#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 4.86 0.33 0.00 -1.09 -1.26 -4.26 121.20 119.78 1s17 s ILE 3 Ca 0.00 0.13 -0.08 0.00 -2.23 0.00 0.00 60.65 58.46 1s17 s ILE 3 Cb 0.00 -4.17 -0.06 0.00 -1.58 0.00 0.00 42.46 36.65 1s17 s ILE 3 CO 0.00 -0.54 0.65 -0.76 -1.23 0.00 0.00 174.94 173.06 1s17 s LEU 4 N 2.74 3.97 0.15 2.97 1.43 -1.26 -5.04 118.68 123.64 1s17 s LEU 4 Ca 0.22 0.94 -0.30 0.00 -1.03 0.00 0.00 54.13 53.95 1s17 s LEU 4 Cb -0.14 -3.78 -0.07 0.00 0.03 0.00 0.00 46.19 42.23 1s17 s LEU 4 CO 0.18 -0.27 1.13 0.21 0.23 0.00 0.00 176.35 177.83 1s17 s ASN 5 N -3.05 7.20 -0.25 2.29 2.47 -1.26 -4.97 114.94 117.37 1s17 s ASN 5 Ca 0.48 2.08 -0.11 0.00 0.42 0.00 0.00 52.86 55.73 1s17 s ASN 5 Cb -0.11 -2.60 -0.05 0.00 -1.45 0.00 0.00 41.25 37.05 1s17 s ASN 5 CO 0.29 -0.30 0.18 -0.63 -3.72 0.00 0.00 177.10 172.92 1s17 s ILE 6 N 0.12 5.34 0.46 -5.21 1.01 -1.26 -4.43 121.20 117.23 1s17 s ILE 6 Ca 0.52 0.20 -0.23 0.00 0.00 0.00 0.00 60.65 61.14 1s17 s ILE 6 Cb -0.30 -3.52 -0.07 0.00 0.01 0.00 0.00 42.46 38.58 1s17 s ILE 6 CO 0.34 0.31 1.21 -0.76 0.00 0.00 0.00 174.94 176.04 1s17 s LEU 7 N 1.28 4.04 0.01 2.97 1.43 0.77 -4.99 118.68 124.19 1s17 s LEU 7 Ca 0.08 2.43 0.07 0.00 -1.03 0.00 0.00 54.13 55.68 1s17 s LEU 7 Cb -0.14 -4.17 -0.02 0.00 0.03 0.00 0.00 46.19 41.88 1s17 s LEU 7 CO 0.06 -0.98 -0.23 -1.61 0.23 0.00 0.00 176.35 173.83 1s17 s GLU 8 N -2.62 1.71 0.35 1.70 2.02 -1.26 -4.34 118.70 116.27 1s17 s GLU 8 Ca 0.63 -0.88 -0.27 0.00 0.02 0.00 0.00 54.97 54.47 1s17 s GLU 8 Cb -0.32 -1.73 -0.12 0.00 0.10 0.00 0.00 34.13 32.06 1s17 s GLU 8 CO 0.39 0.46 1.21 0.34 0.02 0.00 0.00 175.26 177.68 1s17 n PHE 9 N 2.26 1.97 -0.50 1.61 7.35 0.77 -1.02 117.46 129.89 1s17 n PHE 9 Ca -0.16 0.57 -0.16 0.00 -0.76 0.00 0.00 57.45 56.94 1s17 n PHE 9 Cb 0.52 -2.36 0.11 0.00 0.35 0.00 0.00 39.48 38.10 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 0.47 1.83 -1.68 -7.13 -0.04 -1.26 -4.81 135.00 122.38 1s17 n PRO 10 Ca 0.06 -1.95 -0.47 0.00 -0.04 0.00 0.00 63.50 61.10 1s17 n PRO 10 Cb 0.36 -1.76 -0.04 0.00 -0.04 0.00 0.00 33.50 32.01 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 -0.50 3.44 0.28 3.54 -0.08 -0.19 -4.83 116.55 118.21 1s17 n ASP 11 Ca 0.39 1.00 0.19 0.00 -1.51 0.00 0.00 54.79 54.85 1s17 n ASP 11 Cb 1.18 -1.41 0.94 0.00 2.34 0.00 0.00 41.12 44.17 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 8.30 0.00 0.00 -0.67 0.13 -2.00 -2.44 132.00 135.32 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 1.26 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.39 1s17 h PRO 12 CO 0.93 0.00 -0.07 0.00 -0.23 0.00 0.00 178.00 178.63 1s17 h ARG 13 N 0.00 0.00 0.00 0.86 3.08 -1.97 -1.56 114.38 114.79 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 0.13 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.18 1s17 h ARG 13 CO 0.00 0.07 0.00 1.28 -1.07 0.00 0.00 179.97 180.25 1s17 n LEU 14 N -3.35 0.57 -0.58 3.04 4.77 -0.92 -2.32 117.00 118.22 1s17 n LEU 14 Ca -0.01 0.65 0.13 0.00 -0.03 0.00 0.00 56.01 56.75 1s17 n LEU 14 Cb 0.23 -0.59 0.44 0.00 -2.33 0.00 0.00 43.42 41.17 1s17 n LEU 14 CO 0.27 -0.56 0.82 0.54 -1.33 0.00 0.00 177.39 177.13 1s17 n ARG 15 N -2.15 1.80 -2.39 3.23 5.12 -0.59 -4.28 116.66 117.40 1s17 n ARG 15 Ca 0.02 -1.16 -0.41 0.00 -1.93 0.00 0.00 57.85 54.37 1s17 n ARG 15 Cb 0.20 -1.47 -0.04 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 -1.98 3.50 -0.22 0.55 2.01 -0.98 -4.35 115.64 114.17 1s17 s THR 16 Ca 0.36 1.34 -0.24 0.00 0.31 0.00 0.00 61.69 63.46 1s17 s THR 16 Cb 0.21 -3.86 -0.01 0.00 0.01 0.00 0.00 72.50 68.85 1s17 s THR 16 CO 0.32 0.25 0.78 -0.63 -0.69 0.00 0.00 174.62 174.66 1s17 s ILE 17 N -0.44 4.89 0.36 1.82 -1.09 -1.26 -3.76 121.20 121.72 1s17 s ILE 17 Ca 0.50 1.49 -0.26 0.00 -2.23 0.00 0.00 60.65 60.15 1s17 s ILE 17 Cb -0.33 -4.08 -0.09 0.00 -1.58 0.00 0.00 42.46 36.38 1s17 s ILE 17 CO 0.39 -0.01 1.14 0.00 -1.23 0.00 0.00 174.94 175.23 1s17 s ALA 18 N 2.50 3.24 0.18 9.38 0.00 -0.09 -4.94 121.76 132.03 1s17 s ALA 18 Ca 0.34 0.93 -0.17 0.00 0.00 0.00 0.00 51.96 53.06 1s17 s ALA 18 Cb -0.16 -3.36 -0.08 0.00 0.00 0.00 0.00 23.12 19.53 1s17 s ALA 18 CO 0.09 -0.39 0.64 0.15 0.00 0.00 0.00 175.76 176.25 1s17 s LYS 19 N -2.06 4.14 0.68 0.00 1.02 0.03 -4.65 119.74 118.89 1s17 s LYS 19 Ca 0.53 0.71 -0.17 0.00 0.02 0.00 0.00 55.97 57.06 1s17 s LYS 19 Cb -0.30 -2.92 0.01 0.00 -0.52 0.00 0.00 37.83 34.09 1s17 s LYS 19 CO 0.39 0.44 1.24 -2.14 -0.92 0.00 0.00 175.35 174.36 1s17 s PRO 20 N -1.91 2.41 -0.18 -1.68 0.02 -1.26 -1.00 135.00 131.39 1s17 s PRO 20 Ca 0.40 1.89 -0.20 0.00 0.02 0.00 0.00 61.00 63.11 1s17 s PRO 20 Cb -0.16 -1.85 -0.03 0.00 0.02 0.00 0.00 34.50 32.48 1s17 s PRO 20 CO 0.20 -1.66 0.57 0.08 -0.33 0.00 0.00 177.00 175.86 1s17 s VAL 21 N -1.70 5.07 -0.01 3.83 1.01 -1.26 -4.78 120.40 122.55 1s17 s VAL 21 Ca 0.78 1.09 0.12 0.00 0.00 0.00 0.00 61.98 63.97 1s17 s VAL 21 Cb -0.32 -3.90 -0.21 0.00 0.00 0.00 0.00 36.38 31.95 1s17 s VAL 21 CO 0.41 0.17 0.84 -0.33 0.00 0.00 0.00 175.10 176.19 1s17 h GLU 22 N 7.32 0.00 -2.51 2.72 4.39 -2.01 -3.47 114.58 121.02 1s17 h GLU 22 Ca -0.34 0.00 -0.09 0.00 0.34 0.00 0.00 59.36 59.26 1s17 h GLU 22 Cb 1.16 0.00 -0.23 0.00 -0.10 0.00 0.00 28.75 29.57 1s17 h GLU 22 CO 0.76 0.59 -0.14 0.54 -1.16 0.00 0.00 179.01 179.60 1s17 s VAL 23 N -2.66 -0.00 -1.19 3.13 0.11 -1.26 -5.07 120.40 