#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1w00 n LEU 3 N 0.00 2.62 -4.69 3.41 7.99 -1.23 -4.19 117.00 120.92 1w00 n LEU 3 Ca 0.00 -0.02 -0.43 0.00 -0.01 0.00 0.00 56.01 55.56 1w00 n LEU 3 Cb 0.00 -0.84 -0.01 0.00 -0.11 0.00 0.00 43.42 42.46 1w00 n LEU 3 CO 0.00 0.87 0.89 -2.65 -1.51 0.00 0.00 177.39 174.99 1w00 n PRO 4 N -3.28 2.06 -1.63 3.23 -0.02 -1.26 -4.90 135.00 129.19 1w00 n PRO 4 Ca -0.40 0.72 -0.29 0.00 -2.02 0.00 0.00 63.50 61.51 1w00 n PRO 4 Cb 1.02 -2.30 0.11 0.00 -0.02 0.00 0.00 33.50 32.32 1w00 n PRO 4 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1w00 s THR 5 N -0.95 2.29 0.19 3.45 -4.23 -1.26 -3.84 115.64 111.29 1w00 s THR 5 Ca 0.57 0.09 -0.12 0.00 -1.18 0.00 0.00 61.69 61.05 1w00 s THR 5 Cb -0.59 -2.91 0.13 0.00 1.34 0.00 0.00 72.50 70.48 1w00 s THR 5 CO 0.60 -0.12 1.70 0.00 -0.54 0.00 0.00 174.62 176.26 1w00 h ALA 6 N -1.29 0.58 -0.39 3.99 0.00 -1.92 0.89 119.26 121.12 1w00 h ALA 6 Ca -0.49 0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.51 1w00 h ALA 6 Cb 1.32 0.18 -0.02 0.00 0.00 0.00 0.00 17.79 19.27 1w00 h ALA 6 CO 0.62 -0.33 0.08 1.96 0.00 0.00 0.00 179.25 181.58 1w00 h GLN 7 N 0.21 0.59 -0.09 0.00 4.20 -1.92 -1.10 115.11 116.99 1w00 h GLN 7 Ca 0.27 -0.11 -0.15 0.00 0.06 0.00 0.00 58.65 58.73 1w00 h GLN 7 Cb 0.38 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 28.06 1w00 h GLN 7 CO -0.37 0.55 -0.58 0.93 -0.67 0.00 0.00 178.83 178.69 1w00 h GLU 8 N 0.57 0.29 -0.17 1.46 5.08 -1.55 -2.10 114.58 118.17 1w00 h GLU 8 Ca 0.13 -0.19 -0.01 0.00 -1.00 0.00 0.00 59.36 58.29 1w00 h GLU 8 Cb 0.25 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.52 1w00 h GLU 8 CO -0.00 0.79 0.06 0.28 -1.00 0.00 0.00 179.01 179.14 1w00 h VAL 9 N 0.22 1.17 -0.78 3.13 2.07 -0.08 0.12 116.25 122.10 1w00 h VAL 9 Ca -0.00 -0.53 0.06 0.00 0.82 0.00 0.00 66.70 67.04 1w00 h VAL 9 Cb 1.09 1.20 -0.06 0.00 -1.52 0.00 0.00 31.29 32.00 1w00 h VAL 9 CO 0.09 0.17 0.47 1.56 0.02 0.00 0.00 177.57 179.88 1w00 h GLN 10 N 0.11 0.85 -0.27 1.57 4.20 -1.11 0.48 115.11 120.95 1w00 h GLN 10 Ca 0.06 -0.05 -0.03 0.00 0.06 0.00 0.00 58.65 58.68 1w00 h GLN 10 Cb 0.20 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 27.78 1w00 h GLN 10 CO -0.00 0.56 0.04 0.78 -0.67 0.00 0.00 178.83 179.54 1w00 h GLY 11 N 0.88 0.48 1.02 3.46 0.00 -1.00 -0.80 103.07 107.11 1w00 h GLY 11 Ca 0.34 -0.32 -0.03 0.00 0.00 0.00 0.00 47.33 47.32 1w00 h GLY 11 CO -0.16 0.30 0.35 1.41 0.00 0.00 0.00 176.54 178.43 1w00 h LEU 12 N 0.25 1.00 -0.48 3.11 3.38 -0.17 -0.54 115.31 121.87 1w00 h LEU 12 Ca 0.08 -0.14 -0.17 0.00 0.09 0.00 0.00 57.88 57.74 1w00 h LEU 12 Cb 0.34 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 1w00 h LEU 12 CO 0.01 0.86 -0.71 0.24 0.09 0.00 0.00 178.44 178.93 1w00 h MET 13 N 1.07 0.30 -0.41 1.13 2.86 -0.87 -1.38 114.93 117.62 1w00 h MET 13 Ca 0.26 -0.24 -0.12 0.00 -2.06 0.00 0.00 59.70 57.53 1w00 h MET 13 Cb 0.14 0.05 -0.01 0.00 0.06 0.00 0.00 31.60 31.84 1w00 h MET 13 CO -0.03 0.89 -0.24 0.00 1.06 0.00 0.00 176.91 178.59 1w00 h ALA 14 N 1.05 0.81 -0.25 6.32 0.00 -0.90 -2.66 119.26 123.63 1w00 h ALA 14 Ca -0.02 -0.38 -0.00 0.00 0.00 0.00 0.00 54.91 54.50 1w00 h ALA 14 Cb 1.27 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 1w00 h ALA 14 CO 0.11 0.65 0.14 -0.09 0.00 0.00 0.00 179.25 180.06 1w00 h ARG 15 N 0.72 0.35 -0.68 0.00 2.43 -0.95 -2.25 114.38 114.00 1w00 