 181 N 0.25 1.09 -0.21 2.65 2.04 -0.68 -1.78 117.51 120.87 3dkt h ILE 181 Ca -0.04 -0.29 -0.17 0.00 1.00 0.00 0.00 64.86 65.37 3dkt h ILE 181 Cb 1.38 0.19 -0.00 0.00 -0.74 0.00 0.00 36.82 37.65 3dkt h ILE 181 CO 0.13 0.15 -0.55 0.78 0.00 0.00 0.00 178.15 178.67 3dkt h ASN 182 N 0.83 0.70 0.79 1.72 2.35 -0.60 -2.23 115.58 119.13 3dkt h ASN 182 Ca 0.28 -0.37 -0.07 0.00 -0.55 0.00 0.00 56.30 55.59 3dkt h ASN 182 Cb 0.08 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.24 3dkt h ASN 182 CO -0.08 1.10 -0.33 -0.26 -1.65 0.00 0.00 177.43 176.21 3dkt h PHE 183 N 0.48 0.00 -0.00 1.19 -1.00 -1.16 -2.47 116.94 113.98 3dkt h PHE 183 Ca 0.01 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.79 3dkt h PHE 183 Cb 1.11 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.67 3dkt h PHE 183 CO 0.05 0.33 -0.04 -0.11 -1.61 0.00 0.00 178.31 176.93 3dkt n LEU 184 N -3.55 0.06 0.23 1.54 -0.00 -0.69 -3.00 117.00 111.59 3dkt n LEU 184 Ca -0.00 0.41 -0.09 0.00 -0.00 0.00 0.00 56.01 56.33 3dkt n LEU 184 Cb 0.47 -0.44 -0.04 0.00 -0.00 0.00 0.00 43.42 43.41 3dkt n LEU 184 CO 0.36 0.01 0.37 0.11 -0.00 0.00 0.00 177.39 178.24 3dkt h LYS 185 N 0.02 -0.58 0.00 1.96 1.79 -0.92 -3.32 116.57 115.51 3dkt h LYS 185 Ca 0.00 0.04 -0.06 0.00 -2.18 0.00 0.00 60.65 58.45 3dkt h LYS 185 Cb 0.47 0.13 -0.01 0.00 -1.58 0.00 0.00 32.23 31.24 3dkt h LYS 185 CO 0.00 -0.39 -0.26 0.93 -1.08 0.00 0.00 179.45 178.65 3dkt h GLU 186 N -0.79 0.00 -2.36 3.15 3.07 -1.68 -3.06 114.58 112.91 3dkt h GLU 186 Ca -0.06 0.00 -0.78 0.00 -0.50 0.00 0.00 59.36 58.02 3dkt h GLU 186 Cb 0.46 0.00 -0.22 0.00 -0.84 0.00 0.00 28.75 28.15 3dkt h GLU 186 CO 0.10 0.26 1.48 -1.91 -1.40 0.00 0.00 179.01 177.54 3dkt n GLU 187 N -3.62 5.08 -3.27 2.33 4.07 -1.16 -4.90 120.64 119.17 3dkt n GLU 187 Ca -0.01 -4.22 -0.46 0.00 -0.06 0.00 0.00 57.16 52.41 3dkt n GLU 187 Cb 0.39 -2.51 -0.01 0.00 -0.06 0.00 0.00 31.44 29.25 3dkt n GLU 187 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 3dkt s ALA 188 N -3.28 4.24 -0.52 4.31 0.00 -1.16 -4.59 121.76 120.76 3dkt s ALA 188 Ca 0.44 -3.46 -0.03 0.00 0.00 0.00 0.00 51.96 48.92 3dkt s ALA 188 Cb 0.20 -3.63 0.00 0.00 0.00 0.00 0.00 23.12 19.69 3dkt s ALA 188 CO -0.13 -2.35 0.45 0.41 0.00 0.00 0.00 175.76 174.14 3dkt n GLY 189 N 3.67 0.32 0.14 0.00 0.00 -1.26 -4.93 105.19 103.14 3dkt n GLY 189 Ca 0.20 -0.30 -0.26 0.00 0.00 0.00 0.00 46.02 45.66 3dkt n GLY 189 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3dkt n HIS 190 N -3.24 0.00 -3.64 1.61 8.25 -1.26 -5.03 115.22 111.91 3dkt n HIS 190 Ca -0.02 0.00 -0.06 0.00 -0.26 0.00 0.00 57.72 57.38 3dkt n HIS 190 Cb 0.53 -0.99 -0.07 0.00 1.12 0.00 0.00 29.99 30.58 3dkt n HIS 190 CO 0.00 0.00 0.00 -0.47 0.64 0.00 0.00 176.34 176.51 3dkt s TYR 191 N -2.51 -0.46 -0.01 4.41 5.04 -1.26 -5.13 117.35 117.43 3dkt s TYR 191 Ca -0.38 1.03 -0.33 0.00 -2.44 0.00 0.00 57.07 54.96 3dkt s TYR 191 Cb 0.13 0.36 -0.11 0.00 0.35 0.00 0.00 41.96 42.69 3dkt s TYR 191 CO 0.52 -0.22 1.86 -2.30 -1.34 0.00 0.00 175.55 174.07 3dkt n PRO 192 N 2.66 2.38 -0.18 4.97 -0.02 -1.26 -4.87 135.00 138.68 3dkt n PRO 192 Ca -0.14 0.87 -0.03 0.00 -2.02 0.00 0.00 63.50 62.18 3dkt n PRO 192 Cb 0.57 -2.74 0.07 0.00 -0.02 0.00 0.00 33.50 31.38 3dkt n PRO 192 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 3dkt h LEU 193 N 9.04 0.30 -0.81 2.45 5.85 -1.97 -2.71 115.31 127.46 3dkt h LEU 193 Ca -0.48 0.05 0.08 0.00 0.84 0.00 0.00 57.88 58.37 3dkt h LEU 193 Cb 1.26 0.00 -0.10 0.00 0.37 0.00 0.00 40.66 42.19 3dkt h LEU 193 CO 0.94 0.20 -0.45 -0.62 -0.34 0.00 0.00 178.44 178.17 3dkt n GLU 194 N -4.94 -0.33 0.14 1.25 4.71 -1.26 -0.77 120.64 119.45 3dkt n GLU 194 Ca 0.06 1.23 0.01 0.00 -0.01 0.00 0.00 57.16 58.45 3dkt n GLU 194 Cb 0.19 -1.82 0.16 0.00 -1.01 0.00 0.00 31.44 28.96 3dkt n GLU 194 CO 0.00 0.00 0.00 0.87 0.09 0.00 0.00 177.13 178.09 3dkt h LYS 195 N 0.00 0.00 -0.03 3.49 1.57 -1.88 -1.33 116.57 118.39 3dkt h LYS 195 Ca 0.16 0.00 -0.21 0.00 -1.87 0.00 0.00 60.65 58.73 3dkt h LYS 195 Cb 0.36 0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.67 3dkt h LYS 195 CO -0.77 0.57 -0.86 -0.09 -0.57 0.00 0.00 179.45 177.73 3dkt h ARG 196 N 0.00 0.41 -0.16 3.15 1.12 -0.78 0.20 114.38 118.32 3dkt h ARG 196 Ca -0.01 -0.40 -0.10 0.00 -1.11 0.00 0.00 59.98 58.36 3dkt h ARG 196 Cb 1.19 0.10 0.00 0.00 -0.01 0.00 0.00 29.97 31.26 3dkt h ARG 196 CO 0.07 1.06 -0.29 0.28 -3.11 0.00 0.00 179.97 177.98 3dkt h VAL 197 N 0.25 1.35 -0.34 0.20 2.07 -0.83 -0.54 116.25 118.41 3dkt h VAL 197 Ca -0.06 -1.53 -0.01 0.00 0.82 0.00 0.00 66.70 65.91 3dkt h VAL 197 Cb 1.48 1.94 -0.02 0.00 -1.52 0.00 0.00 31.29 33.17 3dkt h VAL 197 CO 0.15 0.46 0.16 -0.33 0.02 0.00 0.00 177.57 178.03 3dkt h GLU 198 N 0.12 0.47 0.24 1.57 5.08 -1.22 -0.34 114.58 120.50 3dkt h GLU 198 Ca 0.01 -0.05 -0.01 0.00 -1.00 0.00 0.00 59.36 58.31 3dkt h GLU 198 Cb 0.88 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 30.04 3dkt h GLU 198 CO 0.07 0.37 -0.11 0.93 -1.00 0.00 0.00 179.01 179.26 3dkt h GLU 199 N 0.47 -0.31 0.00 2.33 5.08 -0.84 -0.59 114.58 120.72 3dkt h GLU 199 Ca 0.12 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.50 3dkt h GLU 199 Cb 0.06 0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.38 3dkt h GLU 199 CO -0.02 0.06 0.00 0.00 -1.00 0.00 0.00 179.01 178.05 3dkt n LEU 201 N -1.47 2.70 -3.38 0.00 4.77 -0.16 -4.63 117.00 114.83 3dkt n LEU 201 Ca 0.00 -1.03 -0.13 0.00 -0.03 0.00 0.00 56.01 54.82 3dkt n LEU 201 Cb 0.02 -0.10 0.01 0.00 -2.33 0.00 0.00 43.42 41.02 3dkt n LEU 201 CO 0.01 0.51 0.09 0.54 -1.33 0.00 0.00 177.39 177.22 3dkt n ARG 202 N 1.05 -1.43 -1.38 3.23 1.74 0.18 -3.37 116.66 116.68 3dkt n ARG 202 Ca 0.17 1.06 -0.09 0.00 -0.77 0.00 0.00 57.85 58.22 3dkt n ARG 202 Cb 0.52 -4.56 -0.04 0.00 -1.02 0.00 0.00 32.46 27.37 3dkt n ARG 202 