113.47 1s17 s VAL 23 Ca -0.03 0.01 -0.12 0.00 -2.93 0.00 0.00 61.98 58.92 1s17 s VAL 23 Cb 0.08 -0.70 0.21 0.00 -1.53 0.00 0.00 36.38 34.44 1s17 s VAL 23 CO 0.82 0.01 1.39 0.52 -3.33 0.00 0.00 175.10 174.50 1s17 n VAL 24 N 3.09 4.40 -1.47 2.04 0.31 -1.26 -4.87 118.33 120.57 1s17 n VAL 24 Ca -0.15 -4.94 0.00 0.00 -0.01 0.00 0.00 64.34 59.24 1s17 n VAL 24 Cb 0.56 -2.48 0.00 0.00 -0.91 0.00 0.00 33.84 31.02 1s17 n VAL 24 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 1s17 n ASP 25 N 4.48 0.00 -0.05 4.52 5.68 -1.26 -4.81 116.55 125.10 1s17 n ASP 25 Ca 0.33 -0.61 -0.09 0.00 -0.50 0.00 0.00 54.79 53.92 1s17 n ASP 25 Cb 0.41 0.00 -0.03 0.00 -1.14 0.00 0.00 41.12 40.36 1s17 n ASP 25 CO 0.00 0.00 0.00 -0.78 -1.33 0.00 0.00 177.20 175.09 1s17 h ASP 26 N 0.00 0.15 -0.55 -1.12 1.82 -1.98 -1.02 116.42 113.73 1s17 h ASP 26 Ca 0.00 0.01 0.07 0.00 -0.39 0.00 0.00 57.03 56.72 1s17 h ASP 26 Cb 0.00 -0.02 -0.06 0.00 0.68 0.00 0.00 39.33 39.93 1s17 h ASP 26 CO 0.00 0.12 0.21 0.00 -1.61 0.00 0.00 179.24 177.96 1s17 h ALA 27 N 1.11 0.69 -0.56 -0.78 0.00 -1.97 -0.07 119.26 117.69 1s17 h ALA 27 Ca 0.09 0.06 -0.06 0.00 0.00 0.00 0.00 54.91 55.01 1s17 h ALA 27 Cb 0.03 0.02 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 1s17 h ALA 27 CO -0.07 -0.18 0.13 0.28 0.00 0.00 0.00 179.25 179.42 1s17 h VAL 28 N 0.41 1.25 -0.63 0.00 2.07 -1.84 -1.34 116.25 116.17 1s17 h VAL 28 Ca 0.26 -0.89 0.01 0.00 0.82 0.00 0.00 66.70 66.90 1s17 h VAL 28 Cb 0.28 0.76 -0.03 0.00 -1.52 0.00 0.00 31.29 30.77 1s17 h VAL 28 CO -0.25 0.33 0.42 0.03 0.02 0.00 0.00 177.57 178.12 1s17 h ARG 29 N 0.80 0.83 -0.23 1.57 3.08 -0.61 -0.71 114.38 119.10 1s17 h ARG 29 Ca 0.17 -0.05 -0.09 0.00 0.07 0.00 0.00 59.98 60.08 1s17 h ARG 29 Cb 0.35 -0.19 -0.00 0.00 0.08 0.00 0.00 29.97 30.21 1s17 h ARG 29 CO 0.00 0.55 -0.21 0.37 -1.07 0.00 0.00 179.97 179.61 1s17 h GLN 30 N 0.85 0.54 -0.65 0.04 5.75 -0.61 -2.51 115.11 118.51 1s17 h GLN 30 Ca 0.23 -0.28 0.06 0.00 -0.15 0.00 0.00 58.65 58.51 1s17 h GLN 30 Cb -0.09 0.01 -0.06 0.00 1.07 0.00 0.00 27.48 28.41 1s17 h GLN 30 CO -0.05 0.86 0.35 1.25 -2.65 0.00 0.00 178.83 178.60 1s17 h LEU 31 N 0.23 0.51 -0.44 -2.39 5.85 -0.72 -1.14 115.31 117.22 1s17 h LEU 31 Ca 0.04 0.03 0.04 0.00 0.84 0.00 0.00 57.88 58.83 1s17 h LEU 31 Cb 0.76 -0.06 -0.04 0.00 0.37 0.00 0.00 40.66 41.68 1s17 h LEU 31 CO 0.05 0.33 0.20 0.40 -0.34 0.00 0.00 178.44 179.09 1s17 h ILE 32 N 0.65 0.93 -0.48 4.05 2.04 -1.04 0.19 117.51 123.86 1s17 h ILE 32 Ca 0.30 -0.14 -0.06 0.00 1.00 0.00 0.00 64.86 65.96 1s17 h ILE 32 Cb 0.20 0.49 -0.02 0.00 -0.74 0.00 0.00 36.82 36.75 1s17 h ILE 32 CO -0.19 0.07 0.05 0.44 0.00 0.00 0.00 178.15 178.52 1s17 h ASP 33 N 0.41 0.71 0.16 1.72 3.32 -0.95 -1.11 116.42 120.68 1s17 h ASP 33 Ca 0.20 -0.15 -0.14 0.00 0.02 0.00 0.00 57.03 56.96 1s17 h ASP 33 Cb 0.13 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 39.48 1s17 h ASP 33 CO -0.16 0.75 -0.52 0.44 -1.72 0.00 0.00 179.24 178.04 1s17 h ASP 34 N 0.72 0.44 -0.36 6.45 3.32 -0.40 -2.52 116.42 124.06 1s17 h ASP 34 Ca 0.15 -0.22 -0.03 0.00 0.02 0.00 0.00 57.03 56.95 1s17 h ASP 34 Cb 0.37 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 39.78 1s17 h ASP 34 CO 0.01 0.88 0.11 0.24 -1.72 0.00 0.00 179.24 178.76 1s17 h MET 35 N 0.31 0.57 -0.12 3.56 2.86 -0.12 -0.23 114.93 121.76 1s17 h MET 35 Ca 0.01 -0.12 0.02 0.00 -2.06 0.00 0.00 59.70 57.55 1s17 h MET 35 Cb 1.02 -0.08 -0.02 0.00 0.06 0.00 0.00 31.60 32.58 1s17 h MET 35 CO 0.09 0.58 -0.01 0.74 1.06 0.00 0.00 176.91 179.38 1s17 h PHE 36 N 0.44 -0.02 -0.92 -0.22 0.04 -1.10 0.19 116.94 115.35 1s17 h PHE 36 Ca 0.12 0.01 0.00 0.00 2.80 0.00 0.00 57.97 60.90 1s17 h PHE 36 Cb 0.26 0.03 -0.05 0.00 2.20 0.00 0.00 35.95 38.39 1s17 h PHE 36 CO 0.01 -0.02 0.59 0.93 -0.60 0.00 0.00 178.31 179.21 1s17 h GLU 37 N 0.03 1.23 -0.10 1.51 5.08 -1.27 0.36 114.58 121.42 1s17 h GLU 37 Ca 0.05 -0.09 -0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1s17 h GLU 37 Cb 0.07 -0.27 -0.00 0.00 0.50 0.00 0.00 28.75 29.05 1s17 h GLU 37 CO -0.10 0.83 0.04 1.15 -1.00 0.00 0.00 179.01 179.94 1s17 h THR 38 N 1.26 1.14 -0.19 1.13 2.02 -0.74 -1.58 112.91 115.94 1s17 h THR 38 Ca 0.33 -0.40 0.00 0.00 0.77 0.00 0.00 66.41 67.11 1s17 h THR 38 Cb -0.11 1.23 -0.01 0.00 -1.74 0.00 0.00 68.15 67.52 1s17 h THR 38 CO -0.07 0.12 0.12 -0.03 0.37 0.00 0.00 175.52 176.04 1s17 h MET 39 N 0.01 0.25 -0.06 6.66 1.85 -0.12 -2.27 114.93 121.25 1s17 h MET 39 Ca 0.03 -0.02 -0.06 0.00 -0.61 0.00 0.00 59.70 59.05 1s17 h MET 39 Cb 0.15 -0.06 -0.01 0.00 0.43 0.00 0.00 31.60 32.12 1s17 h MET 39 CO -0.00 0.17 -0.23 1.88 -0.40 0.00 0.00 176.91 178.33 1s17 h TYR 40 N 0.25 0.10 0.00 1.39 0.05 -0.86 0.48 116.97 118.38 1s17 h TYR 40 Ca 0.07 -0.01 -0.02 0.00 0.05 0.00 0.00 58.73 58.82 1s17 h TYR 40 Cb -0.02 -0.03 -0.00 0.00 1.01 0.00 0.00 36.73 37.69 1s17 h TYR 40 CO -0.06 0.32 -0.48 1.05 -1.05 0.00 0.00 178.16 177.94 1s17 h GLU 41 N 0.09 0.00 -0.17 4.88 -0.00 -1.04 -3.37 114.58 114.96 1s17 h GLU 41 Ca 0.01 0.00 0.04 0.00 -0.00 0.00 0.00 59.36 59.42 1s17 h GLU 41 Cb 0.46 0.00 -0.07 0.00 -0.00 0.00 0.00 28.75 29.14 1s17 h GLU 41 CO 0.03 0.06 -0.45 0.00 -0.00 0.00 0.00 179.01 178.66 1s17 h ALA 42 N 1.92 -0.64 -2.10 1.06 0.00 -1.25 -3.47 119.26 114.79 1s17 h ALA 42 Ca -0.01 -0.01 -0.46 0.00 0.00 0.00 0.00 54.91 54.43 1s17 h ALA 42 Cb 1.07 0.86 0.01 