h ARG 15 Ca 0.09 -0.04 0.12 0.00 -0.81 0.00 0.00 59.98 59.35 1w00 h ARG 15 Cb 0.77 -0.07 -0.09 0.00 -0.42 0.00 0.00 29.97 30.16 1w00 h ARG 15 CO 0.06 0.31 0.23 -0.92 -1.51 0.00 0.00 179.97 178.14 1w00 h TYR 16 N 0.30 0.39 -0.73 2.20 5.03 -1.02 -0.57 116.97 122.57 1w00 h TYR 16 Ca 0.09 0.04 -0.04 0.00 2.58 0.00 0.00 58.73 61.40 1w00 h TYR 16 Cb 0.06 -0.07 -0.03 0.00 1.55 0.00 0.00 36.73 38.24 1w00 h TYR 16 CO -0.04 0.04 0.31 0.82 -1.32 0.00 0.00 178.16 177.97 1w00 h ILE 17 N 0.38 1.25 -0.58 1.81 1.08 -1.16 -1.73 117.51 118.56 1w00 h ILE 17 Ca 0.36 -0.75 0.00 0.00 -0.39 0.00 0.00 64.86 64.08 1w00 h ILE 17 Cb 0.53 0.38 -0.03 0.00 -3.07 0.00 0.00 36.82 34.63 1w00 h ILE 17 CO -0.39 0.31 0.37 -0.33 -0.69 0.00 0.00 178.15 177.41 1w00 h GLU 18 N 1.04 0.77 -0.65 2.37 5.08 -0.62 0.96 114.58 123.54 1w00 h GLU 18 Ca 0.25 -0.06 -0.08 0.00 -1.00 0.00 0.00 59.36 58.46 1w00 h GLU 18 Cb 0.18 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 29.24 1w00 h GLU 18 CO -0.02 0.53 0.08 -0.07 -1.00 0.00 0.00 179.01 178.52 1w00 h LEU 19 N 0.78 1.06 -0.63 1.33 3.38 -0.91 -0.78 115.31 119.54 1w00 h LEU 19 Ca 0.21 -0.27 -0.05 0.00 0.09 0.00 0.00 57.88 57.85 1w00 h LEU 19 Cb -0.05 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.39 1w00 h LEU 19 CO -0.04 1.07 0.19 0.58 0.09 0.00 0.00 178.44 180.33 1w00 h VAL 20 N 1.02 1.25 -0.42 1.22 2.07 -0.95 0.18 116.25 120.61 1w00 h VAL 20 Ca 0.19 -0.86 -0.04 0.00 0.82 0.00 0.00 66.70 66.82 1w00 h VAL 20 Cb 0.48 0.61 -0.02 0.00 -1.52 0.00 0.00 31.29 30.84 1w00 h VAL 20 CO 0.02 0.33 0.09 -0.78 0.02 0.00 0.00 177.57 177.25 1w00 h ASP 21 N 0.91 0.57 1.25 0.57 3.58 -0.37 -2.43 116.42 120.50 1w00 h ASP 21 Ca 0.20 -0.09 -0.05 0.00 0.42 0.00 0.00 57.03 57.52 1w00 h ASP 21 Cb 0.30 -0.15 -0.01 0.00 1.72 0.00 0.00 39.33 41.20 1w00 h ASP 21 CO -0.01 0.58 -0.77 -0.37 -2.88 0.00 0.00 179.24 175.79 1w00 h VAL 22 N 0.60 0.20 0.00 2.25 -1.51 -0.85 -3.43 116.25 113.52 1w00 h VAL 22 Ca 0.14 -1.34 0.00 0.00 -1.23 0.00 0.00 66.70 64.26 1w00 h VAL 22 Cb 0.24 1.84 0.00 0.00 -2.13 0.00 0.00 31.29 31.24 1w00 h VAL 22 CO -0.00 0.12 0.00 0.61 -1.23 0.00 0.00 177.57 177.06 1w00 n GLY 23 N 1.21 0.69 3.46 5.19 0.00 0.56 -5.01 105.19 111.30 1w00 n GLY 23 Ca -0.01 -0.72 -0.43 0.00 0.00 0.00 0.00 46.02 44.86 1w00 n GLY 23 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1w00 s ASP 24 N -2.76 6.45 0.15 1.61 -1.08 -0.87 -4.86 116.67 115.31 1w00 s ASP 24 Ca 0.00 -1.60 -0.14 0.00 -0.52 0.00 0.00 52.55 50.29 1w00 s ASP 24 Cb 0.00 -2.42 0.02 0.00 -1.46 0.00 0.00 42.92 39.06 1w00 s ASP 24 CO 0.00 -1.25 1.66 0.40 0.52 0.00 0.00 175.17 176.51 1w00 h ILE 25 N 5.98 1.23 -0.58 4.11 2.04 -1.94 -1.77 117.51 126.57 1w00 h ILE 25 Ca -0.00 -0.80 -0.00 0.00 1.00 0.00 0.00 64.86 65.05 1w00 h ILE 25 Cb 1.04 0.84 -0.03 0.00 -0.74 0.00 0.00 36.82 37.93 1w00 h ILE 25 CO 1.17 0.29 0.35 -0.33 0.00 0.00 0.00 178.15 179.62 1w00 h GLU 26 N 0.65 0.80 -0.59 2.37 4.39 -1.98 0.12 114.58 120.34 1w00 h GLU 26 Ca 0.15 -0.08 -0.10 0.00 0.34 0.00 0.00 59.36 59.68 1w00 h GLU 26 Cb 0.30 -0.16 -0.02 0.00 -0.10 0.00 0.00 28.75 28.76 1w00 h GLU 26 CO -0.00 0.58 -0.01 0.00 -1.16 0.00 0.00 179.01 178.42 1w00 h ALA 27 N 1.17 0.87 0.14 3.43 0.00 -1.95 -1.96 119.26 120.97 1w00 h ALA 27 Ca 0.21 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 1w00 h ALA 27 Cb -0.01 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.57 