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3dkt n GLY 203 N -1.68 0.96 3.90 -0.13 0.00 -0.24 -4.69 105.19 103.31 3dkt n GLY 203 Ca -0.11 -0.60 -0.30 0.00 0.00 0.00 0.00 46.02 45.01 3dkt n GLY 203 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3dkt s GLY 204 N -2.86 1.78 0.34 -0.02 0.00 -1.18 -4.87 107.32 100.51 3dkt s GLY 204 Ca 0.00 -1.24 0.08 0.00 0.00 0.00 0.00 44.72 43.56 3dkt s GLY 204 CO 0.00 -0.43 -0.06 -1.59 0.00 0.00 0.00 173.10 171.02 3dkt s LYS 205 N -5.89 1.78 -0.15 2.90 -2.85 -1.09 -4.72 119.74 109.72 3dkt s LYS 205 Ca 0.75 -1.93 0.00 0.00 -1.00 0.00 0.00 55.97 53.79 3dkt s LYS 205 Cb -0.03 -1.54 0.02 0.00 -2.06 0.00 0.00 37.83 34.22 3dkt s LYS 205 CO 0.54 0.07 -0.14 0.42 0.10 0.00 0.00 175.35 176.34 3dkt s ILE 206 N -2.75 1.56 -0.31 3.79 1.01 -1.26 -1.51 121.20 121.73 3dkt s ILE 206 Ca 0.32 -0.63 -0.06 0.00 0.00 0.00 0.00 60.65 60.29 3dkt s ILE 206 Cb 0.04 -1.47 0.02 0.00 0.01 0.00 0.00 42.46 41.07 3dkt s ILE 206 CO 0.16 0.46 0.07 -0.63 0.00 0.00 0.00 174.94 174.99 3dkt s ILE 207 N 1.49 3.73 0.31 2.92 1.01 0.82 -4.97 121.20 126.52 3dkt s ILE 207 Ca 0.05 -0.93 -0.21 0.00 0.00 0.00 0.00 60.65 59.56 3dkt s ILE 207 Cb -0.13 -3.01 -0.09 0.00 0.01 0.00 0.00 42.46 39.24 3dkt s ILE 207 CO -0.11 -0.02 0.84 0.42 0.00 0.00 0.00 174.94 176.07 3dkt s THR 208 N 1.43 4.44 -0.24 2.92 -4.23 -1.26 -1.79 115.64 116.92 3dkt s THR 208 Ca 0.00 1.43 -0.26 0.00 -1.18 0.00 0.00 61.69 61.68 3dkt s THR 208 Cb -0.18 -3.81 0.09 0.00 1.34 0.00 0.00 72.50 69.93 3dkt s THR 208 CO 0.02 0.02 0.82 0.28 -0.54 0.00 0.00 174.62 175.22 3dkt s THR 209 N -1.76 0.00 -0.65 3.99 -1.32 -0.57 -4.88 115.64 110.45 3dkt s THR 209 Ca 0.51 0.00 -0.02 0.00 -1.21 0.00 0.00 61.69 60.97 3dkt s THR 209 Cb -0.15 -1.00 0.39 0.00 -1.51 0.00 0.00 72.50 70.24 3dkt s THR 209 CO 0.20 0.00 2.06 -0.81 -2.21 0.00 0.00 174.62 173.86 3dkt n PRO 210 N 2.19 2.59 -0.00 7.08 -0.05 -1.26 -1.56 135.00 143.99 3dkt n PRO 210 Ca -0.14 -3.10 0.02 0.00 -0.05 0.00 0.00 63.50 60.23 3dkt n PRO 210 Cb 0.56 -2.21 -0.03 0.00 -0.05 0.00 0.00 33.50 31.77 3dkt n PRO 210 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 175.50 175.99 3dkt n ARG 211 N -0.66 0.90 -4.25 0.54 5.12 -1.26 -5.02 116.66 112.03 3dkt n ARG 211 Ca 0.57 -0.03 -0.14 0.00 -1.93 0.00 0.00 57.85 56.33 3dkt n ARG 211 Cb 0.58 -1.03 -0.10 0.00 -1.16 0.00 0.00 32.46 30.75 3dkt n ARG 211 CO 0.00 0.00 0.00 0.96 -1.93 0.00 0.00 177.63 176.66 3dkt s ILE 212 N -2.12 0.99 -0.08 0.55 -4.36 -1.26 -5.01 121.20 109.90 3dkt s ILE 212 Ca -0.01 -2.02 0.21 0.00 -0.26 0.00 0.00 60.65 58.57 3dkt s ILE 212 Cb 0.02 -1.95 -0.31 0.00 1.25 0.00 0.00 42.46 41.47 3dkt s ILE 212 CO 0.15 -0.65 0.37 -0.62 0.24 0.00 0.00 174.94 174.42 3dkt n GLU 213 N -0.22 0.67 0.00 0.37 1.02 -1.26 -4.37 120.64 116.86 3dkt n GLU 213 Ca -0.09 -0.15 0.00 0.00 -0.02 0.00 0.00 57.16 56.90 3dkt n GLU 213 Cb 0.62 -1.52 0.00 0.00 -0.02 0.00 0.00 31.44 30.52 3dkt n GLU 