#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1s17 s ILE 3 N 0.00 5.11 0.33 0.00 -1.09 -1.26 -4.39 121.20 119.90 1s17 s ILE 3 Ca 0.00 0.37 -0.06 0.00 -2.23 0.00 0.00 60.65 58.73 1s17 s ILE 3 Cb 0.00 -3.83 -0.05 0.00 -1.58 0.00 0.00 42.46 37.00 1s17 s ILE 3 CO 0.00 -0.04 0.62 -0.76 -1.23 0.00 0.00 174.94 173.53 1s17 s LEU 4 N 2.18 3.97 0.19 2.97 1.43 -1.26 -5.02 118.68 123.14 1s17 s LEU 4 Ca 0.16 0.80 -0.30 0.00 -1.03 0.00 0.00 54.13 53.76 1s17 s LEU 4 Cb -0.16 -3.65 -0.08 0.00 0.03 0.00 0.00 46.19 42.34 1s17 s LEU 4 CO 0.11 -0.27 1.11 0.21 0.23 0.00 0.00 176.35 177.73 1s17 s ASN 5 N -3.29 7.26 -0.29 2.29 2.47 -1.26 -4.94 114.94 117.17 1s17 s ASN 5 Ca 0.45 2.11 -0.13 0.00 0.42 0.00 0.00 52.86 55.72 1s17 s ASN 5 Cb -0.10 -2.61 -0.04 0.00 -1.45 0.00 0.00 41.25 37.05 1s17 s ASN 5 CO 0.32 -0.22 0.27 -0.63 -3.72 0.00 0.00 177.10 173.12 1s17 s ILE 6 N -0.29 5.25 0.63 -5.21 1.01 -1.26 -4.46 121.20 116.86 1s17 s ILE 6 Ca 0.49 0.25 -0.18 0.00 0.00 0.00 0.00 60.65 61.21 1s17 s ILE 6 Cb -0.30 -3.64 -0.02 0.00 0.01 0.00 0.00 42.46 38.51 1s17 s ILE 6 CO 0.35 0.16 1.21 0.18 0.00 0.00 0.00 174.94 176.85 1s17 n LEU 7 N 5.19 5.39 -4.16 2.97 4.77 0.59 -4.96 117.00 126.79 1s17 n LEU 7 Ca -0.11 0.84 -0.23 0.00 -0.03 0.00 0.00 56.01 56.47 1s17 n LEU 7 Cb 0.51 -1.52 -0.15 0.00 -2.33 0.00 0.00 43.42 39.94 1s17 n LEU 7 CO 0.36 -1.18 -0.49 -1.61 -1.33 0.00 0.00 177.39 173.14 1s17 s GLU 8 N -3.16 1.23 0.36 3.23 2.02 -1.26 -4.24 118.70 116.88 1s17 s GLU 8 Ca 0.80 -0.68 -0.27 0.00 0.02 0.00 0.00 54.97 54.84 1s17 s GLU 8 Cb -0.39 -1.23 -0.12 0.00 0.10 0.00 0.00 34.13 32.49 1s17 s GLU 8 CO 0.43 0.33 1.23 0.34 0.02 0.00 0.00 175.26 177.60 1s17 n PHE 9 N 2.36 2.03 -0.42 1.61 7.35 0.11 -1.03 117.46 129.48 1s17 n PHE 9 Ca -0.16 0.56 -0.11 0.00 -0.76 0.00 0.00 57.45 56.98 1s17 n PHE 9 Cb 0.54 -2.37 0.15 0.00 0.35 0.00 0.00 39.48 38.15 1s17 n PHE 9 CO 0.00 0.00 0.00 -0.35 -0.76 0.00 0.00 176.76 175.65 1s17 n PRO 10 N 0.45 2.21 -1.68 -7.13 -0.04 -1.26 -4.77 135.00 122.78 1s17 n PRO 10 Ca 0.06 -2.00 -0.51 0.00 -0.04 0.00 0.00 63.50 61.01 1s17 n PRO 10 Cb 0.36 -1.83 -0.05 0.00 -0.04 0.00 0.00 33.50 31.94 1s17 n PRO 10 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 1s17 n ASP 11 N -0.36 2.98 0.31 3.54 -0.08 -0.20 -4.82 116.55 117.93 1s17 n ASP 11 Ca 0.35 1.03 0.21 0.00 -1.51 0.00 0.00 54.79 54.87 1s17 n ASP 11 Cb 1.19 -1.30 1.10 0.00 2.34 0.00 0.00 41.12 44.45 1s17 n ASP 11 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 1s17 h PRO 12 N 7.90 0.00 0.00 -0.67 0.13 -2.00 -2.41 132.00 134.95 1s17 h PRO 12 Ca -0.47 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.64 1s17 h PRO 12 Cb 1.29 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.42 1s17 h PRO 12 CO 0.93 0.00 -0.06 0.00 -0.23 0.00 0.00 178.00 178.64 1s17 h ARG 13 N 0.00 0.00 0.00 0.86 3.08 -1.97 -0.82 114.38 115.53 1s17 h ARG 13 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1s17 h ARG 13 Cb 0.07 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.12 1s17 h ARG 13 CO 0.00 0.06 0.00 1.28 -1.07 0.00 0.00 179.97 180.24 1s17 n LEU 14 N -3.64 0.36 -0.52 3.04 4.77 -0.91 -2.16 117.00 117.94 1s17 n LEU 14 Ca -0.02 0.59 0.13 0.00 -0.03 0.00 0.00 56.01 56.68 1s17 n LEU 14 Cb 0.17 -0.55 0.37 0.00 -2.33 0.00 0.00 43.42 41.08 1s17 n LEU 14 CO 0.28 -0.43 0.73 0.54 -1.33 0.00 0.00 177.39 177.18 1s17 n ARG 15 N -1.90 1.58 -2.16 3.23 5.12 -0.31 -4.31 116.66 117.90 1s17 n ARG 15 Ca 0.03 -1.05 -0.41 0.00 -1.93 0.00 0.00 57.85 54.49 1s17 n ARG 15 Cb 0.19 -1.48 -0.02 0.00 -1.16 0.00 0.00 32.46 29.99 1s17 n ARG 15 CO 0.00 0.00 0.00 0.99 -1.93 0.00 0.00 177.63 176.69 1s17 s THR 16 N -2.14 2.84 -0.13 0.55 2.01 -0.92 -4.38 115.64 113.47 1s17 s THR 16 Ca 0.32 0.82 -0.25 0.00 0.31 0.00 0.00 61.69 62.88 1s17 s THR 16 Cb 0.20 -3.52 -0.02 0.00 0.01 0.00 0.00 72.50 69.17 1s17 s THR 16 CO 0.39 0.19 0.82 -0.63 -0.69 0.00 0.00 174.62 174.70 1s17 s ILE 17 N -0.98 4.92 0.45 1.82 -1.09 -1.26 -3.59 121.20 121.47 1s17 s ILE 17 Ca 0.50 1.64 -0.22 0.00 -2.23 0.00 0.00 60.65 60.34 1s17 s ILE 17 Cb -0.39 -4.14 -0.09 0.00 -1.58 0.00 0.00 42.46 36.27 1s17 s ILE 17 CO 0.50 0.09 1.04 0.00 -1.23 0.00 0.00 174.94 175.34 1s17 s ALA 18 N 1.71 2.96 -0.06 9.38 0.00 0.22 -4.93 121.76 131.04 1s17 s ALA 18 Ca 0.40 0.64 -0.12 0.00 0.00 0.00 0.00 51.96 52.88 1s17 s ALA 18 Cb -0.17 -3.26 -0.05 0.00 0.00 0.00 0.00 23.12 19.64 1s17 s ALA 18 CO 0.15 -0.26 0.29 0.15 0.00 0.00 0.00 175.76 176.10 1s17 s LYS 19 N -2.95 3.74 0.65 0.00 1.02 0.27 -4.67 119.74 117.80 1s17 s LYS 19 Ca 0.64 0.18 -0.17 0.00 0.02 0.00 0.00 55.97 56.63 1s17 s LYS 19 Cb -0.18 -3.22 -0.03 0.00 -0.52 0.00 0.00 37.83 33.88 1s17 s LYS 19 CO 0.23 0.71 0.98 -0.35 -0.92 0.00 0.00 175.35 175.99 1s17 n PRO 20 N 1.97 0.75 -3.04 -1.68 -0.04 -1.26 -1.12 135.00 130.58 1s17 n PRO 20 Ca -0.16 0.31 -0.41 0.00 -0.04 0.00 0.00 63.50 63.20 1s17 n PRO 20 Cb 0.53 -2.21 -0.05 0.00 -0.04 0.00 0.00 33.50 31.73 1s17 n PRO 20 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1s17 s VAL 21 N -1.62 4.97 -0.20 0.52 1.01 -1.26 -4.77 120.40 119.05 1s17 s VAL 21 Ca 0.76 1.32 0.20 0.00 0.00 0.00 0.00 61.98 64.26 1s17 s VAL 21 Cb -0.38 -4.00 -0.03 0.00 0.00 0.00 0.00 36.38 31.96 1s17 s VAL 21 CO 0.47 0.06 1.00 -0.33 0.00 0.00 0.00 175.10 176.31 1s17 h GLU 22 N 7.52 0.00 -2.68 2.72 5.08 -2.01 -3.46 114.58 121.75 1s17 h GLU 22 Ca -0.29 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 57.95 1s17 h GLU 22 Cb 1.13 0.00 -0.26 0.00 0.50 0.00 0.00 28.75 30.12 1s17 h GLU 22 CO 0.80 0.12 -0.29 0.54 -1.00 0.00 0.00 179.01 179.18 1s17 s VAL 23 N -3.19 -0.02 -0.88 3.13 0.11 -1.26 -5.08 120.40 113.21 1s17 s VAL 23 Ca -0.01 0.07 -0.17 0.00 -2.93 0.00 0.00 61.98 58.95 1s17 s VAL 23 Cb 0.09 -0.59 0.17 0.00 -1.53 0.00 0.00 36.38 34.52 1s17 s VAL 23 CO 0.79 0.03 0.96 -0.69 -3.33 0.00 0.00 175.10 172.86 1s17 s VAL 24 N 1.10 5.14 0.00 2.04 1.01 -1.26 -4.88 120.40 123.55 1s17 s VAL 24 Ca -0.07 -1.97 0.00 0.00 0.00 0.00 0.00 61.98 59.93 1s17 s VAL 24 Cb -0.07 -4.63 0.00 0.00 0.00 0.00 0.00 36.38 31.68 1s17 s VAL 24 CO -0.09 -1.28 0.00 -0.90 0.00 0.00 0.00 175.10 172.82 1s17 n ASP 25 N 5.37 0.06 0.12 3.32 5.68 -1.26 -4.77 116.55 125.07 1s17 n ASP 25 Ca 0.19 -0.02 -0.00 0.00 -0.50 0.00 0.00 54.79 54.45 1s17 n ASP 25 Cb 0.48 0.00 0.05 0.00 -1.14 0.00 0.00 41.12 40.51 1s17 n ASP 25 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 1s17 h ASP 26 N 0.00 0.00 -0.51 -1.12 5.19 -1.99 -2.27 116.42 115.72 1s17 h ASP 26 Ca 0.00 0.00 -0.06 0.00 -0.62 0.00 0.00 57.03 56.35 1s17 h ASP 26 Cb 0.00 0.00 -0.02 0.00 0.18 0.00 0.00 39.33 39.49 1s17 h ASP 26 CO 0.00 0.65 0.10 0.00 -3.12 0.00 0.00 179.24 176.87 1s17 h ALA 27 N 1.35 0.68 -0.32 3.45 0.00 -1.97 0.92 119.26 123.37 1s17 h ALA 27 Ca -0.01 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 1s17 h ALA 27 Cb 1.39 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.97 1s17 h ALA 27 CO 0.08 0.40 0.18 0.28 0.00 0.00 0.00 179.25 180.19 1s17 h VAL 28 N 0.72 1.13 0.00 0.00 2.07 -1.88 -0.73 116.25 117.57 1s17 h VAL 28 Ca 0.16 -0.35 -0.04 0.00 0.82 0.00 0.00 66.70 67.29 1s17 h VAL 28 Cb 0.38 0.78 -0.01 0.00 -1.52 0.00 0.00 31.29 30.92 1s17 h VAL 28 CO 0.01 0.14 -0.17 0.03 0.02 0.00 0.00 177.57 177.59 1s17 h ARG 29 N 0.40 0.00 -0.22 1.57 3.08 -0.82 -0.16 114.38 118.23 1s17 h ARG 29 Ca 0.11 0.00 -0.21 0.00 0.07 0.00 0.00 59.98 59.96 1s17 h ARG 29 Cb 0.06 0.00 0.01 0.00 0.08 0.00 0.00 29.97 30.12 1s17 h ARG 29 CO -0.02 0.17 -0.66 0.37 -1.07 0.00 0.00 179.97 178.76 1s17 h GLN 30 N 0.00 0.84 -0.53 0.04 5.75 -0.14 -1.01 115.11 120.07 1s17 h GLN 30 Ca -0.00 -0.61 0.01 0.00 -0.15 0.00 0.00 58.65 57.90 1s17 h GLN 30 Cb 0.34 0.10 -0.03 0.00 1.07 0.00 0.00 27.48 28.97 1s17 h GLN 30 CO 0.02 1.23 0.34 1.25 -2.65 0.00 0.00 178.83 179.02 1s17 h LEU 31 N 0.61 0.57 -0.81 -2.39 5.85 -0.59 -1.15 115.31 117.41 1s17 h LEU 31 Ca -0.02 -0.01 0.04 0.00 0.84 0.00 0.00 57.88 58.73 1s17 h LEU 31 Cb 1.28 -0.13 -0.05 0.00 0.37 0.00 0.00 40.66 42.13 1s17 h LEU 31 CO 0.14 0.41 0.51 0.40 -0.34 0.00 0.00 178.44 179.56 1s17 h ILE 32 N 0.69 1.09 -0.64 4.05 2.04 -0.86 0.11 117.51 123.99 1s17 h ILE 32 Ca 0.20 -0.33 -0.06 0.00 1.00 0.00 0.00 64.86 65.67 1s17 h ILE 32 Cb -0.05 0.04 -0.03 0.00 -0.74 0.00 0.00 36.82 36.05 1s17 h ILE 32 CO -0.06 0.18 0.17 0.44 0.00 0.00 0.00 178.15 178.87 1s17 h ASP 33 N 0.97 0.93 -0.33 1.72 3.32 -0.53 -0.08 116.42 122.41 1s17 h ASP 33 Ca 0.33 -0.18 -0.14 0.00 0.02 0.00 0.00 57.03 57.07 1s17 h ASP 33 Cb 0.06 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.36 1s17 h ASP 33 CO -0.13 0.89 -0.31 0.44 -1.72 0.00 0.00 179.24 178.41 1s17 h ASP 34 N 0.95 0.90 -0.37 6.45 3.32 -0.66 -1.65 116.42 125.35 1s17 h ASP 34 Ca 0.21 -0.37 -0.01 0.00 0.02 0.00 0.00 57.03 56.88 1s17 h ASP 34 Cb 0.32 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.60 1s17 h ASP 34 CO -0.00 1.13 0.20 0.24 -1.72 0.00 0.00 179.24 179.09 1s17 h MET 35 N 0.72 0.52 -0.58 3.56 2.86 -0.45 -0.00 114.93 121.57 1s17 h MET 35 Ca 0.08 -0.06 -0.01 0.00 -2.06 0.00 0.00 59.70 57.64 1s17 h MET 35 Cb 0.87 -0.10 -0.03 0.00 0.06 0.00 0.00 31.60 32.40 1s17 h MET 35 CO 0.08 0.44 0.31 0.74 1.06 0.00 0.00 176.91 179.54 1s17 h PHE 36 N 0.47 0.81 -0.39 -0.22 0.04 -0.89 0.16 116.94 116.91 1s17 h PHE 36 Ca 0.13 -0.02 0.01 0.00 2.80 0.00 0.00 57.97 60.89 1s17 h PHE 36 Cb 0.07 -0.26 -0.02 0.00 2.20 0.00 0.00 35.95 37.94 1s17 h PHE 36 CO -0.02 0.59 0.24 1.49 -0.60 0.00 0.00 178.31 180.00 1s17 h GLU 37 N 0.79 0.47 -0.19 1.51 4.57 -0.92 0.27 114.58 121.07 1s17 h GLU 37 Ca 0.20 -0.03 0.03 0.00 -1.18 0.00 0.00 59.36 58.38 1s17 h GLU 37 Cb 0.06 -0.11 -0.03 0.00 -0.16 0.00 0.00 28.75 28.51 1s17 h GLU 37 CO -0.03 0.31 0.01 1.15 -1.18 0.00 0.00 179.01 179.27 1s17 h THR 38 N 0.48 0.89 0.11 0.32 2.02 -0.70 -0.85 112.91 115.17 1s17 h THR 38 Ca 0.15 -0.03 -0.01 0.00 0.77 0.00 0.00 66.41 67.30 1s17 h THR 38 Cb -0.01 0.80 0.00 0.00 -1.74 0.00 0.00 68.15 67.20 1s17 h THR 38 CO -0.06 0.01 -0.05 -0.03 0.37 0.00 0.00 175.52 175.76 1s17 h MET 39 N 0.08 -0.14 -0.22 6.66 1.85 -0.27 -1.61 114.93 121.28 1s17 h MET 39 Ca 0.09 0.01 -0.05 0.00 -0.61 0.00 0.00 59.70 59.14 1s17 h MET 39 Cb 0.10 0.03 -0.01 0.00 0.43 0.00 0.00 31.60 32.15 1s17 h MET 39 CO -0.13 -0.06 -0.07 1.88 -0.40 0.00 0.00 176.91 178.12 1s17 h TYR 40 N -0.18 0.36 0.00 1.39 0.05 -0.31 -0.56 116.97 117.72 1s17 h TYR 40 Ca -0.02 -0.04 -0.11 0.00 0.05 0.00 0.00 58.73 58.62 1s17 h TYR 40 Cb 0.14 -0.10 -0.02 0.00 1.01 0.00 0.00 36.73 37.77 1s17 h TYR 40 CO -0.06 0.42 -0.51 0.93 -1.05 0.00 0.00 178.16 177.89 1s17 h GLU 41 N 0.33 0.00 -0.04 4.88 4.39 -0.92 -3.39 114.58 119.83 1s17 h GLU 41 Ca 0.07 0.00 0.03 0.00 0.34 0.00 0.00 59.36 59.80 1s17 h GLU 41 Cb 0.34 0.00 -0.06 0.00 -0.10 0.00 0.00 28.75 28.93 1s17 h GLU 41 CO 0.02 0.51 -0.50 0.00 -1.16 0.00 0.00 179.01 177.87 1s17 h ALA 42 N 1.49 -0.84 -2.23 3.43 0.00 -1.05 -3.47 119.26 116.59 1s17 h ALA 42 Ca -0.01 -0.06 -0.47 0.00 0.00 0.00 0.00 54.91 54.37 1s17 h ALA 42 Cb 1.29 0.90 -0.00 0.00 0.00 0.00 0.00 17.79 19.98 1s17 h ALA 42 CO 0.07 -1.06 -0.32 -1.25 0.00 0.00 0.00 179.25 