0.00 0.00 0.00 0.00 17.79 19.73 1s17 h ALA 42 CO 0.01 -0.95 -0.21 -1.25 0.00 0.00 0.00 179.25 176.84 1s17 s PRO 43 N -5.84 3.27 0.28 0.00 0.04 -1.26 -5.15 135.00 126.34 1s17 s PRO 43 Ca -0.15 -0.56 -0.12 0.00 0.04 0.00 0.00 61.00 60.20 1s17 s PRO 43 Cb 0.09 -2.68 0.00 0.00 0.04 0.00 0.00 34.50 31.95 1s17 s PRO 43 CO 0.64 0.03 0.53 0.20 0.04 0.00 0.00 177.00 178.43 1s17 s GLY 44 N -4.12 0.59 0.00 0.56 0.00 0.15 -5.01 107.32 99.50 1s17 s GLY 44 Ca 0.43 -0.90 0.18 0.00 0.00 0.00 0.00 44.72 44.42 1s17 s GLY 44 CO 0.35 -0.60 0.89 0.29 0.00 0.00 0.00 173.10 174.03 1s17 n ILE 45 N -0.43 0.00 -3.55 0.90 -5.35 -1.26 -4.54 119.36 105.13 1s17 n ILE 45 Ca -0.02 -0.30 -0.11 0.00 -0.27 0.00 0.00 62.75 62.05 1s17 n ILE 45 Cb 0.61 1.19 -0.04 0.00 -1.74 0.00 0.00 39.64 39.67 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 -2.08 -0.41 -0.26 3.28 0.00 -1.26 -0.87 107.32 105.72 1s17 s GLY 46 Ca 0.14 0.17 -0.19 0.00 0.00 0.00 0.00 44.72 44.84 1s17 s GLY 46 CO 0.46 -0.12 0.66 -2.27 0.00 0.00 0.00 173.10 171.83 1s17 s LEU 47 N -2.77 -0.72 -0.01 0.66 2.96 -0.18 -4.92 118.68 113.70 1s17 s LEU 47 Ca 0.02 1.40 0.01 0.00 -0.22 0.00 0.00 54.13 55.33 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 -0.12 -0.23 0.02 0.00 -1.32 0.00 0.00 176.35 174.70 1s17 s ALA 48 N 1.06 3.37 0.40 5.97 0.00 -1.26 -1.38 121.76 129.92 1s17 s ALA 48 Ca -0.06 -0.91 0.13 0.00 0.00 0.00 0.00 51.96 51.12 1s17 s ALA 48 Cb -0.05 -1.42 0.96 0.00 0.00 0.00 0.00 23.12 22.60 1s17 s ALA 48 CO -0.10 0.65 1.93 0.00 0.00 0.00 0.00 175.76 178.23 1s17 h ALA 49 N 4.36 1.98 -0.92 0.00 0.00 -1.42 -0.53 119.26 122.73 1s17 h ALA 49 Ca -0.49 -0.00 0.19 0.00 0.00 0.00 0.00 54.91 54.61 1s17 h ALA 49 Cb 1.18 -0.10 -0.11 0.00 0.00 0.00 0.00 17.79 18.76 1s17 h ALA 49 CO 0.58 -0.17 0.48 1.15 0.00 0.00 0.00 179.25 181.29 1s17 h THR 50 N 0.52 0.61 0.00 0.00 2.02 -1.68 -0.19 112.91 114.19 1s17 h THR 50 Ca 0.36 -0.20 -0.01 0.00 0.77 0.00 0.00 66.41 67.34 1s17 h THR 50 Cb 0.69 -0.01 -0.00 0.00 -1.74 0.00 0.00 68.15 67.09 1s17 h THR 50 CO -0.13 0.10 -0.05 1.56 0.37 0.00 0.00 175.52 177.38 1s17 h GLN 51 N 0.57 0.00 -0.47 6.66 4.20 -1.39 -1.24 115.11 123.44 1s17 h GLN 51 Ca 0.55 0.00 -0.13 0.00 0.06 0.00 0.00 58.65 59.13 1s17 h GLN 51 Cb 0.92 0.00 -0.08 0.00 0.30 0.00 0.00 27.48 28.63 1s17 h GLN 51 CO -0.44 0.05 0.09 1.33 -0.67 0.00 0.00 178.83 179.19 1s17 n VAL 52 N -3.53 2.61 -2.66 -0.54 0.24 -0.17 -0.16 118.33 114.11 1s17 n VAL 52 Ca -0.02 -2.00 -0.20 0.00 -2.04 0.00 0.00 64.34 60.08 1s17 n VAL 52 Cb 0.16 -0.31 0.01 0.00 -1.47 0.00 0.00 33.84 32.23 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 -0.53 -5.65 -4.04 -1.34 5.15 -0.47 -4.85 115.26 103.53 1s17 n ASN 53 Ca 0.32 -0.14 -0.32 0.00 -0.60 0.00 0.00 54.58 53.84 1s17 n ASN 53 Cb 1.12 -4.58 -0.15 0.00 -0.53 0.00 0.00 39.78 35.64 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 -3.04 2.06 -1.31 3.44 1.01 -0.65 -5.00 120.40 116.90 1s17 s VAL 54 Ca 0.14 -1.67 -0.08 0.00 0.00 0.00 0.00 61.98 60.37 1s17 s VAL 54 Cb -0.06 -2.25 0.14 0.00 0.00 0.00 0.00 36.38 34.21 1s17 s VAL 54 CO 0.17 -0.14 2.10 1.41 0.00 0.00 0.00 175.10 178.65 1s17 n HIS 55 N 4.45 2.80 -4.41 5.22 8.25 -1.26 -2.32 115.22 127.95 1s17 n HIS 55 Ca -0.11 -2.81 -0.21 0.00 -0.26 0.00 0.00 57.72 54.33 1s17 n HIS 55 Cb 0.42 -1.94 -0.13 0.00 1.12 0.00 0.00 29.99 29.45 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 -0.00 1.03 -1.26 -0.41 1.02 -1.26 -0.79 119.74 118.07 1s17 s LYS 56 Ca 0.46 -0.80 -0.20 0.00 0.02 0.00 0.00 55.97 55.45 1s17 s LYS 56 Cb 0.13 -1.07 0.01 0.00 -0.52 0.00 0.00 37.83 36.38 1s17 s LYS 56 CO -0.03 0.27 1.83 0.54 -0.92 0.00 0.00 175.35 177.03 1s17 n ARG 57 N 1.89 2.59 -4.19 1.68 1.74 -0.17 -4.43 116.66 115.76 1s17 n ARG 57 Ca -0.18 -2.95 -0.18 0.00 -0.77 0.00 0.00 57.85 53.77 1s17 n ARG 57 Cb 0.54 -3.57 -0.15 0.00 -1.02 0.00 0.00 32.46 28.26 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 6.66 0.50 -0.02 0.55 1.01 -1.26 -0.53 121.20 128.12 1s17 s ILE 58 Ca 0.59 -0.20 0.01 0.00 0.00 0.00 0.00 60.65 61.06 1s17 s ILE 58 Cb 0.03 -0.47 0.01 0.00 0.01 0.00 0.00 42.46 42.03 1s17 s ILE 58 CO 0.10 0.18 -0.05 -0.69 0.00 0.00 0.00 174.94 174.48 1s17 s VAL 59 N 0.33 0.43 0.23 2.92 1.01 0.16 -1.32 120.40 124.15 1s17 s VAL 59 Ca -0.04 -0.17 0.10 0.00 0.00 0.00 0.00 61.98 61.88 1s17 s VAL 59 Cb -0.08 -0.41 -0.05 0.00 0.00 0.00 0.00 36.38 35.85 1s17 s VAL 59 CO -0.00 0.15 -0.19 0.68 0.00 0.00 0.00 175.10 175.74 1s17 s VAL 60 N 0.29 2.18 0.07 2.92 -7.23 -0.48 -0.73 120.40 117.41 1s17 s VAL 60 Ca -0.03 -2.23 -0.22 0.00 -1.81 0.00 0.00 61.98 57.70 1s17 s VAL 60 Cb -0.07 -2.14 0.05 0.00 0.56 0.00 0.00 36.38 34.78 1s17 s VAL 60 CO -0.00 -0.39 0.51 -0.32 -0.31 0.00 0.00 175.10 174.59 1s17 s MET 61 N -3.30 1.06 -0.27 4.82 1.75 -0.40 -1.01 119.30 121.96 1s17 s MET 61 Ca 0.24 -0.31 0.00 0.00 -1.25 0.00 0.00 55.69 54.37 1s17 s MET 61 Cb -0.05 0.48 0.16 0.00 2.84 0.00 0.00 34.83 38.27 1s17 s MET 61 CO 0.11 -0.40 0.44 0.34 -0.65 0.00 0.00 175.02 174.86 1s17 s ASP 62 N -2.15 -0.08 0.00 1.11 -1.08 -0.05 -0.51 116.67 113.91 1s17 s ASP 62 Ca -0.04 0.08 0.23 0.00 -0.52 0.00 0.00 52.55 52.30 1s17 s ASP 62 Cb -0.00 1.33 0.76 0.00 -1.46 0.00 0.00 42.92 43.55 1s17 s ASP 62 CO -0.04 -0.32 1.57 0.18 0.52 0.00 0.00 175.17 177.08 1s17 n LEU 63 N 5.37 1.83 -4.89 -1.34 4.77 -1.26 -4.60 117.00 116.89 1s17 n LEU 63 Ca -0.01 -0.73 -0.30 0.00 -0.03 0.00 0.00 56.01 54.94 1s17 n LEU 63 Cb 0.50 -0.09 0.16 0.00 -2.33 0.00 0.00 43.42 41.66 1s17 n LEU 63 CO 0.02 0.37 0.82 -0.94 -1.33 0.00 0.00 177.39 176.32 1s17 s SER 64 N -1.67 3.35 0.08 -1.43 1.04 -1.26 -4.99 113.70 108.81 1s17 s SER 64 Ca 0.34 0.49 0.23 0.00 0.48 0.00 0.00 55.95 57.48 1s17 s SER 64 Cb 0.19 -0.71 0.03 0.00 0.10 0.00 0.00 66.02 65.63 1s17 s SER 64 CO 0.28 -2.61 1.01 -0.62 0.98 0.00 0.00 173.24 172.28 1s17 n GLU 65 N -3.72 0.37 -1.27 4.02 4.71 -1.26 -4.48 120.64 119.01 1s17 n GLU 65 Ca 0.12 0.01 0.01 0.00 -0.01 0.00 0.00 57.16 57.29 1s17 n GLU 65 Cb 0.60 -1.64 0.11 0.00 -1.01 0.00 0.00 31.44 29.50 1s17 n GLU 65 CO 0.00 0.00 0.00 -0.40 0.09 0.00 0.00 177.13 176.82 1s17 n ASP 66 N -2.12 1.88 -2.84 1.62 5.68 -1.26 -4.99 116.55 114.51 1s17 n ASP 66 Ca 0.01 -3.10 -0.22 0.00 -0.50 0.00 0.00 54.79 50.98 1s17 n ASP 66 Cb 0.47 -0.43 0.02 0.00 -1.14 0.00 0.00 41.12 40.04 1s17 n ASP 66 CO 0.00 0.00 0.00 0.29 -1.33 0.00 0.00 177.20 176.16 1s17 n LYS 67 N -0.50 -3.89 -0.03 0.11 5.02 -1.26 -4.89 118.16 112.72 1s17 n LYS 67 Ca 0.17 0.92 0.07 0.00 -2.02 0.00 0.00 58.31 57.45 1s17 n LYS 67 Cb 0.88 -5.72 0.08 0.00 -0.02 0.00 0.00 35.03 30.25 1s17 n LYS 67 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 1s17 n SER 68 N -2.36 2.35 -3.13 4.39 3.41 -1.26 -4.75 113.62 112.27 1s17 n SER 68 Ca -0.15 -1.66 -0.20 0.00 -0.26 0.00 0.00 58.87 56.60 1s17 n SER 68 Cb 0.64 -0.04 -0.03 0.00 -0.26 0.00 0.00 64.21 64.51 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 0.82 1.56 -1.93 4.33 1.02 -1.26 -5.05 120.64 120.13 1s17 n GLU 69 Ca 0.09 -3.76 -0.41 0.00 -0.02 0.00 0.00 57.16 53.06 1s17 n GLU 69 Cb 0.38 -1.85 -0.01 0.00 -0.02 0.00 0.00 31.44 29.94 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 -2.70 4.21 0.00 3.49 0.04 -1.26 -4.27 135.00 134.51 1s17 s PRO 70 Ca 0.42 2.43 0.02 0.00 0.04 0.00 0.00 61.00 63.91 1s17 s PRO 70 Cb 0.33 -3.03 -0.01 0.00 0.04 0.00 0.00 34.50 31.84 1s17 s PRO 70 CO -0.10 -0.42 -0.07 1.03 0.04 0.00 0.00 177.00 177.48 1s17 s ARG 71 N -1.59 0.58 -0.06 4.56 1.81 0.34 -4.99 118.95 119.60 1s17 s ARG 71 Ca 0.54 -0.33 0.06 0.00 -1.72 0.00 0.00 55.73 54.27 1s17 s ARG 71 Cb -0.44 -0.54 -0.01 0.00 -0.45 0.00 0.00 34.95 33.52 1s17 s ARG 71 CO 0.56 0.14 -0.24 0.08 -0.68 0.00 0.00 175.30 175.16 1s17 s VAL 72 N -0.34 1.97 -0.13 3.52 1.01 -1.26 -1.27 120.40 123.90 1s17 s VAL 72 Ca 0.01 -1.01 -0.01 0.00 0.00 0.00 0.00 61.98 60.97 1s17 s VAL 72 Cb -0.04 -1.67 0.03 0.00 0.00 0.00 0.00 36.38 34.71 1s17 s VAL 72 CO -0.00 0.55 -0.03 -0.36 0.00 0.00 0.00 175.10 175.25 1s17 s PHE 73 N -0.05 1.25 -0.10 5.22 0.40 0.09 -4.70 117.98 120.10 1s17 s PHE 73 Ca -0.06 -0.68 -0.02 0.00 -0.60 0.00 0.00 56.93 55.57 1s17 s PHE 73 Cb -0.14 -1.10 -0.03 0.00 0.51 0.00 0.00 43.02 42.25 1s17 s PHE 73 CO 0.04 -0.50 -0.02 0.42 0.70 0.00 0.00 175.22 175.86 1s17 s ILE 74 N 1.78 4.10 -1.43 0.64 1.01 -0.44 -0.67 121.20 126.20 1s17 s ILE 74 Ca 0.03 -0.32 -0.00 0.00 0.00 0.00 0.00 60.65 60.36 1s17 s ILE 74 Cb -0.14 -2.73 0.00 0.00 0.01 0.00 0.00 42.46 39.60 1s17 s ILE 74 CO -0.07 0.58 0.35 0.59 0.00 0.00 0.00 174.94 176.39 1s17 n ASN 75 N 2.46 -0.10 -4.78 3.58 3.02 0.31 -0.33 115.26 119.42 1s17 n ASN 75 Ca -0.18 -1.05 -0.33 0.00 -0.03 0.00 0.00 54.58 52.99 1s17 n ASN 75 Cb 0.53 -2.83 0.02 0.00 -0.61 0.00 0.00 39.78 36.89 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 -6.68 3.09 0.11 3.52 0.04 -1.26 -4.48 135.00 129.34 1s17 s PRO 76 Ca 0.00 1.38 -0.09 0.00 0.04 0.00 0.00 61.00 62.33 1s17 s PRO 76 Cb -0.00 -1.99 -0.00 0.00 0.04 0.00 0.00 34.50 32.55 1s17 s PRO 76 CO 0.91 -1.02 0.22 -1.21 0.04 0.00 0.00 177.00 175.94 1s17 s GLU 77 N -3.90 0.93 0.04 4.56 2.02 0.14 -4.98 118.70 117.52 1s17 s GLU 77 Ca 0.67 -1.00 -0.10 0.00 0.02 0.00 0.00 54.97 54.56 1s17 s GLU 77 Cb -0.20 0.36 0.01 0.00 0.10 0.00 0.00 34.13 34.40 1s17 s GLU 77 CO 0.36 -0.31 0.21 -0.59 0.02 0.00 0.00 175.26 174.95 1s17 s PHE 78 N -3.89 0.03 -0.04 1.61 -0.12 -1.26 -1.28 117.98 113.04 1s17 s PHE 78 Ca 0.08 -0.26 0.01 0.00 -0.05 0.00 0.00 56.93 56.72 1s17 s PHE 78 Cb 0.04 -0.01 0.02 0.00 -0.63 0.00 0.00 43.02 42.44 1s17 s PHE 78 CO -0.08 -0.45 -0.05 -1.83 -0.05 0.00 0.00 175.22 172.76 1s17 s GLU 79 N -2.65 0.84 0.44 1.99 -1.05 -0.26 -4.95 118.70 113.06 1s17 s GLU 79 Ca -0.04 -0.12 -0.25 0.00 -0.15 0.00 0.00 54.97 54.41 1s17 s GLU 79 Cb -0.01 -0.83 -0.08 0.00 -0.44 0.00 0.00 34.13 32.78 1s17 s GLU 79 CO -0.04 -0.06 1.30 -2.14 0.95 0.00 0.00 175.26 175.27 1s17 s PRO 80 N 0.82 3.76 0.00 -4.83 0.02 -1.26 -0.09 135.00 133.42 1s17 s PRO 80 Ca -0.11 2.13 0.12 0.00 0.02 0.00 0.00 61.00 63.16 1s17 s PRO 80 Cb -0.14 -2.60 0.29 0.00 0.02 0.00 0.00 34.50 32.07 1s17 s PRO 80 CO 0.00 -0.66 1.21 1.28 -0.33 0.00 0.00 177.00 178.50 1s17 n LEU 81 N -0.21 2.83 -3.59 -5.54 4.77 -0.14 -4.80 117.00 110.33 1s17 n LEU 81 Ca 0.06 -1.80 -0.11 0.00 -0.03 0.00 0.00 56.01 54.12 1s17 n LEU 81 Cb 0.44 -0.21 -0.04 0.00 -2.33 0.00 0.00 43.42 41.28 1s17 n LEU 81 CO 0.54 0.68 0.22 0.28 -1.33 0.00 0.00 177.39 177.78 1s17 s THR 82 N -1.01 0.05 -2.13 -5.08 -1.32 -1.25 -4.99 115.64 99.91 1s17 s THR 82 Ca 0.23 -0.42 0.17 0.00 -1.21 0.00 0.00 61.69 60.47 1s17 s THR 82 Cb 0.13 -1.10 0.15 0.00 -1.51 0.00 0.00 72.50 70.17 1s17 s THR 82 CO 0.17 -0.23 1.06 -1.84 -2.21 0.00 0.00 174.62 171.57 1s17 n GLU 83 N -0.14 1.46 -2.06 7.08 0.28 -1.26 -4.90 120.64 121.09 1s17 n GLU 83 Ca -0.17 -1.56 -0.41 0.00 -0.16 0.00 0.00 57.16 54.86 1s17 n GLU 83 Cb 0.63 -1.33 -0.02 0.00 1.43 0.00 0.00 31.44 32.15 1s17 n GLU 83 CO 0.00 0.00 0.00 -2.00 -0.16 0.00 0.00 177.13 174.97 1s17 s GLU 84 N -1.42 4.31 0.21 3.44 2.12 -1.26 -4.98 118.70 121.12 1s17 s GLU 84 Ca 0.21 2.27 0.07 0.00 0.36 0.00 0.00 54.97 57.87 1s17 s GLU 84 Cb 0.15 -3.08 -0.04 0.00 0.26 0.00 0.00 34.13 31.42 1s17 s GLU 84 CO 0.22 -0.29 0.11 -1.64 -0.54 0.00 0.00 175.26 173.12 1s17 s MET 85 N -1.29 2.74 -0.09 4.30 -1.94 -1.26 -4.06 119.30 117.69 1s17 s MET 85 Ca 0.53 -1.06 -0.08 0.00 -1.71 0.00 0.00 55.69 53.37 1s17 s MET 85 Cb -0.41 -2.50 0.02 0.00 2.01 0.00 0.00 34.83 33.96 1s17 s MET 85 CO 0.50 0.43 0.23 -0.51 -0.01 0.00 0.00 175.02 175.67 1s17 s ASP 86 N -3.42 -0.24 0.25 3.03 1.01 0.04 -4.90 116.67 112.45 1s17 s ASP 86 Ca 0.31 0.45 -0.14 0.00 0.71 0.00 0.00 52.55 53.88 1s17 s ASP 86 Cb -0.09 0.47 -0.08 0.00 1.01 0.00 0.00 42.92 44.24 1s17 s ASP 86 CO 0.23 -0.09 0.65 -1.10 0.21 0.00 0.00 175.17 175.07 1s17 s GLN 87 N 0.07 3.99 -0.20 8.23 -0.21 -1.26 -1.64 119.66 128.64 1s17 s GLN 87 Ca -0.01 0.57 -0.15 0.00 0.02 0.00 0.00 55.36 55.80 1s17 s GLN 87 Cb -0.02 -2.65 0.06 0.00 1.00 0.00 0.00 33.01 31.40 1s17 s GLN 87 CO 0.00 0.29 0.50 -0.47 -2.12 0.00 0.00 175.29 173.50 1s17 s TYR 88 N -1.77 -0.64 -0.34 0.91 5.04 -1.12 -4.96 117.35 114.47 1s17 s TYR 88 Ca 0.48 1.44 -0.29 0.00 -2.44 0.00 0.00 57.07 56.26 1s17 s TYR 88 Cb -0.12 0.27 0.01 0.00 0.35 0.00 0.00 41.96 42.47 1s17 s TYR 88 CO 0.19 -0.33 1.30 -0.65 -1.34 0.00 0.00 175.55 174.73 1s17 s GLN 89 N 0.80 3.82 0.08 4.97 -1.52 -1.26 -2.14 119.66 124.41 1s17 s GLN 89 Ca -0.04 1.10 0.02 0.00 -1.95 0.00 0.00 55.36 54.49 1s17 s GLN 89 Cb -0.05 -3.91 -0.04 0.00 -0.22 0.00 0.00 33.01 28.79 1s17 s GLN 89 CO -0.06 -1.25 0.13 -1.21 -0.25 0.00 0.00 175.29 172.66 1s17 s GLU 90 N 4.36 3.11 0.38 2.91 2.02 0.40 -4.82 118.70 127.06 1s17 s GLU 90 Ca 0.56 -0.60 0.04 0.00 0.02 0.00 0.00 54.97 54.99 1s17 s GLU 90 Cb -0.15 -2.85 -0.05 0.00 0.10 0.00 0.00 34.13 31.18 1s17 s GLU 90 CO 0.26 0.58 0.06 0.20 0.02 0.00 0.00 175.26 176.38 1s17 s GLY 91 N -2.48 2.37 -0.18 -1.39 0.00 -1.26 -1.59 107.32 102.79 1s17 s GLY 91 Ca 0.32 -1.71 -0.14 0.00 0.00 0.00 0.00 44.72 43.18 1s17 s GLY 91 CO 0.24 -1.90 0.47 0.00 0.00 0.00 0.00 173.10 171.91 1s17 h LEU 93 N 6.00 0.00 -0.97 0.00 3.38 -1.96 0.11 115.31 121.88 1s17 h LEU 93 Ca -0.30 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.67 1s17 h LEU 93 Cb 1.18 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.93 1s17 h LEU 93 CO 0.23 0.01 0.00 -1.20 0.09 0.00 0.00 178.44 177.57 1s17 n SER 94 N -3.13 1.48 -2.94 -0.43 7.64 -1.26 -3.93 113.62 111.04 1s17 n SER 94 Ca -0.01 -1.56 -0.16 0.00 1.01 0.00 0.00 58.87 58.15 1s17 n SER 94 Cb 0.23 -0.04 -0.01 0.00 -1.01 0.00 0.00 64.21 63.38 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 0.17 0.61 -1.64 0.44 0.31 0.01 -0.17 118.33 118.06 1s17 n VAL 95 Ca 0.18 -4.12 -0.46 0.00 -0.01 0.00 0.00 64.34 59.93 1s17 n VAL 95 Cb 0.33 -0.05 -0.03 0.00 -0.91 0.00 0.00 33.84 33.18 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 0.08 1.74 -0.56 5.55 -0.04 -1.09 -2.70 135.00 137.98 1s17 n PRO 96 Ca 0.20 0.62 0.00 0.00 -0.04 0.00 0.00 63.50 64.28 1s17 n PRO 96 Cb 0.70 -2.21 0.00 0.00 -0.04 0.00 0.00 33.50 31.95 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 2.01 0.77 3.23 0.55 0.00 -1.26 -5.05 105.19 105.45 1s17 n GLY 97 Ca 0.12 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.86 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 -2.98 2.00 -0.07 1.61 0.40 -1.10 -5.11 117.98 112.73 1s17 s PHE 98 Ca 0.00 -0.45 -0.01 0.00 -0.60 0.00 0.00 56.93 55.87 1s17 s PHE 98 Cb 0.00 -1.30 0.03 0.00 0.51 0.00 0.00 43.02 42.26 1s17 s PHE 98 CO 0.00 -0.08 0.01 0.71 0.70 0.00 0.00 175.22 176.55 1s17 s TYR 99 N -0.37 0.63 0.05 0.36 1.51 -1.26 -4.31 117.35 113.96 1s17 s TYR 99 Ca 0.05 -0.15 0.02 0.00 -1.01 0.00 0.00 57.07 55.98 1s17 s TYR 99 Cb -0.10 -0.78 -0.03 0.00 -0.11 0.00 0.00 41.96 40.94 1s17 s TYR 99 CO 0.00 -0.32 -0.07 -1.21 -1.11 0.00 0.00 175.55 172.84 1s17 s GLU 100 N 1.99 0.56 0.35 -0.62 0.41 -0.62 -4.85 118.70 115.92 1s17 s GLU 100 Ca 0.05 -0.87 -0.27 0.00 -0.41 0.00 0.00 54.97 53.48 1s17 s GLU 100 Cb -0.12 -0.20 -0.09 0.00 -1.78 0.00 0.00 34.13 31.94 1s17 s GLU 100 CO -0.05 0.02 1.15 -0.80 -0.49 0.00 0.00 175.26 175.09 1s17 s ASN 101 N -1.90 6.81 -0.03 -0.19 0.01 -1.26 -0.46 114.94 117.92 1s17 s ASN 101 Ca -0.06 2.34 -0.02 0.00 -0.71 0.00 0.00 52.86 54.41 1s17 s ASN 101 Cb -0.06 -2.62 0.02 0.00 0.41 0.00 0.00 41.25 39.00 1s17 s ASN 101 CO -0.01 -0.48 0.07 -0.69 -1.51 0.00 0.00 177.10 174.48 1s17 s VAL 102 N -1.33 -0.03 -0.16 1.60 1.01 -0.91 -4.90 120.40 115.68 1s17 s VAL 102 Ca 0.52 0.10 -0.15 0.00 0.00 0.00 0.00 61.98 62.45 1s17 s VAL 102 Cb -0.31 -0.12 -0.04 0.00 0.00 0.00 0.00 36.38 35.90 1s17 s VAL 102 CO 0.40 0.04 0.33 -1.81 0.00 0.00 0.00 175.10 174.06 1s17 s ASP 103 N 0.57 6.46 0.05 3.32 1.11 -1.26 -2.80 116.67 124.12 1s17 s ASP 103 Ca -0.04 0.54 -0.12 0.00 0.18 0.00 0.00 52.55 53.11 1s17 s ASP 103 Cb -0.06 -2.20 0.01 0.00 1.07 0.00 0.00 42.92 41.74 1s17 s ASP 103 CO -0.02 0.05 0.25 -0.13 1.18 0.00 0.00 175.17 176.51 1s17 s ARG 104 N 0.65 0.79 0.48 8.23 0.52 -0.65 -4.86 118.95 124.12 1s17 s ARG 104 Ca 0.18 -0.64 -0.22 0.00 -0.52 