1w00 h ALA 27 CO -0.04 0.66 -0.07 0.82 0.00 0.00 0.00 179.25 180.63 1w00 h ILE 28 N 0.94 0.95 -0.79 0.00 2.04 -0.95 -2.86 117.51 116.84 1w00 h ILE 28 Ca 0.17 -0.37 0.10 0.00 1.00 0.00 0.00 64.86 65.76 1w00 h ILE 28 Cb 0.55 1.18 -0.05 0.00 -0.74 0.00 0.00 36.82 37.76 1w00 h ILE 28 CO 0.03 0.09 0.52 0.58 0.00 0.00 0.00 178.15 179.36 1w00 h VAL 29 N -0.36 0.93 0.00 1.67 2.07 -0.89 -0.24 116.25 119.44 1w00 h VAL 29 Ca -0.02 -0.24 -0.01 0.00 0.82 0.00 0.00 66.70 67.25 1w00 h VAL 29 Cb 0.28 0.17 -0.00 0.00 -1.52 0.00 0.00 31.29 30.22 1w00 h VAL 29 CO 0.03 0.13 -0.04 1.56 0.02 0.00 0.00 177.57 179.27 1w00 h GLN 30 N 0.70 0.00 0.00 1.57 4.20 -1.12 -2.14 115.11 118.32 1w00 h GLN 30 Ca 0.37 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 59.07 1w00 h GLN 30 Cb 0.48 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.26 1w00 h GLN 30 CO -0.14 0.04 -0.02 0.52 -0.67 0.00 0.00 178.83 178.56 1w00 h MET 31 N 0.00 0.00 -6.95 1.46 2.86 -0.96 -3.45 114.93 107.89 1w00 h MET 31 Ca -0.00 0.00 -0.49 0.00 -2.06 0.00 0.00 59.70 57.15 1w00 h MET 31 Cb 0.18 0.00 0.02 0.00 0.06 0.00 0.00 31.60 31.86 1w00 h MET 31 CO 0.01 0.02 0.17 0.71 1.06 0.00 0.00 176.91 178.87 1w00 s TYR 32 N -3.67 3.51 0.43 -0.22 2.02 -0.80 -0.63 117.35 117.99 1w00 s TYR 32 Ca 0.01 1.03 -0.01 0.00 -0.37 0.00 0.00 57.07 57.73 1w00 s TYR 32 Cb 0.09 -2.45 -0.02 0.00 -0.40 0.00 0.00 41.96 39.17 1w00 s TYR 32 CO 0.55 -0.24 0.67 0.00 -1.57 0.00 0.00 175.55 174.96 1w00 s ALA 33 N -2.59 3.61 0.34 3.71 0.00 -0.45 -4.70 121.76 121.69 1w00 s ALA 33 Ca 0.51 -0.83 0.07 0.00 0.00 0.00 0.00 51.96 51.71 1w00 s ALA 33 Cb -0.10 -2.27 0.76 0.00 0.00 0.00 0.00 23.12 21.51 1w00 s ALA 33 CO 0.38 -0.25 1.88 -0.44 0.00 0.00 0.00 175.76 177.32 1w00 h ASP 34 N 0.46 0.70 -0.67 0.00 3.45 -1.98 -1.54 116.42 116.83 1w00 h ASP 34 Ca -0.48 0.04 0.00 0.00 0.43 0.00 0.00 57.03 57.02 1w00 h ASP 34 Cb 1.23 -0.10 0.00 0.00 -0.56 0.00 0.00 39.33 39.89 1w00 h ASP 34 CO 0.60 0.37 0.00 -0.90 -1.57 0.00 0.00 179.24 177.74 1w00 n ASP 35 N -4.56 4.02 -4.65 6.45 5.75 -1.26 -4.49 116.55 117.82 1w00 n ASP 35 Ca 0.17 -2.15 -0.36 0.00 -0.01 0.00 0.00 54.79 52.43 1w00 n ASP 35 Cb 0.42 -0.50 0.08 0.00 -1.03 0.00 0.00 41.12 40.08 1w00 n ASP 35 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1w00 n ALA 36 N 1.38 0.28 -2.58 2.12 0.00 -0.58 -4.91 120.51 116.23 1w00 n ALA 36 Ca 0.24 -0.09 -0.22 0.00 0.00 0.00 0.00 53.44 53.36 1w00 n ALA 36 Cb 0.68 -2.18 -0.14 0.00 0.00 0.00 0.00 19.45 17.81 1w00 n ALA 36 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1w00 s THR 37 N -1.63 1.35 -0.10 0.00 -4.23 -0.87 -4.09 115.64 106.07 1w00 s THR 37 Ca 0.77 -1.10 0.03 0.00 -1.18 0.00 0.00 61.69 60.21 1w00 s THR 37 Cb -0.37 -1.20 0.01 0.00 1.34 0.00 0.00 72.50 72.28 1w00 s THR 37 CO 0.46 0.07 -0.19 -0.69 -0.54 0.00 0.00 174.62 173.74 1w00 s VAL 38 N -0.85 1.72 -0.34 2.29 1.01 0.42 -1.52 120.40 123.13 1w00 s VAL 38 Ca 0.04 -0.80 0.02 0.00 0.00 0.00 0.00 61.98 61.24 1w00 s VAL 38 Cb -0.08 -1.52 0.10 0.00 0.00 0.00 0.00 36.38 34.88 1w00 s VAL 38 CO 0.02 0.48 0.09 -1.61 0.00 0.00 0.00 175.10 174.08 1w00 s GLU 39 N 0.62 1.17 -0.24 2.72 2.02 -0.31 0.09 118.70 124.76 1w00 s GLU 39 Ca -0.14 -1.59 -0.03 0.00 0.02 0.00 0.00 54.97 53.23 1w00 s GLU 39 Cb -0.16 -2.65 0.12 0.00 0.10 0.00 0.00 34.13 31.54 1w00 s GLU 39 CO 0.04 -0.98 0.32 0.34 0.02 0.00 0.00 175.26 175.00 1w00 s ASP 40 N 