176.69 1s17 s PRO 43 N -5.79 3.46 0.28 0.00 0.04 -1.26 -5.15 135.00 126.59 1s17 s PRO 43 Ca -0.16 -0.55 -0.08 0.00 0.04 0.00 0.00 61.00 60.25 1s17 s PRO 43 Cb 0.07 -2.79 -0.00 0.00 0.04 0.00 0.00 34.50 31.83 1s17 s PRO 43 CO 0.62 0.30 0.46 0.20 0.04 0.00 0.00 177.00 178.63 1s17 s GLY 44 N -3.96 0.95 0.00 0.56 0.00 -0.24 -5.02 107.32 99.61 1s17 s GLY 44 Ca 0.37 -1.18 0.13 0.00 0.00 0.00 0.00 44.72 44.05 1s17 s GLY 44 CO 0.32 -0.82 0.71 0.29 0.00 0.00 0.00 173.10 173.60 1s17 n ILE 45 N -0.44 0.00 -3.61 0.90 -5.35 -1.26 -4.56 119.36 105.04 1s17 n ILE 45 Ca -0.01 -0.31 -0.11 0.00 -0.27 0.00 0.00 62.75 62.05 1s17 n ILE 45 Cb 0.62 1.12 -0.04 0.00 -1.74 0.00 0.00 39.64 39.60 1s17 n ILE 45 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1s17 s GLY 46 N -1.83 -0.30 -0.28 3.28 0.00 -1.26 -0.43 107.32 106.50 1s17 s GLY 46 Ca 0.10 0.02 -0.23 0.00 0.00 0.00 0.00 44.72 44.61 1s17 s GLY 46 CO 0.40 -0.21 0.81 -2.27 0.00 0.00 0.00 173.10 171.83 1s17 s LEU 47 N -2.81 -0.69 0.05 0.66 2.96 0.20 -4.94 118.68 114.10 1s17 s LEU 47 Ca 0.04 1.28 0.03 0.00 -0.22 0.00 0.00 54.13 55.26 1s17 s LEU 47 Cb 0.01 2.27 -0.04 0.00 0.50 0.00 0.00 46.19 48.93 1s17 s LEU 47 CO -0.10 -0.22 0.00 0.00 -1.32 0.00 0.00 176.35 174.71 1s17 s ALA 48 N 0.61 3.29 0.38 5.97 0.00 -1.26 -1.06 121.76 129.68 1s17 s ALA 48 Ca -0.01 -1.04 0.05 0.00 0.00 0.00 0.00 51.96 50.96 1s17 s ALA 48 Cb -0.05 -1.26 0.75 0.00 0.00 0.00 0.00 23.12 22.56 1s17 s ALA 48 CO -0.05 0.68 2.02 0.00 0.00 0.00 0.00 175.76 178.41 1s17 h ALA 49 N 3.85 1.64 -0.96 0.00 0.00 -1.42 -0.09 119.26 122.29 1s17 h ALA 49 Ca -0.48 -0.03 0.22 0.00 0.00 0.00 0.00 54.91 54.61 1s17 h ALA 49 Cb 1.17 -0.21 -0.08 0.00 0.00 0.00 0.00 17.79 18.67 1s17 h ALA 49 CO 0.59 0.31 0.62 1.15 0.00 0.00 0.00 179.25 181.92 1s17 h THR 50 N 0.72 0.65 0.00 0.00 2.02 -1.65 0.56 112.91 115.20 1s17 h THR 50 Ca 0.21 -0.16 -0.02 0.00 0.77 0.00 0.00 66.41 67.21 1s17 h THR 50 Cb -0.02 0.14 -0.00 0.00 -1.74 0.00 0.00 68.15 66.52 1s17 h THR 50 CO -0.05 0.09 -0.11 1.56 0.37 0.00 0.00 175.52 177.37 1s17 h GLN 51 N 0.47 0.00 -0.44 6.66 4.20 -1.30 -1.31 115.11 123.39 1s17 h GLN 51 Ca 0.52 0.00 -0.07 0.00 0.06 0.00 0.00 58.65 59.16 1s17 h GLN 51 Cb 1.20 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.94 1s17 h GLN 51 CO -0.24 0.11 0.05 1.33 -0.67 0.00 0.00 178.83 179.42 1s17 n VAL 52 N -3.43 2.57 -2.27 -0.54 0.24 0.08 -0.30 118.33 114.68 1s17 n VAL 52 Ca -0.01 -1.82 -0.15 0.00 -2.04 0.00 0.00 64.34 60.32 1s17 n VAL 52 Cb 0.28 -0.29 -0.01 0.00 -1.47 0.00 0.00 33.84 32.35 1s17 n VAL 52 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 1s17 n ASN 53 N -0.26 -4.52 -4.11 -1.34 5.15 -0.49 -4.86 115.26 104.82 1s17 n ASN 53 Ca 0.28 -0.01 -0.33 0.00 -0.60 0.00 0.00 54.58 53.93 1s17 n ASN 53 Cb 1.08 -3.66 -0.15 0.00 -0.53 0.00 0.00 39.78 36.52 1s17 n ASN 53 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 1s17 s VAL 54 N -2.74 2.38 -1.37 3.44 1.01 -0.54 -4.99 120.40 117.59 1s17 s VAL 54 Ca 0.00 -1.48 -0.07 0.00 0.00 0.00 0.00 61.98 60.43 1s17 s VAL 54 Cb 0.00 -2.34 0.10 0.00 0.00 0.00 0.00 36.38 34.13 1s17 s VAL 54 CO 0.00 0.02 2.35 1.41 0.00 0.00 0.00 175.10 178.88 1s17 n HIS 55 N 4.50 2.69 -4.24 5.22 8.25 -1.26 -2.20 115.22 128.17 1s17 n HIS 55 Ca -0.15 -2.86 -0.21 0.00 -0.26 0.00 0.00 57.72 54.24 1s17 n HIS 55 Cb 0.43 -1.99 -0.12 0.00 1.12 0.00 0.00 29.99 29.43 1s17 n HIS 55 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 1s17 s LYS 56 N -0.09 1.01 -1.30 -0.41 1.02 -1.26 -0.56 119.74 118.15 1s17 s LYS 56 Ca 0.53 -1.12 -0.17 0.00 0.02 0.00 0.00 55.97 55.23 1s17 s LYS 56 Cb 0.16 -1.12 0.08 0.00 -0.52 0.00 0.00 37.83 36.43 1s17 s LYS 56 CO -0.07 0.25 1.75 0.54 -0.92 0.00 0.00 175.35 176.91 1s17 n ARG 57 N 1.02 3.19 -4.28 1.68 1.74 -0.27 -4.40 116.66 115.35 1s17 n ARG 57 Ca -0.19 -3.29 -0.20 0.00 -0.77 0.00 0.00 57.85 53.39 1s17 n ARG 57 Cb 0.54 -3.41 -0.16 0.00 -1.02 0.00 0.00 32.46 28.42 1s17 n ARG 57 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1s17 s ILE 58 N 3.70 0.66 -0.02 0.55 1.01 -1.26 -0.41 121.20 125.43 1s17 s ILE 58 Ca 0.52 -0.23 0.04 0.00 0.00 0.00 0.00 60.65 60.98 1s17 s ILE 58 Cb 0.04 -0.64 -0.01 0.00 0.01 0.00 0.00 42.46 41.86 1s17 s ILE 58 CO 0.05 0.24 -0.13 -0.69 0.00 0.00 0.00 174.94 174.41 1s17 s VAL 59 N 0.66 1.07 0.23 2.92 1.01 -0.00 -1.34 120.40 124.95 1s17 s VAL 59 Ca -0.10 -0.55 0.10 0.00 0.00 0.00 0.00 61.98 61.43 1s17 s VAL 59 Cb -0.13 -0.91 -0.05 0.00 0.00 0.00 0.00 36.38 35.30 1s17 s VAL 59 CO 0.01 0.31 -0.18 0.68 0.00 0.00 0.00 175.10 175.92 1s17 s VAL 60 N -0.11 2.10 0.01 2.92 -7.23 -0.22 -0.84 120.40 117.03 1s17 s VAL 60 Ca 0.01 -2.22 -0.28 0.00 -1.81 0.00 0.00 61.98 57.69 1s17 s VAL 60 Cb -0.07 -2.12 0.07 0.00 0.56 0.00 0.00 36.38 34.82 1s17 s VAL 60 CO 0.00 -0.42 0.63 -0.32 -0.31 0.00 0.00 175.10 174.68 1s17 s MET 61 N -3.34 1.09 -0.28 4.82 1.75 -0.59 -0.63 119.30 122.12 1s17 s MET 61 Ca 0.24 0.02 0.01 0.00 -1.25 0.00 0.00 55.69 54.71 1s17 s MET 61 Cb -0.04 0.51 0.16 0.00 2.84 0.00 0.00 34.83 38.30 1s17 s MET 61 CO 0.10 -0.38 0.43 0.34 -0.65 0.00 0.00 175.02 174.86 1s17 s ASP 62 N -1.63 0.05 0.00 1.11 -1.08 0.43 -1.03 116.67 114.52 1s17 s ASP 62 Ca -0.08 -0.09 0.18 0.00 -0.52 0.00 0.00 52.55 52.04 1s17 s ASP 62 Cb -0.00 1.26 0.74 0.00 -1.46 0.00 0.00 42.92 43.45 1s17 s ASP 62 CO 0.03 -0.33 1.52 0.18 0.52 0.00 0.00 175.17 177.09 1s17 n LEU 63 N 5.37 1.18 -4.92 -1.34 4.77 -1.26 -4.62 117.00 116.18 1s17 n LEU 63 Ca -0.00 -0.51 -0.27 0.00 -0.03 0.00 0.00 56.01 55.20 1s17 n LEU 63 Cb 0.50 -0.09 0.05 