213 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 3dkt n ASP 214 N -2.39 0.00 -3.94 1.62 9.92 -1.26 -4.67 116.55 115.83 3dkt n ASP 214 Ca -0.12 0.00 -0.11 0.00 -0.53 0.00 0.00 54.79 54.03 3dkt n ASP 214 Cb 0.73 0.00 -0.07 0.00 -0.64 0.00 0.00 41.12 41.14 3dkt n ASP 214 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 3dkt s ALA 215 N -2.48 0.56 -0.24 2.24 0.00 -1.26 -1.64 121.76 118.93 3dkt s ALA 215 Ca 0.00 -1.35 -0.21 0.00 0.00 0.00 0.00 51.96 50.40 3dkt s ALA 215 Cb 0.00 1.23 0.06 0.00 0.00 0.00 0.00 23.12 24.41 3dkt s ALA 215 CO 0.00 -0.73 0.64 -1.17 0.00 0.00 0.00 175.76 174.50 3dkt s LEU 216 N -3.12 -0.50 -0.06 0.00 2.96 0.52 -2.12 118.68 116.36 3dkt s LEU 216 Ca 0.31 1.31 0.01 0.00 -0.22 0.00 0.00 54.13 55.53 3dkt s LEU 216 Cb 0.03 2.19 0.02 0.00 0.50 0.00 0.00 46.19 48.93 3dkt s LEU 216 CO 0.13 -0.22 -0.05 -0.69 -1.32 0.00 0.00 176.35 174.19 3dkt s VAL 217 N 0.54 0.63 0.13 1.68 1.01 0.87 -0.62 120.40 124.64 3dkt s VAL 217 Ca -0.02 -0.14 0.03 0.00 0.00 0.00 0.00 61.98 61.85 3dkt s VAL 217 Cb -0.05 -0.67 -0.04 0.00 0.00 0.00 0.00 36.38 35.62 3dkt s VAL 217 CO -0.02 0.26 -0.06 0.68 0.00 0.00 0.00 175.10 175.96 3dkt s VAL 218 N 1.16 0.83 -0.17 2.92 -7.23 -1.02 -0.00 120.40 116.89 3dkt s VAL 218 Ca -0.07 -1.98 -0.05 0.00 -1.81 0.00 0.00 61.98 58.07 3dkt s VAL 218 Cb -0.14 -1.84 -0.03 0.00 0.56 0.00 0.00 36.38 34.93 3dkt s VAL 218 CO -0.01 -0.74 0.00 -0.94 -0.31 0.00 0.00 175.10 173.10 3dkt s SER 219 N -3.11 5.13 -0.21 4.85 1.04 -1.02 -0.99 113.70 119.39 3dkt s SER 219 Ca 0.16 -0.05 0.02 0.00 0.48 0.00 0.00 55.95 56.56 3dkt s SER 219 Cb 0.05 -1.86 0.30 0.00 0.10 0.00 0.00 66.02 64.61 3dkt s SER 219 CO -0.01 0.17 1.44 -0.62 0.98 0.00 0.00 173.24 175.19 3dkt n GLU 220 N 3.57 1.58 0.32 4.02 1.02 -0.44 -4.24 120.64 126.47 3dkt n GLU 220 Ca -0.17 -1.38 0.22 0.00 -0.02 0.00 0.00 57.16 55.81 3dkt n GLU 220 Cb 0.52 -1.54 1.13 0.00 -0.02 0.00 0.00 31.44 31.53 3dkt n GLU 220 CO 0.00 0.00 0.00 0.07 1.18 0.00 0.00 177.13 178.38 3dkt h ARG 221 N 0.49 0.00 0.00 3.49 0.11 -1.86 -3.43 114.38 113.17 3dkt h ARG 221 Ca 0.29 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.37 3dkt h ARG 221 Cb 1.83 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.91 3dkt h ARG 221 CO 0.51 0.00 0.00 0.41 0.10 0.00 0.00 179.97 180.99 3dkt n GLY 222 N -0.94 1.38 2.10 0.08 0.00 -1.26 -5.01 105.19 101.53 3dkt n GLY 222 Ca -0.02 -1.65 -0.06 0.00 0.00 0.00 0.00 46.02 44.29 3dkt n GLY 222 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dkt n GLY 223 N 1.45 0.27 0.00 -0.02 0.00 -1.26 -4.91 105.19 100.72 3dkt n GLY 223 Ca 0.00 -0.57 0.00 0.00 0.00 0.00 0.00 46.02 45.45 3dkt n GLY 223 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3dkt n ASP 224 N 0.70 4.40 -3.65 1.61 8.00 -1.26 -4.63 116.55 121.72 3dkt n ASP 224 Ca -0.04 0.00 -0.29 0.00 0.71 0.00 0.00 54.79 55.17 3dkt n ASP 224 Cb 0.54 0.63 -0.12 0.00 -0.02 0.00 0.00 