0.00 0.00 55.73 54.53 1s17 s ARG 104 Cb -0.14 0.34 -0.07 0.00 0.52 0.00 0.00 34.95 35.60 1s17 s ARG 104 CO 0.05 -0.25 1.18 -1.25 0.02 0.00 0.00 175.30 175.05 1s17 s PRO 105 N -2.85 3.63 0.00 3.54 0.04 -1.26 -0.78 135.00 137.31 1s17 s PRO 105 Ca -0.03 1.80 0.27 0.00 0.04 0.00 0.00 61.00 63.08 1s17 s PRO 105 Cb 0.00 -2.33 0.95 0.00 0.04 0.00 0.00 34.50 33.16 1s17 s PRO 105 CO -0.05 -0.67 1.68 0.00 0.04 0.00 0.00 177.00 178.00 1s17 n GLN 106 N -0.67 1.22 -3.75 4.56 10.64 -1.26 -4.69 117.38 123.43 1s17 n GLN 106 Ca 0.08 -0.69 -0.16 0.00 -1.83 0.00 0.00 57.00 54.41 1s17 n GLN 106 Cb 0.48 -1.49 -0.16 0.00 -0.86 0.00 0.00 30.24 28.21 1s17 n GLN 106 CO 0.00 0.00 0.00 0.21 -1.83 0.00 0.00 177.06 175.44 1s17 s LYS 107 N -2.25 -0.04 0.08 2.61 2.20 -1.26 -2.14 119.74 118.93 1s17 s LYS 107 Ca 0.31 0.23 -0.06 0.00 -0.36 0.00 0.00 55.97 56.09 1s17 s LYS 107 Cb 0.20 -0.28 -0.01 0.00 -1.51 0.00 0.00 37.83 36.22 1s17 s LYS 107 CO 0.43 -0.19 0.12 0.14 -0.36 0.00 0.00 175.35 175.49 1s17 s VAL 108 N 1.25 0.17 -0.19 4.02 -7.23 -0.27 -0.96 120.40 117.18 1s17 s VAL 108 Ca -0.07 -1.37 -0.06 0.00 -1.81 0.00 0.00 61.98 58.66 1s17 s VAL 108 Cb -0.13 -1.40 -0.03 0.00 0.56 0.00 0.00 36.38 35.38 1s17 s VAL 108 CO -0.03 -0.76 0.04 -0.60 -0.31 0.00 0.00 175.10 173.44 1s17 s ARG 109 N -3.88 3.82 -0.14 4.82 3.52 0.87 -0.62 118.95 127.34 1s17 s ARG 109 Ca 0.06 -0.42 -0.06 0.00 -0.13 0.00 0.00 55.73 55.17 1s17 s ARG 109 Cb 0.06 -3.16 -0.04 0.00 -1.56 0.00 0.00 34.95 30.25 1s17 s ARG 109 CO -0.11 0.15 0.09 0.42 -0.81 0.00 0.00 175.30 175.04 1s17 s ILE 110 N 0.68 5.03 -0.05 4.11 1.01 0.97 -1.11 121.20 131.85 1s17 s ILE 110 Ca 0.02 0.04 0.06 0.00 0.00 0.00 0.00 60.65 60.77 1s17 s ILE 110 Cb -0.14 -3.21 -0.01 0.00 0.01 0.00 0.00 42.46 39.11 1s17 s ILE 110 CO 0.02 0.55 -0.25 -0.54 0.00 0.00 0.00 174.94 174.73 1s17 s LYS 111 N -0.46 2.45 0.14 2.79 1.02 -0.41 -0.31 119.74 124.96 1s17 s LYS 111 Ca 0.11 -0.90 -0.25 0.00 0.02 0.00 0.00 55.97 54.95 1s17 s LYS 111 Cb -0.12 -2.15 0.08 0.00 -0.52 0.00 0.00 37.83 35.12 1s17 s LYS 111 CO 0.02 0.44 1.04 0.00 -0.92 0.00 0.00 175.35 175.92 1s17 s ALA 112 N -0.29 -1.72 -0.03 5.17 0.00 -0.60 -0.68 121.76 123.60 1s17 s ALA 112 Ca 0.00 0.03 -0.01 0.00 0.00 0.00 0.00 51.96 51.98 1s17 s ALA 112 Cb -0.13 0.65 -0.04 0.00 0.00 0.00 0.00 23.12 23.61 1s17 s ALA 112 CO 0.02 -1.06 0.07 -0.51 0.00 0.00 0.00 175.76 174.28 1s17 s LEU 113 N -3.13 3.85 0.00 0.00 1.43 0.55 -0.60 118.68 120.79 1s17 s LEU 113 Ca 0.16 0.17 -0.04 0.00 -1.03 0.00 0.00 54.13 53.38 1s17 s LEU 113 Cb -0.01 -2.14 0.08 0.00 0.03 0.00 0.00 46.19 44.15 1s17 s LEU 113 CO 0.03 0.31 0.52 -0.90 0.23 0.00 0.00 176.35 176.53 1s17 n ASP 114 N 1.46 0.26 0.30 2.29 5.68 0.19 -1.33 116.55 125.40 1s17 n ASP 114 Ca -0.15 -1.32 0.16 0.00 -0.50 0.00 0.00 54.79 52.98 1s17 n ASP 114 Cb 0.53 -0.38 0.95 0.00 -1.14 0.00 0.00 41.12 41.08 1s17 n ASP 114 CO 0.00 0.00 0.00 -0.09 -1.33 0.00 0.00 177.20 175.78 1s17 h ARG 115 N 0.00 0.00 -0.04 0.11 2.43 -1.89 -0.21 114.38 114.78 1s17 h ARG 115 Ca -0.17 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.00 1s17 h ARG 115 Cb 0.52 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.07 1s17 h ARG 115 CO 0.14 0.02 0.00 -0.25 -1.51 0.00 0.00 179.97 178.37 1s17 n ASP 116 N -3.64 1.00 0.00 -3.80 8.00 -1.26 -4.88 116.55 111.97 1s17 n ASP 116 Ca -0.03 -1.40 0.00 0.00 0.71 0.00 0.00 54.79 54.07 1s17 n ASP 116 Cb 0.11 -0.02 0.00 0.00 -0.02 0.00 0.00 41.12 41.19 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 1.08 0.48 3.78 0.44 0.00 -0.09 -4.93 105.19 105.95 1s17 n GLY 117 Ca 0.19 -0.54 -0.37 0.00 0.00 0.00 0.00 46.02 45.31 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 -2.49 6.55 0.49 1.61 0.01 -1.26 -4.74 114.94 115.12 1s17 s ASN 118 Ca 0.00 0.65 -0.20 0.00 -0.71 0.00 0.00 52.86 52.60 1s17 s ASN 118 Cb 0.00 -2.20 -0.08 0.00 0.41 0.00 0.00 41.25 39.39 1s17 s ASN 118 CO 0.00 0.19 1.06 -2.16 -1.51 0.00 0.00 177.10 174.68 1s17 s PRO 119 N -0.12 3.72 0.13 -0.60 0.04 -1.26 -0.64 135.00 136.27 1s17 s PRO 119 Ca 0.19 1.44 -0.12 0.00 0.04 0.00 0.00 61.00 62.55 1s17 s PRO 119 Cb -0.14 -2.11 0.01 0.00 0.04 0.00 0.00 34.50 32.30 1s17 s PRO 119 CO 0.07 -0.51 0.31 -0.59 0.04 0.00 0.00 177.00 176.32 1s17 s PHE 120 N -1.90 0.06 0.02 0.56 -0.71 0.23 -4.87 117.98 111.37 1s17 s PHE 120 Ca 0.68 -0.43 0.05 0.00 -1.04 0.00 0.00 56.93 56.18 1s17 s PHE 120 Cb -0.19 0.09 -0.02 0.00 -1.21 0.00 0.00 43.02 41.70 1s17 s PHE 120 CO 0.22 -0.67 -0.15 -1.21 -1.34 0.00 0.00 175.22 172.07 1s17 s GLU 121 N -3.87 1.06 -0.00 1.99 2.02 -1.26 -1.56 118.70 117.08 1s17 s GLU 121 Ca 0.07 -0.67 0.00 0.00 0.02 0.00 0.00 54.97 54.40 1s17 s GLU 121 Cb 0.03 -1.06 -0.00 0.00 0.10 0.00 0.00 34.13 33.20 1s17 s GLU 121 CO -0.08 0.28 -0.01 -2.00 0.02 0.00 0.00 175.26 173.46 1s17 s GLU 122 N -0.80 0.10 -0.19 1.61 2.12 0.57 -4.95 118.70 117.16 1s17 s GLU 122 Ca 0.04 -0.04 -0.18 0.00 0.36 0.00 0.00 54.97 55.15 1s17 s GLU 122 Cb -0.07 -0.10 -0.03 0.00 0.26 0.00 0.00 34.13 34.18 1s17 s GLU 122 CO 0.01 0.02 0.49 0.08 -0.54 0.00 0.00 175.26 175.32 1s17 s VAL 123 N -0.01 5.14 0.02 3.70 1.01 -1.26 -0.02 120.40 128.97 1s17 s VAL 123 Ca 0.00 0.91 0.08 0.00 0.00 0.00 0.00 61.98 62.97 1s17 s VAL 123 Cb -0.01 -3.82 -0.02 0.00 0.00 0.00 0.00 36.38 32.53 1s17 s VAL 123 CO -0.00 0.22 -0.24 0.00 0.00 0.00 0.00 175.10 175.08 1s17 s ALA 124 N 1.41 