1.10 0.76 0.48 -0.19 -1.08 -1.26 -1.58 116.67 114.89 1w00 s ASP 40 Ca 0.11 -0.05 -0.20 0.00 -0.52 0.00 0.00 52.55 51.89 1w00 s ASP 40 Cb -0.19 0.82 -0.09 0.00 -1.46 0.00 0.00 42.92 42.00 1w00 s ASP 40 CO -0.14 -0.32 1.02 -2.16 0.52 0.00 0.00 175.17 174.09 1w00 s PRO 41 N 2.46 3.86 0.27 4.34 0.04 -1.26 -4.98 135.00 139.72 1w00 s PRO 41 Ca 0.10 1.32 -0.30 0.00 0.04 0.00 0.00 61.00 62.16 1w00 s PRO 41 Cb -0.15 -2.11 -0.13 0.00 0.04 0.00 0.00 34.50 32.16 1w00 s PRO 41 CO -0.17 -0.38 1.45 0.34 0.04 0.00 0.00 177.00 178.28 1w00 n PHE 42 N -0.95 2.42 0.00 0.56 7.35 0.38 -1.44 117.46 125.78 1w00 n PHE 42 Ca 0.09 0.39 0.00 0.00 -0.76 0.00 0.00 57.45 57.17 1w00 n PHE 42 Cb 0.53 -2.50 0.00 0.00 0.35 0.00 0.00 39.48 37.86 1w00 n PHE 42 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1w00 n GLY 43 N 1.95 2.27 3.90 7.13 0.00 -1.26 -4.87 105.19 114.31 1w00 n GLY 43 Ca 0.10 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.81 1w00 n GLY 43 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1w00 s GLN 44 N -0.17 3.65 0.36 1.61 -1.52 -0.52 -5.04 119.66 118.03 1w00 s GLN 44 Ca 0.00 -0.01 -0.26 0.00 -1.95 0.00 0.00 55.36 53.15 1w00 s GLN 44 Cb 0.00 -2.74 -0.12 0.00 -0.22 0.00 0.00 33.01 29.93 1w00 s GLN 44 CO 0.00 0.35 0.96 -0.35 -0.25 0.00 0.00 175.29 176.00 1w00 n PRO 45 N -0.36 1.27 -2.04 2.91 -0.04 -1.26 -4.72 135.00 130.76 1w00 n PRO 45 Ca -0.02 0.45 -0.41 0.00 -0.04 0.00 0.00 63.50 63.48 1w00 n PRO 45 Cb 0.53 -1.90 -0.02 0.00 -0.04 0.00 0.00 33.50 32.07 1w00 n PRO 45 CO 0.00 0.00 0.00 -2.14 -0.04 0.00 0.00 175.50 173.32 1w00 s PRO 46 N -1.77 4.29 -0.20 0.54 0.02 -1.26 -4.79 135.00 131.84 1w00 s PRO 46 Ca 0.61 2.29 -0.08 0.00 0.02 0.00 0.00 61.00 63.84 1w00 s PRO 46 Cb -0.62 -3.07 -0.04 0.00 0.02 0.00 0.00 34.50 30.78 1w00 s PRO 46 CO 0.58 -0.31 0.08 0.42 -0.33 0.00 0.00 177.00 177.44 1w00 s ILE 47 N -0.74 4.83 0.10 2.83 1.01 0.11 -4.88 121.20 124.47 1w00 s ILE 47 Ca 0.53 -0.02 0.03 0.00 0.00 0.00 0.00 60.65 61.20 1w00 s ILE 47 Cb -0.41 -3.19 -0.04 0.00 0.01 0.00 0.00 42.46 38.82 1w00 s ILE 47 CO 0.51 0.43 -0.09 -1.38 0.00 0.00 0.00 174.94 174.41 1w00 s HIS 48 N 0.57 1.05 0.00 3.97 -3.43 -1.26 -0.44 115.29 115.75 1w00 s HIS 48 Ca 0.04 -0.72 0.00 0.00 -0.80 0.00 0.00 55.06 53.57 1w00 s HIS 48 Cb -0.13 -0.57 0.00 0.00 -1.43 0.00 0.00 32.58 30.45 1w00 s HIS 48 CO 0.01 -0.02 0.00 0.41 -2.00 0.00 0.00 174.74 173.14 1w00 n GLY 49 N 0.32 0.80 0.21 -1.38 0.00 -1.26 -4.56 105.19 99.33 1w00 n GLY 49 Ca -0.14 -1.25 -0.02 0.00 0.00 0.00 0.00 46.02 44.61 1w00 n GLY 49 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 1w00 h ARG 50 N 0.00 0.36 -0.73 1.61 3.08 -1.91 0.87 114.38 117.64 1w00 h ARG 50 Ca 0.00 -0.02 0.07 0.00 0.07 0.00 0.00 59.98 60.10 1w00 h ARG 50 Cb 0.00 -0.08 -0.06 0.00 0.08 0.00 0.00 29.97 29.91 1w00 h ARG 50 CO 0.00 0.24 0.41 1.49 -1.07 0.00 0.00 179.97 181.03 1w00 h GLU 51 N 0.37 0.70 -0.29 0.04 4.81 -1.99 0.35 114.58 118.57 1w00 h GLU 51 Ca 0.27 -0.04 -0.04 0.00 -0.13 0.00 0.00 59.36 59.42 1w00 h GLU 51 Cb 0.31 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.52 1w00 h GLU 51 CO -0.28 0.47 0.03 1.96 -0.73 0.00 0.00 179.01 180.46 1w00 h GLN 52 N 0.72 0.50 -0.47 1.92 7.50 -1.52 -0.30 115.11 123.46 1w00 h GLN 52 Ca 0.34 -0.14 -0.07 0.00 0.50 0.00 0.00 58.65 59.27 1w00 h GLN 52 Cb 0.26 -0.05 -0.02 0.00 0.05 0.00 0.00 27.48 27.72 1w00 h GLN 52 CO -0.21 0.62 0.00 