0.00 -2.33 0.00 0.00 43.42 41.55 1s17 n LEU 63 CO 0.00 0.26 0.58 -0.94 -1.33 0.00 0.00 177.39 175.96 1s17 s SER 64 N -1.46 5.28 0.00 -1.43 1.04 -1.26 -4.98 113.70 110.88 1s17 s SER 64 Ca 0.28 0.65 0.27 0.00 0.48 0.00 0.00 55.95 57.63 1s17 s SER 64 Cb 0.15 -1.49 0.86 0.00 0.10 0.00 0.00 66.02 65.63 1s17 s SER 64 CO 0.22 -1.29 1.63 -0.62 0.98 0.00 0.00 173.24 174.16 1s17 n GLU 65 N -2.75 1.72 -1.24 4.02 1.02 -1.26 -4.36 120.64 117.78 1s17 n GLU 65 Ca 0.06 -1.11 0.04 0.00 -0.02 0.00 0.00 57.16 56.14 1s17 n GLU 65 Cb 0.59 -1.48 0.06 0.00 -0.02 0.00 0.00 31.44 30.59 1s17 n GLU 65 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 1s17 n ASP 66 N 0.32 1.14 -1.73 1.62 5.75 -1.26 -5.00 116.55 117.39 1s17 n ASP 66 Ca 0.17 -2.44 -0.20 0.00 -0.01 0.00 0.00 54.79 52.32 1s17 n ASP 66 Cb 0.40 -0.35 -0.07 0.00 -1.03 0.00 0.00 41.12 40.07 1s17 n ASP 66 CO 0.00 0.00 0.00 0.29 -0.11 0.00 0.00 177.20 177.38 1s17 n LYS 67 N 0.09 -1.50 -0.10 0.11 4.01 -1.26 -4.83 118.16 114.68 1s17 n LYS 67 Ca 0.09 1.12 0.12 0.00 -0.51 0.00 0.00 58.31 59.12 1s17 n LYS 67 Cb 1.02 -5.54 0.22 0.00 -0.51 0.00 0.00 35.03 30.23 1s17 n LYS 67 CO 0.00 0.00 0.00 -1.13 -1.11 0.00 0.00 177.40 175.16 1s17 n SER 68 N -1.38 2.98 -3.15 4.39 3.41 -1.26 -4.61 113.62 114.01 1s17 n SER 68 Ca -0.20 -1.93 -0.20 0.00 -0.26 0.00 0.00 58.87 56.27 1s17 n SER 68 Cb 0.65 -0.14 -0.03 0.00 -0.26 0.00 0.00 64.21 64.43 1s17 n SER 68 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1s17 n GLU 69 N 1.23 1.40 -2.05 4.33 1.02 -1.26 -5.07 120.64 120.23 1s17 n GLU 69 Ca 0.17 -3.66 -0.40 0.00 -0.02 0.00 0.00 57.16 53.25 1s17 n GLU 69 Cb 0.56 -1.79 -0.01 0.00 -0.02 0.00 0.00 31.44 30.17 1s17 n GLU 69 CO 0.00 0.00 0.00 -1.25 1.18 0.00 0.00 177.13 177.06 1s17 s PRO 70 N -2.56 4.21 -0.00 3.49 0.04 -1.26 -4.35 135.00 134.56 1s17 s PRO 70 Ca 0.41 2.25 0.03 0.00 0.04 0.00 0.00 61.00 63.74 1s17 s PRO 70 Cb 0.33 -2.97 -0.01 0.00 0.04 0.00 0.00 34.50 31.89 1s17 s PRO 70 CO -0.09 -0.33 -0.10 1.03 0.04 0.00 0.00 177.00 177.55 1s17 s ARG 71 N -1.97 0.80 -0.07 4.56 0.52 -0.20 -5.01 118.95 117.59 1s17 s ARG 71 Ca 0.52 -0.38 0.05 0.00 -0.52 0.00 0.00 55.73 55.40 1s17 s ARG 71 Cb -0.40 -0.77 -0.01 0.00 0.52 0.00 0.00 34.95 34.29 1s17 s ARG 71 CO 0.53 0.21 -0.22 0.08 0.02 0.00 0.00 175.30 175.92 1s17 s VAL 72 N -0.29 2.31 -0.19 3.52 1.01 -1.26 -1.54 120.40 123.96 1s17 s VAL 72 Ca 0.03 -0.97 -0.02 0.00 0.00 0.00 0.00 61.98 61.02 1s17 s VAL 72 Cb -0.04 -1.86 0.06 0.00 0.00 0.00 0.00 36.38 34.53 1s17 s VAL 72 CO -0.00 0.57 0.01 -0.36 0.00 0.00 0.00 175.10 175.32 1s17 s PHE 73 N -0.17 1.22 -0.10 5.22 0.40 -0.02 -4.67 117.98 119.86 1s17 s PHE 73 Ca -0.03 -0.93 -0.03 0.00 -0.60 0.00 0.00 56.93 55.34 1s17 s PHE 73 Cb -0.14 -1.10 -0.03 0.00 0.51 0.00 0.00 43.02 42.26 1s17 s PHE 73 CO 0.04 -0.61 0.02 0.42 0.70 0.00 0.00 175.22 175.79 1s17 s ILE 74 N 1.79 4.49 -1.34 0.64 1.01 -0.31 -0.82 121.20 126.65 1s17 s ILE 74 Ca -0.01 -0.18 -0.07 0.00 0.00 0.00 0.00 60.65 60.40 1s17 s ILE 74 Cb -0.17 -2.91 0.00 0.00 0.01 0.00 0.00 42.46 39.40 1s17 s ILE 74 CO -0.07 0.59 0.49 0.59 0.00 0.00 0.00 174.94 176.54 1s17 n ASN 75 N 2.26 -1.54 -4.79 3.58 3.02 0.46 -0.79 115.26 117.45 1s17 n ASN 75 Ca -0.19 -1.05 -0.34 0.00 -0.03 0.00 0.00 54.58 52.97 1s17 n ASN 75 Cb 0.54 -2.94 -0.02 0.00 -0.61 0.00 0.00 39.78 36.75 1s17 n ASN 75 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 1s17 s PRO 76 N -6.54 3.69 0.11 3.52 0.04 -1.26 -4.51 135.00 130.04 1s17 s PRO 76 Ca 0.14 1.44 -0.08 0.00 0.04 0.00 0.00 61.00 62.53 1s17 s PRO 76 Cb -0.06 -2.08 -0.01 0.00 0.04 0.00 0.00 34.50 32.40 1s17 s PRO 76 CO 0.90 -0.54 0.20 -1.21 0.04 0.00 0.00 177.00 176.38 1s17 s GLU 77 N -3.22 0.91 0.08 4.56 2.02 -0.09 -5.00 118.70 117.96 1s17 s GLU 77 Ca 0.69 -1.04 -0.13 0.00 0.02 0.00 0.00 54.97 54.50 1s17 s GLU 77 Cb -0.19 0.34 0.02 0.00 0.10 0.00 0.00 34.13 34.41 1s17 s GLU 77 CO 0.22 -0.30 0.31 -0.59 0.02 0.00 0.00 175.26 174.93 1s17 s PHE 78 N -3.90 -0.08 -0.02 1.61 -0.12 -1.26 -1.15 117.98 113.06 1s17 s PHE 78 Ca 0.09 -0.19 0.00 0.00 -0.05 0.00 0.00 56.93 56.77 1s17 s PHE 78 Cb 0.05 0.12 0.03 0.00 -0.63 0.00 0.00 43.02 42.58 1s17 s PHE 78 CO -0.08 -0.59 0.03 -2.00 -0.05 0.00 0.00 175.22 172.53 1s17 s GLU 79 N -3.34 -0.02 0.32 1.99 2.12 -0.55 -4.93 118.70 114.29 1s17 s GLU 79 Ca 0.00 0.18 -0.29 0.00 0.36 0.00 0.00 54.97 55.22 1s17 s GLU 79 Cb 0.02 -0.25 -0.12 0.00 0.26 0.00 0.00 34.13 34.04 1s17 s GLU 79 CO -0.08 -0.16 1.46 -2.30 -0.54 0.00 0.00 175.26 173.64 1s17 n PRO 80 N 4.14 2.45 0.01 4.30 -0.02 -1.26 -0.33 135.00 144.29 1s17 n PRO 80 Ca -0.27 0.87 0.11 0.00 -2.02 0.00 0.00 63.50 62.18 1s17 n PRO 80 Cb 0.50 -2.57 -0.07 0.00 -0.02 0.00 0.00 33.50 31.35 1s17 n PRO 80 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1s17 n LEU 81 N 1.31 0.51 -4.20 2.45 4.77 0.91 -4.79 117.00 117.97 1s17 n LEU 81 Ca 0.06 -0.10 -0.12 0.00 -0.03 0.00 0.00 56.01 55.82 1s17 n LEU 81 Cb 0.36 -0.04 -0.10 0.00 -2.33 0.00 0.00 43.42 41.31 1s17 n LEU 81 CO 0.63 0.06 -0.25 0.28 -1.33 0.00 0.00 177.39 176.79 1s17 s THR 82 N -3.27 0.06 -2.34 -5.08 -1.32 -1.25 -5.03 115.64 97.42 1s17 s THR 82 Ca 0.01 -1.99 0.25 0.00 -1.21 0.00 0.00 61.69 58.75 1s17 s THR 82 Cb 0.14 -2.45 0.26 0.00 -1.51 0.00 0.00 72.50 68.95 1s17 s THR 82 CO 0.85 -0.06 1.43 -0.62 -2.21 0.00 0.00 174.62 174.01 1s17 n GLU 83 N -0.26 1.53 -2.38 7.08 1.02 -1.26 -4.84 120.64 121.53 1s17 n GLU 83 Ca 0.01 -1.10 -0.35 0.00 -0.02 0.00 0.00 57.16 55.70 1s17 n GLU 83 Cb 0.66 -1.48 -0.02 0.00 -0.02 0.00 0.00 31.44 30.58 1s17 n