41.12 42.15 3dkt n ASP 224 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 3dkt s PHE 225 N -1.83 1.92 -0.42 1.24 0.40 -1.26 -0.62 117.98 117.42 3dkt s PHE 225 Ca 0.00 -2.47 -0.28 0.00 -0.60 0.00 0.00 56.93 53.58 3dkt s PHE 225 Cb 0.00 -1.71 0.02 0.00 0.51 0.00 0.00 43.02 41.84 3dkt s PHE 225 CO 0.00 -0.76 1.05 0.15 0.70 0.00 0.00 175.22 176.36 3dkt s LYS 226 N 0.06 3.79 -0.25 0.44 1.02 -0.99 -2.22 119.74 121.59 3dkt s LYS 226 Ca 0.22 0.61 -0.21 0.00 0.02 0.00 0.00 55.97 56.61 3dkt s LYS 226 Cb -0.15 -3.85 -0.01 0.00 -0.52 0.00 0.00 37.83 33.30 3dkt s LYS 226 CO -0.07 -1.16 0.68 -1.17 -0.92 0.00 0.00 175.35 172.71 3dkt s LEU 227 N 3.96 4.07 -0.41 3.17 2.96 -0.46 -1.84 118.68 130.14 3dkt s LEU 227 Ca 0.44 0.78 -0.10 0.00 -0.22 0.00 0.00 54.13 55.02 3dkt s LEU 227 Cb -0.10 -2.94 0.06 0.00 0.50 0.00 0.00 46.19 43.71 3dkt s LEU 227 CO 0.25 -0.42 0.25 -0.63 -1.32 0.00 0.00 176.35 174.48 3dkt s ILE 228 N 2.60 4.43 0.07 6.68 1.01 -0.36 -1.09 121.20 134.54 3dkt s ILE 228 Ca 0.28 -1.19 -0.20 0.00 0.00 0.00 0.00 60.65 59.55 3dkt s ILE 228 Cb -0.15 -3.62 -0.07 0.00 0.01 0.00 0.00 42.46 38.63 3dkt s ILE 228 CO 0.08 -0.42 0.58 -0.76 0.00 0.00 0.00 174.94 174.42 3dkt s LEU 229 N 1.49 4.52 0.00 2.97 2.01 -1.19 -2.12 118.68 126.36 3dkt s LEU 229 Ca 0.03 1.27 0.00 0.00 0.01 0.00 0.00 54.13 55.43 3dkt s LEU 229 Cb -0.22 -2.91 0.00 0.00 0.01 0.00 0.00 46.19 43.07 3dkt s LEU 229 CO 0.04 0.26 0.00 0.61 1.01 0.00 0.00 176.35 178.27 3dkt n GLY 230 N 1.77 -0.37 3.32 -3.19 0.00 0.16 -1.93 105.19 104.95 3dkt n GLY 230 Ca -0.10 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.57 3dkt n GLY 230 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 3dkt s GLN 231 N -0.65 3.34 1.02 1.61 2.00 -1.23 0.55 119.66 126.30 3dkt s GLN 231 Ca 0.00 -0.66 -0.12 0.00 -2.00 0.00 0.00 55.36 52.59 3dkt s GLN 231 Cb 0.00 -3.07 0.20 0.00 0.80 0.00 0.00 33.01 30.94 3dkt s GLN 231 CO 0.00 -0.23 1.08 0.34 -0.50 0.00 0.00 175.29 175.97 3dkt s ASP 232 N 1.48 2.28 -0.38 6.67 -1.08 -1.26 -1.94 116.67 122.44 3dkt s ASP 232 Ca 0.05 1.62 -0.39 0.00 -0.52 0.00 0.00 52.55 53.32 3dkt s ASP 232 Cb -0.15 -2.28 -0.14 0.00 -1.46 0.00 0.00 42.92 38.89 3dkt s ASP 232 CO -0.02 -3.41 2.09 0.18 0.52 0.00 0.00 175.17 174.53 3dkt n LEU 233 N -4.40 1.78 -4.29 -1.34 4.77 -1.26 -4.66 117.00 107.60 3dkt n LEU 233 Ca 0.06 0.61 -0.16 0.00 -0.03 0.00 0.00 56.01 56.49 3dkt n LEU 233 Cb 0.54 -1.14 -0.10 0.00 -2.33 0.00 0.00 43.42 40.40 3dkt n LEU 233 CO 0.55 -0.69 -0.41 -0.44 -1.33 0.00 0.00 177.39 175.07 3dkt s SER 234 N 6.26 2.01 -0.12 -1.43 0.01 -0.79 -4.99 113.70 114.65 3dkt s SER 234 Ca 1.11 -1.04 -0.01 0.00 1.31 0.00 0.00 55.95 57.32 3dkt s SER 234 Cb -1.08 -0.04 -0.02 0.00 0.21 0.00 0.00 66.02 65.08 3dkt s SER 234 CO 0.57 -0.31 -0.10 -0.63 0.41 0.00 0.00 173.24 173.18 3dkt s ILE 235 N -3.24 3.39 0.20 1.44 1.01 -1.26 -1.57 121.20 121.17 3dkt s ILE 235 Ca 0.20 -0.56 0.03 