0.82 -1.50 0.00 0.00 178.83 178.56 1w00 h ILE 53 N 0.30 1.24 -0.52 2.54 2.04 -0.26 0.04 117.51 122.90 1w00 h ILE 53 Ca 0.09 -0.99 -0.11 0.00 1.00 0.00 0.00 64.86 64.84 1w00 h ILE 53 Cb 0.38 0.88 -0.02 0.00 -0.74 0.00 0.00 36.82 37.32 1w00 h ILE 53 CO 0.01 0.35 -0.12 0.00 0.00 0.00 0.00 178.15 178.39 1w00 h ALA 54 N 1.27 0.71 -0.30 1.87 0.00 -0.15 -2.28 119.26 120.38 1w00 h ALA 54 Ca 0.14 -0.35 -0.07 0.00 0.00 0.00 0.00 54.91 54.63 1w00 h ALA 54 Cb 0.44 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 1w00 h ALA 54 CO 0.02 0.63 -0.12 0.00 0.00 0.00 0.00 179.25 179.78 1w00 h ALA 55 N 0.91 1.23 -0.25 0.00 0.00 -0.67 -1.50 119.26 118.98 1w00 h ALA 55 Ca 0.13 -0.27 -0.00 0.00 0.00 0.00 0.00 54.91 54.77 1w00 h ALA 55 Cb 0.69 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.33 1w00 h ALA 55 CO 0.05 0.50 0.14 0.35 0.00 0.00 0.00 179.25 180.29 1w00 h PHE 56 N 0.48 0.33 0.00 0.00 3.04 -0.60 -2.32 116.94 117.87 1w00 h PHE 56 Ca 0.09 -0.00 -0.05 0.00 3.98 0.00 0.00 57.97 61.98 1w00 h PHE 56 Cb 0.49 -0.11 -0.01 0.00 2.56 0.00 0.00 35.95 38.89 1w00 h PHE 56 CO 0.02 0.27 -0.25 1.88 -2.02 0.00 0.00 178.31 178.20 1w00 h TYR 57 N 0.30 0.00 -0.17 0.41 0.05 -1.17 -2.93 116.97 113.46 1w00 h TYR 57 Ca 0.09 0.00 -0.20 0.00 0.05 0.00 0.00 58.73 58.67 1w00 h TYR 57 Cb 0.04 0.00 0.00 0.00 1.01 0.00 0.00 36.73 37.78 1w00 h TYR 57 CO -0.04 0.25 -0.69 -0.09 -1.05 0.00 0.00 178.16 176.54 1w00 h ARG 58 N 0.00 0.68 0.00 4.88 2.43 -0.95 0.12 114.38 121.54 1w00 h ARG 58 Ca -0.00 -0.51 -0.03 0.00 -0.81 0.00 0.00 59.98 58.63 1w00 h ARG 58 Cb 0.84 0.09 -0.00 0.00 -0.42 0.00 0.00 29.97 30.47 1w00 h ARG 58 CO 0.03 1.13 -0.14 0.37 -1.51 0.00 0.00 179.97 179.85 1w00 h GLN 59 N 0.48 0.00 0.07 0.20 5.75 -1.38 0.26 115.11 120.49 1w00 h GLN 59 Ca -0.03 0.00 -0.32 0.00 -0.15 0.00 0.00 58.65 58.15 1w00 h GLN 59 Cb 1.29 0.00 -0.03 0.00 1.07 0.00 0.00 27.48 29.81 1w00 h GLN 59 CO 0.14 0.14 -1.79 0.41 -2.65 0.00 0.00 178.83 175.07 1w00 n GLY 60 N 0.66 -0.64 0.02 2.39 0.00 -1.11 -4.60 105.19 101.91 1w00 n GLY 60 Ca 0.02 -0.12 0.06 0.00 0.00 0.00 0.00 46.02 45.98 1w00 n GLY 60 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1w00 n LEU 61 N -3.86 0.00 -2.57 0.99 4.77 0.42 -4.91 117.00 111.83 1w00 n LEU 61 Ca -0.34 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.64 1w00 n LEU 61 Cb 0.90 0.07 0.00 0.00 -2.33 0.00 0.00 43.42 42.07 1w00 n LEU 61 CO 0.31 0.07 0.43 0.61 -1.33 0.00 0.00 177.39 177.48 1w00 n GLY 62 N 1.52 0.85 0.14 -0.72 0.00 0.92 -4.77 105.19 103.14 1w00 n GLY 62 Ca -0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.94 1w00 n GLY 62 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1w00 n LYS 65 N 2.78 0.00 -1.89 1.61 4.81 -1.26 -4.95 118.16 119.26 1w00 n LYS 65 Ca 0.00 0.00 -0.42 0.00 -0.87 0.00 0.00 58.31 57.02 1w00 n LYS 65 Cb 0.00 -0.15 -0.02 0.00 0.02 0.00 0.00 35.03 34.88 1w00 n LYS 65 CO 0.00 0.00 0.00 0.08 1.17 0.00 0.00 177.40 178.65 1w00 s VAL 66 N -2.06 2.40 0.17 3.15 1.01 -1.26 -4.85 120.40 118.95 1w00 s VAL 66 Ca 0.00 0.32 0.11 0.00 0.00 0.00 0.00 61.98 62.41 1w00 s VAL 66 Cb 0.00 -3.20 -0.04 0.00 0.00 0.00 0.00 36.38 33.13 1w00 s VAL 66 CO 0.00 0.04 -0.25 -0.13 0.00 0.00 0.00 175.10 174.76 1w00 s ARG 67 N 0.07 1.47 -0.16 2.72 1.81 -0.31 -4.75 118.95 119.79 1w00 s ARG 67 Ca 0.64 -1.45 -0.14 0.00 -1.72 0.00 0.00 55.73 53.07 1w00 s ARG 67 Cb -0.45 -1.87 0.04 0.00 -0.45 