GLU 83 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1s17 s GLU 84 N -2.23 3.67 0.20 3.49 0.41 -1.26 -4.95 118.70 118.03 1s17 s GLU 84 Ca 0.28 1.57 0.11 0.00 -0.41 0.00 0.00 54.97 56.51 1s17 s GLU 84 Cb 0.20 -2.19 -0.04 0.00 -1.78 0.00 0.00 34.13 30.32 1s17 s GLU 84 CO 0.43 -0.58 -0.21 -1.64 -0.49 0.00 0.00 175.26 172.77 1s17 s MET 85 N -3.04 1.63 0.03 1.61 -1.94 -1.26 -1.59 119.30 114.74 1s17 s MET 85 Ca 0.67 -1.52 -0.00 0.00 -1.71 0.00 0.00 55.69 53.13 1s17 s MET 85 Cb -0.23 -1.89 -0.03 0.00 2.01 0.00 0.00 34.83 34.70 1s17 s MET 85 CO 0.27 0.40 -0.03 0.34 -0.01 0.00 0.00 175.02 175.98 1s17 s ASP 86 N -2.81 0.34 -0.01 3.03 -1.08 0.37 -4.74 116.67 111.76 1s17 s ASP 86 Ca 0.23 -0.66 -0.01 0.00 -0.52 0.00 0.00 52.55 51.58 1s17 s ASP 86 Cb -0.08 0.13 -0.04 0.00 -1.46 0.00 0.00 42.92 41.48 1s17 s ASP 86 CO 0.11 -0.39 0.09 -1.58 0.52 0.00 0.00 175.17 173.92 1s17 s GLN 87 N -2.26 3.12 -0.12 4.34 0.74 -1.26 -1.17 119.66 123.05 1s17 s GLN 87 Ca -0.08 -0.46 -0.14 0.00 0.05 0.00 0.00 55.36 54.74 1s17 s GLN 87 Cb -0.04 -2.89 0.04 0.00 1.10 0.00 0.00 33.01 31.21 1s17 s GLN 87 CO -0.04 0.66 0.37 -0.47 -0.55 0.00 0.00 175.29 175.26 1s17 s TYR 88 N -1.20 -0.38 -0.36 1.67 5.04 -0.90 -4.96 117.35 116.26 1s17 s TYR 88 Ca 0.23 0.90 -0.25 0.00 -2.44 0.00 0.00 57.07 55.51 1s17 s TYR 88 Cb -0.12 0.14 0.01 0.00 0.35 0.00 0.00 41.96 42.34 1s17 s TYR 88 CO 0.14 -0.23 0.88 -0.65 -1.34 0.00 0.00 175.55 174.35 1s17 s GLN 89 N -0.05 3.83 0.09 4.97 -0.21 -1.26 -1.11 119.66 125.91 1s17 s GLN 89 Ca -0.02 0.51 0.02 0.00 0.02 0.00 0.00 55.36 55.89 1s17 s GLN 89 Cb -0.03 -3.80 -0.04 0.00 1.00 0.00 0.00 33.01 30.14 1s17 s GLN 89 CO 0.01 -0.90 0.14 -1.21 -2.12 0.00 0.00 175.29 171.21 1s17 s GLU 90 N 3.33 3.09 0.43 2.91 2.02 0.30 -4.81 118.70 125.97 1s17 s GLU 90 Ca 0.36 -0.62 0.03 0.00 0.02 0.00 0.00 54.97 54.76 1s17 s GLU 90 Cb -0.12 -2.83 -0.03 0.00 0.10 0.00 0.00 34.13 31.25 1s17 s GLU 90 CO 0.18 0.57 0.08 0.20 0.02 0.00 0.00 175.26 176.31 1s17 s GLY 91 N -2.54 2.69 -0.27 -1.39 0.00 -1.26 -1.29 107.32 103.25 1s17 s GLY 91 Ca 0.32 -1.09 -0.23 0.00 0.00 0.00 0.00 44.72 43.71 1s17 s GLY 91 CO 0.24 -1.94 0.71 0.00 0.00 0.00 0.00 173.10 172.11 1s17 h LEU 93 N 5.40 0.00 -0.45 0.00 3.38 -1.95 -1.10 115.31 120.59 1s17 h LEU 93 Ca -0.29 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.68 1s17 h LEU 93 Cb 1.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.92 1s17 h LEU 93 CO 0.07 0.19 -0.06 -1.20 0.09 0.00 0.00 178.44 177.53 1s17 n SER 94 N -3.76 0.75 -3.18 -0.43 7.64 -1.26 -3.86 113.62 109.52 1s17 n SER 94 Ca -0.02 -1.01 -0.20 0.00 1.01 0.00 0.00 58.87 58.65 1s17 n SER 94 Cb 0.30 -0.01 -0.04 0.00 -1.01 0.00 0.00 64.21 63.45 1s17 n SER 94 CO 0.00 0.00 0.00 0.52 -3.01 0.00 0.00 175.04 172.55 1s17 n VAL 95 N -0.56 -0.05 -1.73 0.44 0.31 -0.43 0.09 118.33 116.40 1s17 n VAL 95 Ca 0.18 -4.54 -0.42 0.00 -0.01 0.00 0.00 64.34 59.55 1s17 n VAL 95 Cb 0.27 -0.70 -0.01 0.00 -0.91 0.00 0.00 33.84 32.49 1s17 n VAL 95 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 1s17 n PRO 96 N 0.49 2.53 -0.51 5.55 -0.04 -1.12 -2.82 135.00 139.08 1s17 n PRO 96 Ca 0.25 0.90 0.00 0.00 -0.04 0.00 0.00 63.50 64.60 1s17 n PRO 96 Cb 0.61 -2.63 0.00 0.00 -0.04 0.00 0.00 33.50 31.44 1s17 n PRO 96 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1s17 n GLY 97 N 1.85 0.96 3.39 0.55 0.00 -1.26 -5.04 105.19 105.64 1s17 n GLY 97 Ca 0.08 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.78 1s17 n GLY 97 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1s17 s PHE 98 N -3.12 2.59 -0.06 1.61 0.40 -1.13 -5.11 117.98 113.18 1s17 s PHE 98 Ca 0.00 -0.38 -0.01 0.00 -0.60 0.00 0.00 56.93 55.94 1s17 s PHE 98 Cb 0.00 -1.62 0.03 0.00 0.51 0.00 0.00 43.02 41.93 1s17 s PHE 98 CO 0.00 0.02 0.01 0.71 0.70 0.00 0.00 175.22 176.66 1s17 s TYR 99 N -0.47 0.52 0.04 0.36 1.51 -1.26 -4.31 117.35 113.75 1s17 s TYR 99 Ca 0.06 -0.07 0.01 0.00 -1.01 0.00 0.00 57.07 56.05 1s17 s TYR 99 Cb -0.12 -0.68 -0.03 0.00 -0.11 0.00 0.00 41.96 41.02 1s17 s TYR 99 CO 0.01 -0.27 -0.05 -1.21 -1.11 0.00 0.00 175.55 172.93 1s17 s GLU 100 N 1.81 0.50 0.37 -0.62 0.41 -0.41 -4.87 118.70 115.89 1s17 s GLU 100 Ca 0.02 -0.87 -0.26 0.00 -0.41 0.00 0.00 54.97 53.45 1s17 s GLU 100 Cb -0.12 -0.02 -0.09 0.00 -1.78 0.00 0.00 34.13 32.12 1s17 s GLU 100 CO -0.04 -0.03 1.15 -0.80 -0.49 0.00 0.00 175.26 175.05 1s17 s ASN 101 N -1.99 6.72 -0.02 -0.19 0.01 -1.26 -0.54 114.94 117.67 1s17 s ASN 101 Ca -0.06 2.31 0.01 0.00 -0.71 0.00 0.00 52.86 54.40 1s17 s ASN 101 Cb -0.04 -2.61 0.01 0.00 0.41 0.00 0.00 41.25 39.02 1s17 s ASN 101 CO -0.03 -0.54 -0.01 -0.69 -1.51 0.00 0.00 177.10 174.32 1s17 s VAL 102 N -1.38 0.18 -0.10 1.60 1.01 -0.27 -4.88 120.40 116.55 1s17 s VAL 102 Ca 0.54 -0.00 -0.14 0.00 0.00 0.00 0.00 61.98 62.38 1s17 s VAL 102 Cb -0.30 -0.22 -0.05 0.00 0.00 0.00 0.00 36.38 35.81 1s17 s VAL 102 CO 0.38 0.10 0.33 -1.81 0.00 0.00 0.00 175.10 174.11 1s17 s ASP 103 N 0.51 6.57 0.11 3.32 -0.00 -1.26 -2.12 116.67 123.81 1s17 s ASP 103 Ca -0.05 0.68 -0.10 0.00 -0.00 0.00 0.00 52.55 53.07 1s17 s ASP 103 Cb -0.08 -2.20 0.01 0.00 -0.00 0.00 0.00 42.92 40.65 1s17 s ASP 103 CO -0.01 0.19 0.26 -0.13 -0.00 0.00 0.00 175.17 175.48 1s17 s ARG 104 N -0.16 0.97 0.26 8.23 0.52 -0.32 -4.93 118.95 123.52 1s17 s ARG 104 Ca 0.20 -0.95 -0.30 0.00 -0.52 0.00 0.00 55.73 54.16 1s17 s ARG 104 Cb -0.14 0.38 -0.14 0.00 0.52 0.00 0.00 34.95 35.57 1s17 s ARG 104 CO 0.07 -0.34 1.22 -2.30 0.02 0.00 0.00 175.30 173.98 1s17 n PRO 105 N -0.13 1.67 0.20 3.54 -0.02 -1.26 -0.47 135.00 138.52 1s17 n PRO 105 Ca -0.14 0.59 0.09 0.00 -2.02 0.00 0.00 63.50 62.03 1s17 n PRO 105 Cb 0.63 -2.12 0.19 0.00 -0.02 0.00 0.00 33.50 32.18 1s17 n PRO 105 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 1s17 h GLN 106 N 3.11 0.00 -3.39 -0.52 4.20 -1.59 -3.44 115.11 113.48 1s17 h GLN 106 Ca -0.43 0.00 -0.26 0.00 0.06 0.00 0.00 58.65 58.02 1s17 h GLN 106 Cb 1.31 0.00 -0.32 0.00 0.30 0.00 0.00 27.48 28.77 1s17 h GLN 106 CO 0.68 0.17 -0.65 0.21 -0.67 0.00 0.00 178.83 178.56 1s17 s LYS 107 N -3.21 0.04 0.07 1.46 2.20 -1.26 -3.87 119.74 115.18 1s17 s LYS 107 Ca 0.05 0.27 -0.01 0.00 -0.36 0.00 0.00 55.97 55.92 1s17 s LYS 107 Cb 0.06 -0.17 -0.04 0.00 -1.51 0.00 0.00 37.83 36.17 1s17 s LYS 107 CO 0.68 -0.15 -0.01 0.14 -0.36 0.00 0.00 175.35 175.65 1s17 s VAL 108 N 0.98 0.22 -0.24 4.02 -7.23 -0.48 -0.06 120.40 117.60 1s17 s VAL 108 Ca -0.08 -1.84 -0.07 0.00 -1.81 0.00 0.00 61.98 58.18 1s17 s VAL 108 Cb -0.11 -1.66 -0.02 0.00 0.56 0.00 0.00 36.38 35.15 1s17 s VAL 108 CO -0.04 -0.86 0.05 -0.60 -0.31 0.00 0.00 175.10 173.34 1s17 s ARG 109 N -3.95 3.59 0.22 4.82 3.52 0.55 -0.76 118.95 126.94 1s17 s ARG 109 Ca 0.12 -0.52 -0.19 0.00 -0.13 0.00 0.00 55.73 55.01 1s17 s ARG 109 Cb 0.08 -3.26 -0.08 0.00 -1.56 0.00 0.00 34.95 30.13 1s17 s ARG 109 CO -0.07 -0.20 0.71 0.42 -0.81 0.00 0.00 175.30 175.35 1s17 s ILE 110 N 1.58 4.61 -0.02 4.11 1.01 0.15 -1.48 121.20 131.16 1s17 s ILE 110 Ca 0.06 1.21 0.02 0.00 0.00 0.00 0.00 60.65 61.94 1s17 s ILE 110 Cb -0.15 -3.82 0.00 0.00 0.01 0.00 0.00 42.46 38.50 1s17 s ILE 110 CO 0.02 0.18 -0.08 -0.54 0.00 0.00 0.00 174.94 174.52 1s17 s LYS 111 N -2.06 0.83 0.20 2.79 1.02 -0.30 -0.86 119.74 121.37 1s17 s LYS 111 Ca 0.43 -0.27 -0.22 0.00 0.02 0.00 0.00 55.97 55.93 1s17 s LYS 111 Cb -0.16 -0.79 0.07 0.00 -0.52 0.00 0.00 37.83 36.43 1s17 s LYS 111 CO 0.20 0.11 1.00 0.00 -0.92 0.00 0.00 175.35 175.74 1s17 s ALA 112 N 0.16 -1.51 -0.01 5.17 0.00 -0.77 -0.91 121.76 123.88 1s17 s ALA 112 Ca -0.02 -0.32 -0.01 0.00 0.00 0.00 0.00 51.96 51.61 1s17 s ALA 112 Cb -0.07 0.73 -0.04 0.00 0.00 0.00 0.00 23.12 23.74 1s17 s ALA 112 CO 0.00 -1.05 0.09 -0.51 0.00 0.00 0.00 175.76 174.29 1s17 s LEU 113 N -3.31 3.97 0.00 0.00 1.43 0.03 -0.44 118.68 120.37 1s17 s LEU 113 Ca 0.20 0.19 -0.02 0.00 -1.03 0.00 0.00 54.13 53.47 1s17 s LEU 113 Cb -0.03 -2.29 0.05 0.00 0.03 0.00 0.00 46.19 43.95 1s17 s LEU 113 CO 0.06 0.28 0.33 -0.90 0.23 0.00 0.00 176.35 176.35 1s17 n ASP 114 N 1.22 0.30 0.08 2.29 5.68 0.38 -1.16 116.55 125.32 1s17 n ASP 114 Ca -0.13 -1.29 0.07 0.00 -0.50 0.00 0.00 54.79 52.94 1s17 n ASP 114 Cb 0.53 -0.23 0.33 0.00 -1.14 0.00 0.00 41.12 40.61 1s17 n ASP 114 CO 0.00 0.00 0.00 -2.11 -1.33 0.00 0.00 177.20 173.76 1s17 n ARG 115 N -1.65 0.08 0.00 0.11 1.85 -1.26 -0.56 116.66 115.23 1s17 n ARG 115 Ca 0.05 0.50 0.10 0.00 -1.00 0.00 0.00 57.85 57.50 1s17 n ARG 115 Cb 0.18 -1.72 0.03 0.00 -1.05 0.00 0.00 32.46 29.90 1s17 n ARG 115 CO 0.00 0.00 0.00 -0.25 -0.01 0.00 0.00 177.63 177.37 1s17 n ASP 116 N -1.88 2.13 0.00 2.89 8.00 -1.26 -4.92 116.55 121.51 1s17 n ASP 116 Ca 0.00 -1.57 0.00 0.00 0.71 0.00 0.00 54.79 53.94 1s17 n ASP 116 Cb 0.07 0.31 0.00 0.00 -0.02 0.00 0.00 41.12 41.49 1s17 n ASP 116 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1s17 n GLY 117 N 1.25 0.75 3.77 0.44 0.00 0.27 -4.90 105.19 106.77 1s17 n GLY 117 Ca 0.09 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.73 1s17 n GLY 117 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1s17 s ASN 118 N -2.47 6.85 0.24 1.61 0.01 -1.26 -4.68 114.94 115.24 1s17 s ASN 118 Ca 0.00 1.01 -0.30 0.00 -0.71 0.00 0.00 52.86 52.87 1s17 s ASN 118 Cb 0.00 -2.32 -0.09 0.00 0.41 0.00 0.00 41.25 39.26 1s17 s ASN 118 CO 0.00 0.12 1.21 -2.16 -1.51 0.00 0.00 177.10 174.76 1s17 s PRO 119 N -0.15 4.49 0.20 -0.60 0.04 -1.26 -0.47 135.00 137.24 1s17 s PRO 119 Ca 0.28 1.94 -0.06 0.00 0.04 0.00 0.00 61.00 63.20 1s17 s PRO 119 Cb -0.17 -3.19 -0.02 0.00 0.04 0.00 0.00 34.50 31.16 1s17 s PRO 119 CO 0.14 -0.05 0.26 -0.59 0.04 0.00 0.00 177.00 176.80 1s17 s PHE 120 N -0.51 0.74 0.25 0.56 -0.71 0.42 -4.92 117.98 113.80 1s17 s PHE 120 Ca 0.51 -1.04 0.05 0.00 -1.04 0.00 0.00 56.93 55.41 1s17 s PHE 120 Cb -0.34 -0.22 -0.05 0.00 -1.21 0.00 0.00 43.02 41.19 1s17 s PHE 120 CO 0.41 -0.76 -0.05 -1.83 -1.34 0.00 0.00 175.22 171.66 1s17 s GLU 121 N -4.07 1.42 -0.28 1.99 -1.05 -1.26 -1.85 118.70 113.61 1s17 s GLU 121 Ca 0.28 -1.71 -0.16 0.00 -0.15 0.00 0.00 54.97 53.23 1s17 s GLU 121 Cb 0.04 -0.92 0.10 0.00 -0.44 0.00 0.00 34.13 32.91 1s17 s GLU 121 CO 0.08 -0.00 0.78 -2.00 0.95 0.00 0.00 175.26 175.07 1s17 s GLU 122 N -3.77 0.60 0.15 -4.83 2.12 -0.04 -4.96 118.70 107.96 1s17 s GLU 122 Ca 0.28 1.06 -0.29 0.00 0.36 0.00 0.00 54.97 56.37 1s17 s GLU 122 Cb 0.04 0.14 -0.07 0.00 0.26 0.00 0.00 34.13 34.50 1s17 s GLU 122 CO 0.10 -0.13 0.93 0.08 -0.54 0.00 0.00 175.26 175.70 1s17 s VAL 123 N 1.58 4.38 -0.04 3.70 1.01 -1.26 0.32 120.40 130.09 1s17 s VAL 123 Ca -0.10 2.03 0.03 0.00 0.00 0.00 0.00 61.98 63.94 1s17 s VAL 123 Cb -0.05 -4.30 0.01 0.00 0.00 0.00 0.00 36.38 32.04 1s17 s VAL 123 CO -0.18 0.38 -0.11 0.00 0.00 0.00 0.00 175.10 175.19 1s17 s ALA 124 N -0.41 1.05 0.11 5.51 0.00 0.06 -4.93 121.76 123.16 1s17 s ALA 124 Ca 0.44 -0.38 -0.01 0.00 0.00 0.00 0.00 51.96 52.01 1s17 s ALA 124 Cb -0.24 -0.42 -0.04 0.00 0.00 0.00 0.00 23.12 22.42 1s17 s ALA 124 CO 0.30 0.14 0.03 -1.21 0.00 0.00 0.00 175.76 175.02 1s17 s GLU 125 N 0.35 0.87 3.82 0.00 2.02 -1.26 -1.39 118.70 123.10 1s17 s GLU 125 