2.02 0.13 5.51 0.00 0.21 -4.99 121.76 126.04 1s17 s ALA 124 Ca 0.24 -1.11 0.02 0.00 0.00 0.00 0.00 51.96 51.10 1s17 s ALA 124 Cb -0.15 -0.46 -0.04 0.00 0.00 0.00 0.00 23.12 22.47 1s17 s ALA 124 CO 0.09 0.48 -0.04 -1.21 0.00 0.00 0.00 175.76 175.09 1s17 s GLU 125 N -0.93 0.95 5.36 0.00 2.02 -1.26 -1.11 118.70 123.73 1s17 s GLU 125 Ca 0.10 -1.42 0.00 0.00 0.02 0.00 0.00 54.97 53.67 1s17 s GLU 125 Cb -0.09 -0.22 0.00 0.00 0.10 0.00 0.00 34.13 33.91 1s17 s GLU 125 CO 0.01 -0.07 0.00 0.41 0.02 0.00 0.00 175.26 175.63 1s17 n GLY 126 N -0.12 2.27 0.24 -1.39 0.00 -0.91 -3.22 105.19 102.06 1s17 n GLY 126 Ca -0.10 -0.50 -0.02 0.00 0.00 0.00 0.00 46.02 45.41 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 0.46 -0.94 0.99 5.85 -1.99 0.33 115.31 120.01 1s17 h LEU 127 Ca 0.00 0.04 0.05 0.00 0.84 0.00 0.00 57.88 58.80 1s17 h LEU 127 Cb 0.00 -0.05 -0.06 0.00 0.37 0.00 0.00 40.66 40.92 1s17 h LEU 127 CO 0.00 0.30 0.61 0.25 -0.34 0.00 0.00 178.44 179.26 1s17 h LEU 128 N 0.60 1.00 -0.67 2.25 5.85 -1.96 0.25 115.31 122.63 1s17 h LEU 128 Ca 0.29 -0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.97 1s17 h LEU 128 Cb 0.21 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.00 1s17 h LEU 128 CO -0.20 0.67 0.27 0.00 -0.34 0.00 0.00 178.44 178.84 1s17 h ALA 129 N 1.40 0.87 -0.18 1.25 0.00 -0.97 -0.95 119.26 120.70 1s17 h ALA 129 Ca 0.39 -0.18 -0.03 0.00 0.00 0.00 0.00 54.91 55.09 1s17 h ALA 129 Cb 0.07 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1s17 h ALA 129 CO -0.14 0.49 -0.03 0.28 0.00 0.00 0.00 179.25 179.85 1s17 h VAL 130 N 0.95 1.27 -0.66 0.00 2.07 -0.38 -3.01 116.25 116.50 1s17 h VAL 130 Ca 0.22 -0.95 -0.06 0.00 0.82 0.00 0.00 66.70 66.73 1s17 h VAL 130 Cb 0.20 1.55 -0.03 0.00 -1.52 0.00 0.00 31.29 31.49 1s17 h VAL 130 CO -0.02 0.28 0.16 0.00 0.02 0.00 0.00 177.57 178.02 1s17 h ILE 132 N 1.00 1.28 -0.11 0.00 6.09 -1.21 -0.35 117.51 124.20 1s17 h ILE 132 Ca 0.21 -1.31 -0.05 0.00 -1.37 0.00 0.00 64.86 62.34 1s17 h ILE 132 Cb 0.35 1.68 -0.00 0.00 0.47 0.00 0.00 36.82 39.32 1s17 h ILE 132 CO 0.00 0.38 -0.14 1.56 -3.07 0.00 0.00 178.15 176.88 1s17 h GLN 133 N 0.03 0.29 -0.29 2.19 4.20 -1.31 0.39 115.11 120.62 1s17 h GLN 133 Ca 0.00 -0.17 0.05 0.00 0.06 0.00 0.00 58.65 58.59 1s17 h GLN 133 Cb 0.68 0.01 -0.04 0.00 0.30 0.00 0.00 27.48 28.43 1s17 h GLN 133 CO 0.05 0.73 0.01 1.25 -0.67 0.00 0.00 178.83 180.19 1s17 h HIS 134 N -0.13 -0.00 -0.51 2.96 2.76 -1.04 0.06 115.15 119.25 1s17 h HIS 134 Ca 0.01 0.02 -0.10 0.00 -2.20 0.00 0.00 60.37 58.11 1s17 h HIS 134 Cb 0.69 0.04 -0.02 0.00 1.55 0.00 0.00 27.41 29.68 1s17 h HIS 134 CO 0.10 -0.04 -0.06 0.93 -1.30 0.00 0.00 177.93 177.56 1s17 h GLU 135 N 0.09 0.94 -0.66 5.26 4.39 -1.02 -2.47 114.58 121.12 1s17 h GLU 135 Ca 0.14 -0.33 -0.04 0.00 0.34 0.00 0.00 59.36 59.47 1s17 h GLU 135 Cb 0.18 -0.07 -0.03 0.00 -0.10 0.00 0.00 28.75 28.73 1s17 h GLU 135 CO -0.22 0.99 0.26 0.00 -1.16 0.00 0.00 179.01 178.88 1s17 h ASP 137 N 0.94 0.63 -0.94 0.00 3.32 -0.72 -1.15 116.42 118.50 1s17 h ASP 137 Ca 0.22 0.04 0.06 0.00 0.02 0.00 0.00 57.03 57.38 1s17 h ASP 137 Cb 0.18 -0.07 -0.07 0.00 0.22 0.00 0.00 39.33 39.59 1s17 h ASP 137 CO -0.02 0.37 0.60 0.45 -1.72 0.00 0.00 179.24 178.92 1s17 h HIS 138 N 0.75 1.11 0.00 4.55 3.86 -0.89 0.13 115.15 124.66 1s17 h HIS 138 Ca 0.37 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.61 1s17 h HIS 138 Cb 0.32 -0.36 0.00 0.00 1.06 0.00 0.00 27.41 28.43 1s17 h HIS 138 CO -0.07 0.57 0.00 -0.07 0.86 0.00 0.00 177.93 179.22 1s17 h LEU 139 N 1.09 0.00 -3.41 2.43 3.38 -0.90 -0.02 115.31 117.86 1s17 h LEU 139 Ca 0.41 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 58.33 1s17 h LEU 139 Cb 0.17 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.89 1s17 h LEU 139 CO -0.18 0.00 0.04 0.59 0.09 0.00 0.00 178.44 178.98 1s17 n ASN 140 N -2.84 4.30 -1.69 -0.43 3.02 0.08 -0.91 115.26 116.80 1s17 n ASN 140 Ca -0.00 -3.11 -0.16 0.00 -0.03 0.00 0.00 54.58 51.28 1s17 n ASN 140 Cb 0.20 -0.62 -0.02 0.00 -0.61 0.00 0.00 39.78 38.74 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 -0.28 0.01 3.46 7.41 0.00 -0.02 -4.81 105.19 110.96 1s17 n GLY 141 Ca 0.27 -0.24 -0.32 0.00 0.00 0.00 0.00 46.02 45.74 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 -4.55 2.26 0.22 1.61 2.20 0.22 -4.47 119.74 117.23 1s17 s LYS 142 Ca 0.00 -0.86 0.11 0.00 -0.36 0.00 0.00 55.97 54.87 1s17 s LYS 142 Cb 0.00 -2.26 -0.05 0.00 -1.51 0.00 0.00 37.83 34.01 1s17 s LYS 142 CO 0.00 0.58 -0.21 -0.51 -0.36 0.00 0.00 175.35 174.85 1s17 s LEU 143 N -1.11 2.55 0.56 5.43 1.43 -1.26 -2.98 118.68 123.29 1s17 s LEU 143 Ca 0.13 -0.88 0.30 0.00 -1.03 0.00 0.00 54.13 52.65 1s17 s LEU 143 Cb -0.11 -1.21 1.65 0.00 0.03 0.00 0.00 46.19 46.56 1s17 s LEU 143 CO 0.03 0.09 2.15 2.19 0.23 0.00 0.00 176.35 181.05 1s17 h PHE 144 N 2.87 0.00 0.00 0.29 -5.15 -1.97 0.12 116.94 113.10 1s17 h PHE 144 Ca -0.44 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.33 1s17 h PHE 144 Cb 1.22 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.39 1s17 h PHE 144 CO 0.72 0.07 0.00 -0.39 -2.00 0.00 0.00 178.31 176.71 1s17 h VAL 145 N 0.00 0.00 0.00 0.88 -1.51 -1.97 -2.07 116.25 111.57 1s17 h VAL 145 Ca -0.00 -0.26 0.00 0.00 -1.23 0.00 0.00 66.70 65.21 1s17 h VAL 145 Cb 0.21 1.03 0.00 0.00 -2.13 0.00 0.00 31.29 30.41 1s17 h VAL 145 CO 0.01 0.00 0.00 0.44 -1.23 0.00 