0.00 0.00 0.00 0.00 60.65 60.32 3dkt s ILE 235 Cb 0.02 -2.43 -0.01 0.00 0.01 0.00 0.00 42.46 40.06 3dkt s ILE 235 CO 0.03 0.53 0.10 0.61 0.00 0.00 0.00 174.94 176.21 3dkt n GLY 236 N 3.20 3.59 3.18 6.18 0.00 -0.98 -4.90 105.19 115.45 3dkt n GLY 236 Ca -0.18 -1.95 -0.29 0.00 0.00 0.00 0.00 46.02 43.60 3dkt n GLY 236 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3dkt s TYR 237 N -2.46 2.17 -0.21 1.61 5.04 -1.26 -1.96 117.35 120.28 3dkt s TYR 237 Ca 0.14 -0.77 -0.14 0.00 -2.44 0.00 0.00 57.07 53.86 3dkt s TYR 237 Cb 0.01 -1.46 -0.08 0.00 0.35 0.00 0.00 41.96 40.77 3dkt s TYR 237 CO 0.10 -0.29 -0.32 -1.91 -1.34 0.00 0.00 175.55 171.78 3dkt n GLU 238 N 3.36 0.51 -3.88 4.97 2.13 -0.15 -4.08 120.64 123.50 3dkt n GLU 238 Ca -0.19 0.21 -0.01 0.00 0.66 0.00 0.00 57.16 57.83 3dkt n GLU 238 Cb 0.53 -1.37 0.01 0.00 0.27 0.00 0.00 31.44 30.87 3dkt n GLU 238 CO 0.00 0.00 0.00 0.34 -0.41 0.00 0.00 177.13 177.06 3dkt s ASP 239 N -6.65 -0.02 -0.17 4.31 2.15 -0.94 -5.03 116.67 110.33 3dkt s ASP 239 Ca -0.31 -0.46 0.01 0.00 0.43 0.00 0.00 52.55 52.21 3dkt s ASP 239 Cb 0.09 0.36 0.03 0.00 -0.30 0.00 0.00 42.92 43.10 3dkt s ASP 239 CO 0.42 -0.71 -0.15 -0.60 -0.17 0.00 0.00 175.17 173.96 3dkt s ARG 240 N -2.24 2.43 -1.08 4.34 3.00 -1.26 0.23 118.95 124.36 3dkt s ARG 240 Ca 0.22 -0.74 -0.05 0.00 -1.00 0.00 0.00 55.73 54.16 3dkt s ARG 240 Cb -0.01 -2.35 0.30 0.00 0.00 0.00 0.00 34.95 32.89 3dkt s ARG 240 CO 0.02 -0.29 1.35 0.39 0.00 0.00 0.00 175.30 176.77 3dkt n GLU 241 N 4.69 4.14 0.00 5.12 1.02 -0.24 -4.93 120.64 130.45 3dkt n GLU 241 Ca -0.17 -4.53 0.00 0.00 -0.02 0.00 0.00 57.16 52.44 3dkt n GLU 241 Cb 0.49 -2.52 0.00 0.00 -0.02 0.00 0.00 31.44 29.39 3dkt n GLU 241 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 3dkt n LYS 242 N 1.73 0.00 -0.25 3.49 5.02 -1.26 -2.65 118.16 124.25 3dkt n LYS 242 Ca 0.25 0.00 0.08 0.00 -2.02 0.00 0.00 58.31 56.63 3dkt n LYS 242 Cb 0.35 0.00 0.18 0.00 -0.02 0.00 0.00 35.03 35.54 3dkt n LYS 242 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 3dkt n ASP 243 N 1.87 2.58 -4.06 4.39 -0.08 -1.26 -5.02 116.55 114.97 3dkt n ASP 243 Ca 0.00 -3.21 -0.10 0.00 -1.51 0.00 0.00 54.79 49.97 3dkt n ASP 243 Cb 0.00 -0.48 -0.08 0.00 2.34 0.00 0.00 41.12 42.90 3dkt n ASP 243 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3dkt s ALA 244 N -2.93 0.42 -0.04 -1.67 0.00 -1.08 -2.62 121.76 113.83 3dkt s ALA 244 Ca 0.35 -1.20 0.06 0.00 0.00 0.00 0.00 51.96 51.18 3dkt s ALA 244 Cb 0.31 1.01 -0.02 0.00 0.00 0.00 0.00 23.12 24.42 3dkt s ALA 244 CO 0.03 -0.63 -0.22 0.08 0.00 0.00 0.00 175.76 175.02 3dkt s VAL 245 N -4.04 2.42 -0.41 0.00 1.01 -0.19 -1.08 120.40 118.11 3dkt s VAL 245 Ca 0.24 -0.96 -0.11 0.00 0.00 0.00 0.00 61.98 61.15 3dkt s VAL 245 Cb 0.04 -1.89 0.06 0.00 0.00 0.00 0.00 36.38 34.59 3dkt s VAL 245 CO 0.04 0.58 0.27 -0.60 0.00 0.00 0.00 175.10 175.39 3dkt s ARG 246 N -0.51 2.76 0.56 2.72 