Ca -0.07 -1.39 0.00 0.00 0.02 0.00 0.00 54.97 53.53 1s17 s GLU 125 Cb -0.11 0.17 0.00 0.00 0.10 0.00 0.00 34.13 34.28 1s17 s GLU 125 CO 0.01 -0.20 0.00 0.41 0.02 0.00 0.00 175.26 175.50 1s17 n GLY 126 N -0.06 0.78 0.34 -1.39 0.00 -1.25 -3.29 105.19 100.32 1s17 n GLY 126 Ca -0.08 -0.69 0.19 0.00 0.00 0.00 0.00 46.02 45.44 1s17 n GLY 126 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1s17 h LEU 127 N 0.00 0.63 -0.74 0.99 6.46 -1.99 -0.29 115.31 120.38 1s17 h LEU 127 Ca 0.00 0.15 -0.01 0.00 -0.12 0.00 0.00 57.88 57.91 1s17 h LEU 127 Cb 0.00 0.06 -0.04 0.00 -0.73 0.00 0.00 40.66 39.96 1s17 h LEU 127 CO 0.00 0.04 0.43 0.25 -0.62 0.00 0.00 178.44 178.54 1s17 h LEU 128 N 0.51 0.89 -0.59 2.25 5.85 -1.95 0.40 115.31 122.67 1s17 h LEU 128 Ca 0.67 -0.07 -0.13 0.00 0.84 0.00 0.00 57.88 59.19 1s17 h LEU 128 Cb 1.35 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 42.14 1s17 h LEU 128 CO -0.51 0.70 -0.28 0.00 -0.34 0.00 0.00 178.44 178.01 1s17 h ALA 129 N 1.23 0.77 0.13 1.25 0.00 -1.12 -0.87 119.26 120.65 1s17 h ALA 129 Ca 0.26 -0.40 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 1s17 h ALA 129 Cb -0.02 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.63 1s17 h ALA 129 CO -0.05 0.65 -0.06 0.28 0.00 0.00 0.00 179.25 180.07 1s17 h VAL 130 N 0.70 1.00 -0.56 0.00 2.07 -1.12 -2.78 116.25 115.57 1s17 h VAL 130 Ca 0.08 -0.59 -0.02 0.00 0.82 0.00 0.00 66.70 66.99 1s17 h VAL 130 Cb 0.82 1.37 -0.03 0.00 -1.52 0.00 0.00 31.29 31.94 1s17 h VAL 130 CO 0.07 0.14 0.28 0.00 0.02 0.00 0.00 177.57 178.08 1s17 h ILE 132 N 0.75 1.22 -0.35 0.00 6.09 -1.17 0.54 117.51 124.59 1s17 h ILE 132 Ca 0.19 -0.58 -0.13 0.00 -1.37 0.00 0.00 64.86 62.98 1s17 h ILE 132 Cb 0.09 0.28 -0.01 0.00 0.47 0.00 0.00 36.82 37.66 1s17 h ILE 132 CO -0.03 0.25 -0.28 1.56 -3.07 0.00 0.00 178.15 176.59 1s17 h GLN 133 N 1.00 0.80 -0.69 2.19 4.20 -1.18 -0.59 115.11 120.84 1s17 h GLN 133 Ca 0.25 -0.40 0.00 0.00 0.06 0.00 0.00 58.65 58.56 1s17 h GLN 133 Cb 0.06 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 27.81 1s17 h GLN 133 CO -0.04 1.03 0.44 1.25 -0.67 0.00 0.00 178.83 180.84 1s17 h HIS 134 N 0.59 0.89 -0.09 2.96 2.76 -0.73 -0.75 115.15 120.78 1s17 h HIS 134 Ca 0.06 0.01 -0.23 0.00 -2.20 0.00 0.00 60.37 58.02 1s17 h HIS 134 Cb 0.85 -0.30 0.01 0.00 1.55 0.00 0.00 27.41 29.52 1s17 h HIS 134 CO 0.06 0.58 -0.85 0.93 -1.30 0.00 0.00 177.93 177.35 1s17 h GLU 135 N 0.94 0.66 -0.56 5.26 4.39 -0.77 -2.69 114.58 121.81 1s17 h GLU 135 Ca 0.25 -0.59 -0.04 0.00 0.34 0.00 0.00 59.36 59.32 1s17 h GLU 135 Cb -0.07 0.14 -0.03 0.00 -0.10 0.00 0.00 28.75 28.69 1s17 h GLU 135 CO -0.05 1.20 0.20 0.00 -1.16 0.00 0.00 179.01 179.20 1s17 h ASP 137 N 0.80 0.22 -0.69 0.00 3.32 -0.99 -1.73 116.42 117.36 1s17 h ASP 137 Ca 0.19 0.04 0.13 0.00 0.02 0.00 0.00 57.03 57.40 1s17 h ASP 137 Cb 0.19 0.01 -0.09 0.00 0.22 0.00 0.00 39.33 39.66 1s17 h ASP 137 CO -0.01 0.17 0.24 0.45 -1.72 0.00 0.00 179.24 178.36 1s17 h HIS 138 N 0.37 0.41 0.00 4.55 3.86 -1.00 0.16 115.15 123.49 1s17 h HIS 138 Ca 0.20 0.04 0.00 0.00 -1.16 0.00 0.00 60.37 59.44 1s17 h HIS 138 Cb 0.16 -0.08 0.00 0.00 1.06 0.00 0.00 27.41 28.55 1s17 h HIS 138 CO -0.13 0.05 0.00 -0.07 0.86 0.00 0.00 177.93 178.63 1s17 h LEU 139 N 0.39 0.00 -3.33 2.43 3.38 -1.02 0.10 115.31 117.27 1s17 h LEU 139 Ca 0.37 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.34 1s17 h LEU 139 Cb 0.54 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.29 1s17 h LEU 139 CO -0.39 0.00 0.00 0.59 0.09 0.00 0.00 178.44 178.73 1s17 n ASN 140 N -2.73 4.49 -1.21 -0.43 3.02 0.35 -0.61 115.26 118.14 1s17 n ASN 140 Ca -0.01 -2.88 -0.12 0.00 -0.03 0.00 0.00 54.58 51.53 1s17 n ASN 140 Cb 0.12 -0.57 -0.02 0.00 -0.61 0.00 0.00 39.78 38.69 1s17 n ASN 140 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1s17 n GLY 141 N 0.04 0.38 3.46 7.41 0.00 0.36 -4.79 105.19 112.06 1s17 n GLY 141 Ca 0.23 -0.41 -0.32 0.00 0.00 0.00 0.00 46.02 45.52 1s17 n GLY 141 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1s17 s LYS 142 N -4.04 2.38 0.25 1.61 2.20 0.07 -4.36 119.74 117.85 1s17 s LYS 142 Ca 0.00 -0.78 0.11 0.00 -0.36 0.00 0.00 55.97 54.94 1s17 s LYS 142 Cb 0.00 -2.32 -0.05 0.00 -1.51 0.00 0.00 37.83 33.96 1s17 s LYS 142 CO 0.00 0.60 -0.12 -0.51 -0.36 0.00 0.00 175.35 174.96 1s17 s LEU 143 N -0.90 2.83 0.51 5.43 1.43 -1.26 -2.76 118.68 123.95 1s17 s LEU 143 Ca 0.12 -0.81 0.27 0.00 -1.03 0.00 0.00 54.13 52.68 1s17 s LEU 143 Cb -0.11 -1.40 1.39 0.00 0.03 0.00 0.00 46.19 46.11 1s17 s LEU 143 CO 0.02 0.05 2.05 2.19 0.23 0.00 0.00 176.35 180.88 1s17 h PHE 144 N 2.37 0.00 0.00 0.29 -5.15 -1.97 -0.49 116.94 111.99 1s17 h PHE 144 Ca -0.43 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.34 1s17 h PHE 144 Cb 1.24 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.41 1s17 h PHE 144 CO 0.73 0.13 0.00 1.33 -2.00 0.00 0.00 178.31 178.50 1s17 n VAL 145 N -3.64 0.94 0.28 0.88 0.24 -1.26 -1.55 118.33 114.22 1s17 n VAL 145 Ca -0.02 0.43 0.17 0.00 -2.04 0.00 0.00 64.34 62.88 1s17 n VAL 145 Cb 0.25 -1.38 0.68 0.00 -1.47 0.00 0.00 33.84 31.92 1s17 n VAL 145 CO 0.00 0.00 0.00 0.44 -2.14 0.00 0.00 176.83 175.13 1s17 h ASP 146 N 0.00 0.00 0.83 -1.34 3.32 -1.49 -2.66 116.42 115.08 1s17 h ASP 146 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1s17 h ASP 146 Cb 0.22 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.77 1s17 h ASP 146 CO 0.00 0.00 -0.57 -1.22 -1.72 0.00 0.00 179.24 175.73 1s17 n TYR 147 N -3.07 0.47 -1.95 4.55 4.01 -0.59 -4.93 117.16 115.65 1s17 n TYR 147 Ca 0.01 