0.00 0.00 34.95 32.22 1w00 s ARG 67 CO 0.41 0.42 0.42 0.00 -0.68 0.00 0.00 175.30 175.87 1w00 s ALA 68 N -1.40 -1.04 0.02 2.13 0.00 -1.26 -0.51 121.76 119.69 1w00 s ALA 68 Ca 0.18 1.24 -0.07 0.00 0.00 0.00 0.00 51.96 53.31 1w00 s ALA 68 Cb -0.09 -0.73 -0.00 0.00 0.00 0.00 0.00 23.12 22.30 1w00 s ALA 68 CO 0.08 -0.21 0.14 0.00 0.00 0.00 0.00 175.76 175.77 1w00 s LEU 70 N -1.71 4.47 -0.01 0.00 1.43 -1.26 -1.61 118.68 119.98 1w00 s LEU 70 Ca -0.10 2.40 0.09 0.00 -1.03 0.00 0.00 54.13 55.49 1w00 s LEU 70 Cb -0.05 -3.62 0.26 0.00 0.03 0.00 0.00 46.19 42.81 1w00 s LEU 70 CO -0.01 -0.38 1.22 0.35 0.23 0.00 0.00 176.35 177.76 1w00 n THR 71 N 1.67 1.08 -3.61 5.49 -2.24 -0.60 -4.87 114.28 111.20 1w00 n THR 71 Ca 0.02 -1.06 -0.00 0.00 -2.27 0.00 0.00 64.05 60.73 1w00 n THR 71 Cb 0.43 0.45 -0.01 0.00 -2.10 0.00 0.00 70.33 69.10 1w00 n THR 71 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 1w00 s GLY 72 N -1.07 -0.33 0.71 3.38 0.00 -1.25 -4.95 107.32 103.81 1w00 s GLY 72 Ca 0.20 1.42 -0.13 0.00 0.00 0.00 0.00 44.72 46.21 1w00 s GLY 72 CO 0.12 0.42 1.11 2.56 0.00 0.00 0.00 173.10 177.31 1w00 s PRO 73 N -2.17 2.53 0.20 2.90 0.04 -1.26 -4.53 135.00 132.72 1w00 s PRO 73 Ca 0.13 1.34 -0.30 0.00 0.04 0.00 0.00 61.00 62.21 1w00 s PRO 73 Cb 0.02 -1.92 -0.08 0.00 0.04 0.00 0.00 34.50 32.56 1w00 s PRO 73 CO -0.04 -1.45 1.14 0.08 0.04 0.00 0.00 177.00 176.77 1w00 s VAL 74 N -2.51 3.67 -0.38 -0.36 1.01 -1.26 -4.58 120.40 115.99 1w00 s VAL 74 Ca 0.65 1.47 -0.11 0.00 0.00 0.00 0.00 61.98 64.00 1w00 s VAL 74 Cb -0.20 -3.94 0.03 0.00 0.00 0.00 0.00 36.38 32.27 1w00 s VAL 74 CO 0.47 0.27 0.21 -0.13 0.00 0.00 0.00 175.10 175.92 1w00 s ARG 75 N -0.55 2.81 0.18 2.72 3.00 0.98 -4.97 118.95 123.12 1w00 s ARG 75 Ca 0.50 -1.10 0.07 0.00 0.00 0.00 0.00 55.73 55.20 1w00 s ARG 75 Cb -0.31 -3.75 -0.04 0.00 0.00 0.00 0.00 34.95 30.85 1w00 s ARG 75 CO 0.37 -0.72 0.02 0.00 0.00 0.00 0.00 175.30 174.97 1w00 s ALA 76 N 1.55 3.26 0.55 2.13 0.00 -1.26 -0.31 121.76 127.68 1w00 s ALA 76 Ca 0.02 -1.37 0.04 0.00 0.00 0.00 0.00 51.96 50.64 1w00 s ALA 76 Cb -0.19 -1.03 0.04 0.00 0.00 0.00 0.00 23.12 21.93 1w00 s ALA 76 CO 0.07 0.46 0.31 -1.13 0.00 0.00 0.00 175.76 175.47 1w00 n SER 77 N -0.25 2.97 -1.09 0.00 3.41 -0.13 -4.98 113.62 113.56 1w00 n SER 77 Ca -0.09 -3.03 0.11 0.00 -0.26 0.00 0.00 58.87 55.61 1w00 n SER 77 Cb 0.55 0.06 0.25 0.00 -0.26 0.00 0.00 64.21 64.82 1w00 n SER 77 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1w00 n HIS 78 N -1.69 0.54 -1.77 7.33 8.25 -1.26 -3.77 115.22 122.85 1w00 n HIS 78 Ca -0.07 -0.27 -0.22 0.00 -0.26 0.00 0.00 57.72 56.90 1w00 n HIS 78 Cb 0.65 0.00 0.07 0.00 1.12 0.00 0.00 29.99 31.83 1w00 n HIS 78 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 1w00 n ASN 79 N 1.32 4.92 -1.08 0.41 2.04 -1.26 -4.92 115.26 116.69 1w00 n ASN 79 Ca 0.19 -3.78 -0.12 0.00 -0.44 0.00 0.00 54.58 50.44 1w00 n ASN 79 Cb 0.56 -0.53 -0.04 0.00 -2.53 0.00 0.00 39.78 37.24 1w00 n ASN 79 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1w00 n GLY 80 N -0.84 0.91 3.40 4.83 0.00 -1.25 -4.66 105.19 107.58 1w00 n GLY 80 Ca 0.45 -0.43 -0.25 0.00 0.00 0.00 0.00 46.02 45.79 1w00 n GLY 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1w00 s GLY 82 N -2.77 -0.13 -0.02 0.00 0.00 -0.52 -0.95 107.32 102.94 1w00 s GLY 82 Ca 0.20 -0.19 -0.02 0.00 0.00 0.00 0.00 44.72 44.72 1w00 s GLY 82 CO 0.09 -0.32 0.04 0.00 0.00 0.00 0.00 173.10 172.92 1w00 s ALA 83 N -3.85 -0.11 -0.03 3.20 0.00 0.58 -1.01 121.76 120.53 1w00 s ALA 83 Ca 0.07 0.13 -0.08 0.00 0.00 0.00 0.00 51.96 52.07 1w00 s ALA 83 Cb 0.00 -0.07 0.01 0.00 0.00 0.00 0.00 23.12 23.06 1w00 s ALA 83 CO -0.06 -0.02 0.19 0.00 0.00 0.00 0.00 175.76 175.87 1w00 s MET 84 N 0.03 0.41 -0.08 0.00 0.23 0.18 -0.01 119.30 120.06 1w00 s MET 84 Ca -0.00 -0.07 -0.09 0.00 -1.03 0.00 0.00 55.69 54.49 1w00 s MET 84 Cb -0.00 0.18 -0.05 0.00 -1.53 0.00 0.00 34.83 33.43 1w00 s MET 84 CO 0.00 -0.09 0.22 -1.25 -2.03 0.00 0.00 175.02 171.87 1w00 s PRO 85 N -0.74 3.58 0.24 3.16 0.04 -1.26 -0.74 135.00 139.28 1w00 s PRO 85 Ca -0.08 0.02 -0.19 0.00 0.04 0.00 0.00 61.00 60.78 1w00 s PRO 85 Cb -0.05 -3.19 0.03 0.00 0.04 0.00 0.00 34.50 31.33 1w00 s PRO 85 CO 0.01 0.75 0.63 -0.59 0.04 0.00 0.00 177.00 177.84 1w00 s PHE 86 N -1.06 -0.16 -0.03 0.56 -0.71 0.13 -1.56 117.98 115.16 1w00 s PHE 86 Ca 0.18 -0.23 0.06 0.00 -1.04 0.00 0.00 56.93 55.90 1w00 s PHE 86 Cb -0.13 0.55 -0.01 0.00 -1.21 0.00 0.00 43.02 42.22 1w00 s PHE 86 CO 0.07 -1.08 -0.21 0.50 -1.34 0.00 0.00 175.22 173.16 1w00 s ARG 87 N -3.90 1.90 -0.14 1.99 3.52 -0.64 -0.74 118.95 120.95 1w00 s ARG 87 Ca 0.11 -0.75 -0.01 0.00 -0.13 0.00 0.00 55.73 54.95 1w00 s ARG 87 Cb -0.03 -1.73 -0.01 0.00 -1.56 0.00 0.00 34.95 31.61 1w00 s ARG 87 CO 0.02 0.39 -0.12 0.08 -0.81 0.00 0.00 175.30 174.86 1w00 s VAL 88 N -0.29 3.09 -0.24 7.11 1.01 0.63 -2.26 120.40 129.45 1w00 s VAL 88 Ca 0.03 -0.64 -0.09 0.00 0.00 0.00 0.00 61.98 61.28 1w00 s VAL 88 Cb -0.10 -2.31 -0.04 0.00 0.00 0.00 0.00 36.38 33.93 1w00 s VAL 88 CO 0.01 0.52 0.11 -1.61 0.00 0.00 0.00 175.10 174.13 1w00 s GLU 89 N 0.45 3.89 0.00 2.72 2.02 0.33 -0.82 118.70 127.28 1w00 s GLU 89 Ca -0.09 -0.37 0.00 0.00 0.02 0.00 0.00 54.97 54.53 1w00 s GLU 89 Cb -0.16 -3.41 0.00 0.00 0.10 0.00 0.00 34.13 30.66 1w00 s GLU 89 CO 0.05 -0.02 0.00 0.00 0.02 0.00 0.00 175.26 175.31 1w00 n MET 90 N 4.46 0.00 -4.96 1.61 0.00 -0.94 -1.17 117.12 116.12 1w00 n MET 90 Ca -0.16 0.00 -0.28 0.00 0.00 0.00 0.00 57.70 57.27 1w00 n MET 90 Cb 0.52 0.00 -0.16 0.00 0.00 0.00 0.00 33.22 33.58 1w00 n MET 90 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 175.97 176.05 1w00 s VAL 91 N -2.18 1.63 -0.01 3.17 1.01 -1.26 -1.36 120.40 121.40 1w00 s VAL 91 Ca 0.00 -0.82 -0.00 0.00 0.00 0.00 0.00 61.98 61.16 1w00 s VAL 91 Cb 0.00 -1.40 0.01 0.00 0.00 0.00 0.00 36.38 35.00 1w00 s VAL 91 CO 0.00 0.46 0.03 0.86 0.00 0.00 0.00 175.10 176.45 1w00 s TRP 92 N 0.06 -0.00 -2.05 5.22 -0.00 0.45 -4.78 118.94 117.84 1w00 s TRP 92 Ca -0.06 0.09 0.00 0.00 -0.00 0.00 0.00 56.10 56.13 1w00 s TRP 92 Cb -0.13 -0.10 0.00 0.00 -0.00 0.00 0.00 33.47 33.24 1w00 s TRP 92 CO 0.03 -0.05 0.00 -1.71 -0.00 0.00 0.00 176.95 175.23 1w00 n ASN 93 N 3.58 -5.62 -0.39 5.86 2.85 -1.26 -0.86 115.26 119.42 1w00 n ASN 93 Ca -0.19 0.33 -0.03 0.00 -0.11 0.00 0.00 54.58 54.57 1w00 n ASN 93 Cb 0.56 -4.86 -0.00 0.00 1.24 0.00 0.00 39.78 36.71 1w00 n ASN 93 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1w00 n GLY 94 N -0.61 0.27 3.10 8.20 0.00 -1.26 -5.05 105.19 109.84 1w00 n GLY 94 Ca -0.22 -0.76 -0.12 0.00 0.00 0.00 0.00 46.02 44.92 1w00 n GLY 94 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1w00 s GLN 95 N -3.98 0.38 0.21 1.61 2.00 -0.04 -5.14 119.66 114.69 1w00 s GLN 95 Ca 0.00 -0.12 -0.31 0.00 -2.00 