0.00 177.57 176.79 1s17 h ASP 146 N 0.00 0.00 0.41 4.19 3.32 -1.17 -1.35 116.42 121.82 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 0.34 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.89 1s17 h ASP 146 CO 0.00 0.00 -0.40 -1.22 -1.72 0.00 0.00 179.24 175.90 1s17 n TYR 147 N -2.30 0.00 -2.47 4.55 4.01 -0.78 -4.94 117.16 115.24 1s17 n TYR 147 Ca 0.02 0.00 -0.23 0.00 -0.16 0.00 0.00 57.90 57.52 1s17 n TYR 147 Cb 0.21 -0.21 0.06 0.00 -0.31 0.00 0.00 39.34 39.10 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 -2.81 3.06 0.95 7.72 1.43 -0.51 -5.03 118.68 123.49 1s17 s LEU 148 Ca 0.16 0.08 -0.11 0.00 -1.03 0.00 0.00 54.13 53.23 1s17 s LEU 148 Cb 0.18 -2.77 0.17 0.00 0.03 0.00 0.00 46.19 43.80 1s17 s LEU 148 CO 0.63 -1.46 1.10 -0.94 0.23 0.00 0.00 176.35 175.91 1s17 s SER 149 N -4.52 2.75 0.10 2.29 1.04 -1.26 -4.78 113.70 109.31 1s17 s SER 149 Ca 0.60 1.83 -0.18 0.00 0.48 0.00 0.00 55.95 58.68 1s17 s SER 149 Cb -0.09 -2.41 -0.06 0.00 0.10 0.00 0.00 66.02 63.55 1s17 s SER 149 CO 0.42 -3.15 1.59 0.74 0.98 0.00 0.00 173.24 173.82 1s17 h THR 150 N -1.90 1.22 -0.32 2.02 2.02 -1.97 -1.60 112.91 112.38 1s17 h THR 150 Ca -0.49 -0.73 -0.08 0.00 0.77 0.00 0.00 66.41 65.88 1s17 h THR 150 Cb 1.28 1.18 -0.02 0.00 -1.74 0.00 0.00 68.15 68.85 1s17 h THR 150 CO 0.48 0.24 -0.16 -0.07 0.37 0.00 0.00 175.52 176.38 1s17 h LEU 151 N 0.27 0.55 -0.19 2.58 3.38 -1.99 -0.99 115.31 118.94 1s17 h LEU 151 Ca 0.09 -0.16 -0.09 0.00 0.09 0.00 0.00 57.88 57.81 1s17 h LEU 151 Cb 0.30 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.90 1s17 h LEU 151 CO 0.00 0.73 -0.23 0.50 0.09 0.00 0.00 178.44 179.54 1s17 h LYS 152 N 0.51 0.48 -0.79 1.13 3.64 -1.90 -0.64 116.57 119.00 1s17 h LYS 152 Ca 0.09 -0.27 0.01 0.00 -1.27 0.00 0.00 60.65 59.21 1s17 h LYS 152 Cb 0.57 0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 32.36 1s17 h LYS 152 CO 0.04 0.85 0.52 -0.09 -2.27 0.00 0.00 179.45 178.50 1s17 h ARG 153 N 0.14 1.03 -0.02 1.90 2.43 -1.15 -0.57 114.38 118.14 1s17 h ARG 153 Ca 0.02 -0.06 -0.10 0.00 -0.81 0.00 0.00 59.98 59.03 1s17 h ARG 153 Cb 0.78 -0.23 -0.01 0.00 -0.42 0.00 0.00 29.97 30.09 1s17 h ARG 153 CO 0.05 0.68 -0.47 0.22 -1.51 0.00 0.00 179.97 178.95 1s17 h ASP 154 N 1.06 0.05 -0.41 -3.80 -0.00 -1.05 0.05 116.42 112.32 1s17 h ASP 154 Ca 0.29 -0.02 -0.10 0.00 -0.00 0.00 0.00 57.03 57.20 1s17 h ASP 154 Cb -0.11 -0.01 -0.01 0.00 -0.00 0.00 0.00 39.33 39.20 1s17 h ASP 154 CO -0.07 0.51 -0.13 -0.09 -0.00 0.00 0.00 179.24 179.46 1s17 h ARG 155 N 0.04 0.82 -0.38 0.28 2.43 0.01 -0.74 114.38 116.84 1s17 h ARG 155 Ca -0.00 -0.33 -0.00 0.00 -0.81 0.00 0.00 59.98 58.84 1s17 h ARG 155 Cb 0.84 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.33 1s17 h ARG 155 CO 0.06 0.96 0.22 0.82 -1.51 0.00 0.00 179.97 180.52 1s17 h ILE 156 N 0.63 1.13 -0.36 1.20 2.04 -0.63 -1.36 117.51 120.17 1s17 h ILE 156 Ca 0.10 -0.31 0.06 0.00 1.00 0.00 0.00 64.86 65.70 1s17 h ILE 156 Cb 0.68 0.65 -0.05 0.00 -0.74 0.00 0.00 36.82 37.36 1s17 h ILE 156 CO 0.05 0.13 0.05 -0.09 0.00 0.00 0.00 178.15 178.29 1s17 h ARG 157 N 0.49 0.16 -0.73 2.37 2.43 -0.71 -0.42 114.38 117.97 1s17 h ARG 157 Ca 0.13 -0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.28 1s17 h ARG 157 Cb 0.02 -0.04 -0.03 0.00 -0.42 0.00 0.00 29.97 29.50 1s17 h ARG 157 CO -0.02 0.11 0.39 0.87 -1.51 0.00 0.00 179.97 179.80 1s17 h LYS 158 N 0.17 1.03 -0.30 0.20 1.79 -0.79 0.86 116.57 119.53 1s17 h LYS 158 Ca 0.17 -0.13 -0.02 0.00 -2.18 0.00 0.00 60.65 58.49 1s17 h LYS 158 Cb 0.21 -0.20 -0.01 0.00 -1.58 0.00 0.00 32.23 30.65 1s17 h LYS 158 CO -0.24 0.78 0.10 0.87 -1.08 0.00 0.00 179.45 179.87 1s17 h LYS 159 N 1.01 0.46 -0.86 3.15 1.57 -0.82 -0.97 116.57 120.10 1s17 h LYS 159 Ca 0.25 -0.10 0.01 0.00 -1.87 0.00 0.00 60.65 58.95 1s17 h LYS 159 Cb 0.06 -0.07 -0.04 0.00 0.08 0.00 0.00 32.23 32.26 1s17 h LYS 159 CO -0.04 0.51 0.57 -0.07 -0.57 0.00 0.00 179.45 179.85 1s17 h LEU 160 N 0.32 0.98 -0.86 2.94 3.38 -0.60 -1.09 115.31 120.39 1s17 h LEU 160 Ca 0.10 -0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.97 1s17 h LEU 160 Cb 0.24 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.72 1s17 h LEU 160 CO -0.00 0.71 0.05 -0.33 0.09 0.00 0.00 178.44 178.95 1s17 h GLU 161 N 1.16 0.90 0.56 1.13 5.08 -0.62 0.02 114.58 122.81 1s17 h GLU 161 Ca 0.32 -0.24 -0.02 0.00 -1.00 0.00 0.00 59.36 58.42 1s17 h GLU 161 Cb -0.12 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.02 1s17 h GLU 161 CO -0.07 0.86 -0.35 -0.22 -1.00 0.00 0.00 179.01 178.23 1s17 h LYS 162 N 0.84 -0.84 -0.54 2.33 1.63 -0.42 -2.02 116.57 117.56 1s17 h LYS 162 Ca 0.17 0.06 0.11 0.00 -0.85 0.00 0.00 60.65 60.13 1s17 h LYS 162 Cb 0.43 0.19 -0.09 0.00 -0.60 0.00 0.00 32.23 32.17 1s17 h LYS 162 CO 0.02 -0.56 0.01 1.96 -3.45 0.00 0.00 179.45 177.43 1s17 h GLN 163 N -0.87 0.12 -0.74 1.90 4.20 -0.81 -1.77 115.11 117.15 1s17 h GLN 163 Ca -0.07 -0.01 0.11 0.00 0.06 0.00 0.00 58.65 58.74 1s17 h GLN 163 Cb 0.71 -0.03 -0.05 0.00 0.30 0.00 0.00 27.48 28.41 1s17 h GLN 163 CO 0.07 0.08 0.49 0.45 -0.67 0.00 0.00 178.83 179.24 1s17 h HIS 164 N 0.13 0.64 -0.01 2.96 3.86 -0.67 -3.52 115.15 118.54 1s17 h HIS 164 Ca 0.28 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.50 1s17 h HIS 164 Cb 0.42 -0.21 0.00 0.00 1.06 0.00 0.00 27.41 28.69 1s17 h HIS 164 CO -0.32 0.29 0.00 2.89 0.86 0.00 0.00 177.93 181.65