0.14 -0.29 0.00 -0.16 0.00 0.00 57.90 57.59 1s17 n TYR 147 Cb 0.30 -0.60 0.07 0.00 -0.31 0.00 0.00 39.34 38.80 1s17 n TYR 147 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 1s17 s LEU 148 N -4.03 2.72 0.68 7.72 1.43 -1.00 -5.03 118.68 121.16 1s17 s LEU 148 Ca 0.07 0.87 -0.16 0.00 -1.03 0.00 0.00 54.13 53.88 1s17 s LEU 148 Cb 0.14 -3.51 0.01 0.00 0.03 0.00 0.00 46.19 42.86 1s17 s LEU 148 CO 0.71 -1.62 1.21 -0.94 0.23 0.00 0.00 176.35 175.93 1s17 s SER 149 N -4.48 4.61 0.34 2.29 1.04 -1.26 -4.79 113.70 111.45 1s17 s SER 149 Ca 0.60 2.36 0.02 0.00 0.48 0.00 0.00 55.95 59.41 1s17 s SER 149 Cb -0.11 -2.59 0.62 0.00 0.10 0.00 0.00 66.02 64.04 1s17 s SER 149 CO 0.49 -1.98 1.97 0.00 0.98 0.00 0.00 173.24 174.70 1s17 h THR 150 N 0.16 1.17 -0.27 2.02 1.03 -1.96 -1.12 112.91 113.95 1s17 h THR 150 Ca -0.49 -0.41 -0.13 0.00 -0.01 0.00 0.00 66.41 65.37 1s17 h THR 150 Cb 1.30 0.40 -0.01 0.00 -1.07 0.00 0.00 68.15 68.77 1s17 h THR 150 CO 0.52 0.19 -0.35 -0.07 -0.01 0.00 0.00 175.52 175.79 1s17 h LEU 151 N 0.78 0.62 -0.29 0.00 3.38 -1.99 -0.56 115.31 117.25 1s17 h LEU 151 Ca 0.20 -0.26 -0.10 0.00 0.09 0.00 0.00 57.88 57.82 1s17 h LEU 151 Cb 0.01 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.58 1s17 h LEU 151 CO -0.03 0.92 -0.20 0.50 0.09 0.00 0.00 178.44 179.72 1s17 h LYS 152 N 0.50 0.64 -0.64 1.13 3.64 -1.80 -1.62 116.57 118.42 1s17 h LYS 152 Ca 0.05 -0.31 -0.02 0.00 -1.27 0.00 0.00 60.65 59.11 1s17 h LYS 152 Cb 0.85 -0.00 -0.03 0.00 -0.41 0.00 0.00 32.23 32.63 1s17 h LYS 152 CO 0.07 0.90 0.33 -0.09 -2.27 0.00 0.00 179.45 178.39 1s17 h ARG 153 N 0.38 0.89 -0.21 1.90 2.43 -1.03 -1.33 114.38 117.42 1s17 h ARG 153 Ca 0.06 -0.10 -0.13 0.00 -0.81 0.00 0.00 59.98 58.99 1s17 h ARG 153 Cb 0.74 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 30.11 1s17 h ARG 153 CO 0.05 0.67 -0.43 0.22 -1.51 0.00 0.00 179.97 178.97 1s17 h ASP 154 N 0.89 0.53 -0.59 -3.80 -0.00 -0.90 0.87 116.42 113.43 1s17 h ASP 154 Ca 0.22 -0.24 -0.05 0.00 -0.00 0.00 0.00 57.03 56.96 1s17 h ASP 154 Cb 0.06 -0.15 -0.02 0.00 -0.00 0.00 0.00 39.33 39.21 1s17 h ASP 154 CO -0.03 0.90 0.18 -0.09 -0.00 0.00 0.00 179.24 180.20 1s17 h ARG 155 N 0.41 0.91 -0.06 0.28 2.43 -0.75 -0.76 114.38 116.84 1s17 h ARG 155 Ca 0.03 -0.20 -0.00 0.00 -0.81 0.00 0.00 59.98 59.00 1s17 h ARG 155 Cb 0.93 -0.13 -0.00 0.00 -0.42 0.00 0.00 29.97 30.34 1s17 h ARG 155 CO 0.08 0.82 0.03 0.82 -1.51 0.00 0.00 179.97 180.21 1s17 h ILE 156 N 0.83 1.11 -0.30 1.20 2.04 -0.84 -2.22 117.51 119.34 1s17 h ILE 156 Ca 0.19 -0.33 0.06 0.00 1.00 0.00 0.00 64.86 65.78 1s17 h ILE 156 Cb 0.29 1.23 -0.05 0.00 -0.74 0.00 0.00 36.82 37.54 1s17 h ILE 156 CO -0.01 0.09 -0.05 -0.09 0.00 0.00 0.00 178.15 178.10 1s17 h ARG 157 N -0.03 0.03 -0.95 2.37 2.43 -0.56 -1.11 114.38 116.56 1s17 h ARG 157 Ca 0.02 -0.00 0.04 0.00 -0.81 0.00 0.00 59.98 59.23 1s17 h ARG 157 Cb 0.13 -0.01 -0.06 0.00 -0.42 0.00 0.00 29.97 29.62 1s17 h ARG 157 CO -0.00 0.02 0.62 0.87 -1.51 0.00 0.00 179.97 179.97 1s17 h LYS 158 N 0.03 1.17 -0.17 0.20 1.57 -1.08 0.56 116.57 118.84 1s17 h LYS 158 Ca 0.14 -0.07 -0.02 0.00 -1.87 0.00 0.00 60.65 58.83 1s17 h LYS 158 Cb 0.21 -0.26 -0.01 0.00 0.08 0.00 0.00 32.23 32.25 1s17 h LYS 158 CO -0.28 0.77 0.01 0.87 -0.57 0.00 0.00 179.45 180.25 1s17 h LYS 159 N 1.20 0.29 -0.69 3.15 1.57 -0.77 -1.40 116.57 119.92 1s17 h LYS 159 Ca 0.38 -0.09 -0.08 0.00 -1.87 0.00 0.00 60.65 59.00 1s17 h LYS 159 Cb 0.01 -0.03 -0.03 0.00 0.08 0.00 0.00 32.23 32.26 1s17 h LYS 159 CO -0.12 0.49 0.14 -0.07 -0.57 0.00 0.00 179.45 179.31 1s17 h LEU 160 N 0.06 1.07 -0.92 2.94 3.38 -0.83 -0.45 115.31 120.57 1s17 h LEU 160 Ca 0.05 -0.25 0.00 0.00 0.09 0.00 0.00 57.88 57.78 1s17 h LEU 160 Cb 0.34 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.77 1s17 h LEU 160 CO 0.01 1.04 0.59 -0.33 0.09 0.00 0.00 178.44 179.84 1s17 h GLU 161 N 1.05 1.22 -0.32 1.13 5.08 0.28 0.25 114.58 123.26 1s17 h GLU 161 Ca 0.21 -0.09 -0.01 0.00 -1.00 0.00 0.00 59.36 58.47 1s17 h GLU 161 Cb 0.41 -0.27 -0.01 0.00 0.50 0.00 0.00 28.75 29.38 1s17 h GLU 161 CO 0.01 0.82 0.15 -0.22 -1.00 0.00 0.00 179.01 178.77 1s17 h LYS 162 N 1.25 0.46 -0.75 2.33 3.64 -0.77 -1.76 116.57 120.98 1s17 h LYS 162 Ca 0.33 -0.07 0.05 0.00 -1.27 0.00 0.00 60.65 59.69 1s17 h LYS 162 Cb -0.11 -0.08 -0.05 0.00 -0.41 0.00 0.00 32.23 31.57 1s17 h LYS 162 CO -0.07 0.44 0.45 1.96 -2.27 0.00 0.00 179.45 179.96 1s17 h GLN 163 N 0.38 0.83 -0.59 1.90 4.20 -0.43 -1.20 115.11 120.21 1s17 h GLN 163 Ca 0.11 -0.05 -0.05 0.00 0.06 0.00 0.00 58.65 58.72 1s17 h GLN 163 Cb 0.13 -0.19 -0.03 0.00 0.30 0.00 0.00 27.48 27.70 1s17 h GLN 163 CO -0.01 0.55 0.15 0.45 -0.67 0.00 0.00 178.83 179.30 1s17 h HIS 164 N 0.85 0.93 -0.54 2.96 3.86 -0.53 -0.94 115.15 121.75 1s17 h HIS 164 Ca 0.32 -0.09 -0.09 0.00 -1.16 0.00 0.00 60.37 59.35 1s17 h HIS 164 Cb 0.12 -0.27 -0.02 0.00 1.06 0.00 0.00 27.41 28.30 1s17 h HIS 164 CO -0.05 0.77 -0.04 0.00 0.86 0.00 0.00 177.93 179.47 1s17 h ARG 165 N 0.87 0.95 0.00 2.45 3.08 -0.69 -2.81 114.38 118.22 1s17 h ARG 165 Ca 0.19 -0.30 -0.01 0.00 0.07 0.00 0.00 59.98 59.93 1s17 h ARG 165 Cb 0.30 -0.09 -0.00 0.00 0.08 0.00 0.00 29.97 30.26 1s17 h ARG 165 CO -0.00 0.96 -0.05 1.96 -1.07 0.00 0.00 179.97 181.77 1s17 h GLN 166 N 0.86 0.00 -0.02 0.04 4.20 -0.76 -3.52 115.11 115.92 1s17 h GLN 166 Ca 0.15 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.86 1s17 h GLN 166 Cb 0.56 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.34 1s17 h GLN 166 CO 0.03 0.05 0.00 1.04 -0.67 0.00 0.00 178.83 179.28