3.52 0.14 -1.52 118.95 126.61 3dkt s ARG 246 Ca 0.07 -1.30 0.09 0.00 -0.13 0.00 0.00 55.73 54.46 3dkt s ARG 246 Cb -0.11 -3.83 0.08 0.00 -1.56 0.00 0.00 34.95 29.52 3dkt s ARG 246 CO 0.01 -0.87 0.76 -0.51 -0.81 0.00 0.00 175.30 173.87 3dkt s LEU 247 N 1.52 3.16 0.35 -0.88 1.43 -0.93 -0.98 118.68 122.34 3dkt s LEU 247 Ca 0.03 -0.81 -0.08 0.00 -1.03 0.00 0.00 54.13 52.24 3dkt s LEU 247 Cb -0.22 -1.74 0.02 0.00 0.03 0.00 0.00 46.19 44.29 3dkt s LEU 247 CO 0.05 -1.27 0.59 0.72 0.23 0.00 0.00 176.35 176.66 3dkt s PHE 248 N -2.63 0.67 -0.21 0.29 -0.12 -0.83 -1.75 117.98 113.39 3dkt s PHE 248 Ca 0.60 -1.06 -0.02 0.00 -0.05 0.00 0.00 56.93 56.40 3dkt s PHE 248 Cb -0.06 0.27 0.06 0.00 -0.63 0.00 0.00 43.02 42.66 3dkt s PHE 248 CO 0.38 -1.28 0.04 0.42 -0.05 0.00 0.00 175.22 174.73 3dkt s ILE 249 N -2.90 0.60 0.36 -4.49 1.01 -0.90 -2.33 121.20 112.56 3dkt s ILE 249 Ca 0.24 -0.69 0.07 0.00 0.00 0.00 0.00 60.65 60.28 3dkt s ILE 249 Cb -0.02 -1.14 -0.02 0.00 0.01 0.00 0.00 42.46 41.29 3dkt s ILE 249 CO 0.16 -0.26 0.35 -0.89 0.00 0.00 0.00 174.94 174.30 3dkt s THR 250 N 1.81 3.36 0.02 2.92 2.01 -0.61 -2.30 115.64 122.86 3dkt s THR 250 Ca -0.00 -1.30 -0.28 0.00 0.31 0.00 0.00 61.69 60.42 3dkt s THR 250 Cb -0.17 -3.16 0.10 0.00 0.01 0.00 0.00 72.50 69.28 3dkt s THR 250 CO -0.10 -0.12 0.97 -0.70 -0.69 0.00 0.00 174.62 173.98 3dkt s GLU 251 N -4.07 0.85 -0.17 4.92 2.12 -1.21 -1.88 118.70 119.26 3dkt s GLU 251 Ca 0.44 -0.39 -0.05 0.00 0.36 0.00 0.00 54.97 55.34 3dkt s GLU 251 Cb -0.06 0.35 0.08 0.00 0.26 0.00 0.00 34.13 34.76 3dkt s GLU 251 CO 0.28 -0.38 0.30 0.99 -0.54 0.00 0.00 175.26 175.91 3dkt s THR 252 N -3.05 -0.47 0.19 -1.70 2.01 -0.82 -2.51 115.64 109.29 3dkt s THR 252 Ca 0.08 0.15 -0.23 0.00 0.31 0.00 0.00 61.69 62.00 3dkt s THR 252 Cb -0.01 -0.57 0.07 0.00 0.01 0.00 0.00 72.50 72.00 3dkt s THR 252 CO -0.05 0.02 0.96 0.72 -0.69 0.00 0.00 174.62 175.59 3dkt s PHE 253 N 2.46 -0.04 0.27 4.92 -0.12 -0.73 0.39 117.98 125.12 3dkt s PHE 253 Ca 0.03 -0.35 -0.12 0.00 -0.05 0.00 0.00 56.93 56.45 3dkt s PHE 253 Cb -0.13 0.68 0.05 0.00 -0.63 0.00 0.00 43.02 42.99 3dkt s PHE 253 CO -0.11 -0.95 0.61 -2.37 -0.05 0.00 0.00 175.22 172.35 3dkt n THR 254 N -0.56 0.00 -3.60 -4.49 5.66 -0.90 -0.04 114.28 110.35 3dkt n THR 254 Ca -0.05 -0.68 -0.16 0.00 -3.05 0.00 0.00 64.05 60.11 3dkt n THR 254 Cb 0.60 0.70 -0.07 0.00 -1.55 0.00 0.00 70.33 70.01 3dkt n THR 254 CO 0.00 0.00 0.00 0.12 -3.05 0.00 0.00 175.07 172.14 3dkt s PHE 255 N -3.85 -0.67 -0.12 1.09 5.36 -1.26 -1.22 117.98 117.31 3dkt s PHE 255 Ca 0.12 1.41 -0.11 0.00 -0.96 0.00 0.00 56.93 57.39 3dkt s PHE 255 Cb -0.03 0.31 0.03 0.00 -0.34 0.00 0.00 43.02 42.99 3dkt s PHE 255 CO 0.08 -0.47 0.32 1.14 -1.46 0.00 0.00 175.22 174.83 3dkt s GLN 256 N -0.45 0.37 -0.51 10.12 -2.07 -0.76 -4.64 119.66 121.71 3dkt s GLN 256 Ca -0.06 0.45 -0.20 0.00 -1.82 0.00 0.00 55.36 53.73 3dkt s GLN 256 Cb -0.03 0.17 0.06 0.00 -1.09 0.00 0.00 33.01 32.12 3dkt s GLN 256 CO 0.05 -0.05 0.67 0.08 -1.32 0.00 0.00 175.29 174.72 3dkt s VAL 257 N 0.21 4.81 0.00 3.63 1.01 -1.26 -2.35 120.40 126.44 3dkt s VAL 257 Ca -0.00 -0.39 0.00 0.00 0.00 0.00 0.00 61.98 61.58 3dkt s VAL 257 Cb -0.02 -4.33 0.00 0.00 0.00 0.00 0.00 36.38 32.02 3dkt s VAL 257 CO 0.00 -0.85 0.41 0.52 0.00 0.00 0.00 175.10 175.19 3dkt n VAL 258 N 5.69 0.00 -3.33 2.92 0.31 0.21 -4.60 118.33 119.54 3dkt n VAL 258 Ca -0.05 0.84 -0.46 0.00 -0.01 0.00 0.00 64.34 64.65 3dkt n VAL 258 Cb 0.46 -1.69 -0.04 0.00 -0.91 0.00 0.00 33.84 31.65 3dkt n VAL 258 CO 0.00 0.00 0.00 0.20 -1.32 0.00 0.00 176.83 175.71 3dkt s ASN 259 N -2.22 6.37 0.55 4.52 0.01 -1.19 -4.92 114.94 118.05 3dkt s ASN 259 Ca 0.00 -2.12 0.33 0.00 -0.71 0.00 0.00 52.86 50.36 3dkt s ASN 259 Cb 0.00 -2.20 1.53 0.00 0.41 0.00 0.00 41.25 40.99 3dkt s ASN 259 CO 0.00 -0.75 2.06 -0.65 -1.51 0.00 0.00 177.10 176.25 3dkt h PRO 260 N 8.47 0.00 0.00 -0.60 0.11 -1.86 -2.59 132.00 135.53 3dkt h PRO 260 Ca -0.15 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.96 3dkt h PRO 260 Cb 1.08 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.19 3dkt h PRO 260 CO 0.93 0.06 0.00 -0.85 -0.21 0.00 0.00 178.00 177.94 3dkt n GLU 261 N -3.27 0.17 -0.41 1.05 0.00 -1.26 -1.15 120.64 115.77 3dkt n GLU 261 Ca -0.01 0.13 0.06 0.00 0.00 0.00 0.00 57.16 57.34 3dkt n GLU 261 Cb 0.26 -1.50 0.23 0.00 0.00 0.00 0.00 31.44 30.43 3dkt n GLU 261 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 3dkt n ALA 262 N -1.18 2.92 -3.27 -1.84 0.00 -0.98 -4.77 120.51 111.40 3dkt n ALA 262 Ca 0.05 -1.01 -0.21 0.00 0.00 0.00 0.00 53.44 52.27 3dkt n ALA 262 Cb 0.05 -1.02 -0.16 0.00 0.00 0.00 0.00 19.45 18.32 3dkt n ALA 262 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 3dkt s LEU 263 N -1.38 1.65 -0.06 0.00 2.96 -0.30 -2.45 118.68 119.10 3dkt s LEU 263 Ca 0.33 -0.20 -0.00 0.00 -0.22 0.00 0.00 54.13 54.03 3dkt s LEU 263 Cb 0.21 -0.59 0.03 0.00 0.50 0.00 0.00 46.19 46.34 3dkt s LEU 263 CO 0.15 0.03 -0.02 -0.63 -1.32 0.00 0.00 176.35 174.57 3dkt s ILE 264 N 0.47 0.45 0.39 6.68 1.01 1.00 -4.83 121.20 126.37 3dkt s ILE 264 Ca -0.08 0.02 -0.01 0.00 0.00 0.00 0.00 60.65 60.58 3dkt s ILE 264 Cb -0.12 -0.55 -0.03 0.00 0.01 0.00 0.00 42.46 41.78 3dkt s ILE 264 CO 0.01 0.25 0.62 -0.76 0.00 0.00 0.00 174.94 175.06 3dkt s LEU 265 N 1.54 3.87 0.21 2.97 1.43 0.25 -0.09 118.68 128.85 3dkt s LEU 265 Ca -0.01 0.51 0.08 0.00 -1.03 0.00 0.00 54.13 53.68 3dkt s LEU 265 Cb -0.13 -3.39 -0.05 0.00 0.03 0.00 0.00 46.19 42.65 3dkt s LEU 265 CO -0.03 -0.43 -0.15 -0.76 0.23 0.00 0.00 176.35 175.20 3dkt s LEU 266 N -4.45 2.56 0.00 1.79 1.43 -0.90 -1.99 118.68 117.12 3dkt s LEU 266 Ca 0.43 -1.02 0.00 0.00 -1.03 0.00 0.00 54.13 52.51 3dkt s LEU 266 Cb -0.10 -0.73 0.00 0.00 0.03 0.00 0.00 46.19 45.39 3dkt s LEU 266 CO 0.38 -0.14 0.00 2.29 0.23 0.00 0.00 176.35 179.11