0.00 0.00 55.36 52.93 1w00 s GLN 95 Cb 0.00 0.17 -0.11 0.00 0.80 0.00 0.00 33.01 33.87 1w00 s GLN 95 CO 0.00 -0.08 1.57 -1.25 -0.50 0.00 0.00 175.29 175.03 1w00 s PRO 96 N -0.77 4.20 0.21 1.67 0.04 -1.26 -0.41 135.00 138.67 1w00 s PRO 96 Ca -0.09 2.42 -0.03 0.00 0.04 0.00 0.00 61.00 63.34 1w00 s PRO 96 Cb -0.05 -3.11 -0.03 0.00 0.04 0.00 0.00 34.50 31.34 1w00 s PRO 96 CO 0.01 -0.60 0.19 0.00 0.04 0.00 0.00 177.00 176.65 1w00 s ALA 98 N -4.13 1.23 -0.09 0.00 0.00 0.13 -2.20 121.76 116.70 1w00 s ALA 98 Ca 0.36 -0.67 0.01 0.00 0.00 0.00 0.00 51.96 51.65 1w00 s ALA 98 Cb 0.06 -0.30 0.02 0.00 0.00 0.00 0.00 23.12 22.90 1w00 s ALA 98 CO 0.11 0.29 -0.10 -1.17 0.00 0.00 0.00 175.76 174.90 1w00 s LEU 99 N -0.47 1.41 -0.15 0.00 2.96 -0.00 -0.18 118.68 122.24 1w00 s LEU 99 Ca 0.05 -0.30 -0.18 0.00 -0.22 0.00 0.00 54.13 53.48 1w00 s LEU 99 Cb -0.06 -0.82 -0.04 0.00 0.50 0.00 0.00 46.19 45.77 1w00 s LEU 99 CO -0.00 -0.05 0.49 -1.81 -1.32 0.00 0.00 176.35 173.67 1w00 s ASP 100 N 1.19 6.63 0.08 3.68 1.01 -0.27 -0.27 116.67 128.73 1w00 s ASP 100 Ca -0.05 0.75 0.01 0.00 0.71 0.00 0.00 52.55 53.98 1w00 s ASP 100 Cb -0.14 -2.29 -0.04 0.00 1.01 0.00 0.00 42.92 41.46 1w00 s ASP 100 CO -0.02 -0.08 -0.06 -0.69 0.21 0.00 0.00 175.17 174.53 1w00 s VAL 101 N 1.06 0.60 -0.11 -1.27 1.01 0.08 -4.76 120.40 117.00 1w00 s VAL 101 Ca 0.25 -1.80 -0.01 0.00 0.00 0.00 0.00 61.98 60.42 1w00 s VAL 101 Cb -0.15 -1.52 0.03 0.00 0.00 0.00 0.00 36.38 34.74 1w00 s VAL 101 CO 0.10 -0.83 -0.05 -0.63 0.00 0.00 0.00 175.10 173.69 1w00 s ILE 102 N -3.38 0.85 -0.16 2.22 1.01 -1.09 -0.69 121.20 119.95 1w00 s ILE 102 Ca 0.08 -0.21 -0.08 0.00 0.00 0.00 0.00 60.65 60.45 1w00 s ILE 102 Cb 0.04 -0.92 -0.04 0.00 0.01 0.00 0.00 42.46 41.54 1w00 s ILE 102 CO -0.05 0.31 0.12 -0.76 0.00 0.00 0.00 174.94 174.56 1w00 s LEU 103 N 1.78 4.19 -0.14 2.97 1.43 0.08 -1.38 118.68 127.62 1w00 s LEU 103 Ca 0.05 0.30 0.02 0.00 -1.03 0.00 0.00 54.13 53.47 1w00 s LEU 103 Cb -0.13 -2.05 0.00 0.00 0.03 0.00 0.00 46.19 44.05 1w00 s LEU 103 CO -0.07 0.28 -0.20 -0.69 0.23 0.00 0.00 176.35 175.90 1w00 s VAL 104 N -0.27 2.28 0.06 -1.59 1.01 0.01 -0.64 120.40 121.26 1w00 s VAL 104 Ca 0.10 -0.91 0.04 0.00 0.00 0.00 0.00 61.98 61.22 1w00 s VAL 104 Cb -0.12 -1.92 -0.03 0.00 0.00 0.00 0.00 36.38 34.31 1w00 s VAL 104 CO 0.01 0.54 -0.12 -0.04 0.00 0.00 0.00 175.10 175.48 1w00 s MET 105 N 0.74 0.76 -0.16 2.72 -1.94 -0.18 -0.59 119.30 120.65 1w00 s MET 105 Ca -0.08 -0.86 0.02 0.00 -1.71 0.00 0.00 55.69 53.06 1w00 s MET 105 Cb -0.16 -0.71 0.01 0.00 2.01 0.00 0.00 34.83 35.98 1w00 s MET 105 CO 0.00 0.16 -0.21 0.50 -0.01 0.00 0.00 175.02 175.47 1w00 s ARG 106 N -1.56 2.94 0.25 2.03 3.52 -0.38 -1.44 118.95 124.31 1w00 s ARG 106 Ca -0.03 -0.82 0.04 0.00 -0.13 0.00 0.00 55.73 54.79 1w00 s ARG 106 Cb -0.09 -2.45 -0.03 0.00 -1.56 0.00 0.00 34.95 30.81 1w00 s ARG 106 CO 0.02 -0.11 0.40 -0.06 -0.81 0.00 0.00 175.30 174.74 1w00 s PHE 107 N 1.04 3.46 0.33 5.12 0.40 0.29 0.25 117.98 128.88 1w00 s PHE 107 Ca -0.02 0.08 0.05 0.00 -0.60 0.00 0.00 56.93 56.45 1w00 s PHE 107 Cb -0.14 -1.65 0.05 0.00 0.51 0.00 0.00 43.02 41.79 1w00 s PHE 107 CO -0.07 0.38 0.44 -0.40 0.70 0.00 0.00 175.22 176.27 1w00 n ASP 108 N -1.40 1.27 0.00 1.36 5.68 0.16 -2.80 116.55 120.82 1w00 n ASP 108 Ca -0.08 -1.90 0.04 0.00 -0.50 0.00 0.00 54.79 52.35 1w00 n ASP 108 Cb 0.57 -0.22 0.20 0.00 -1.14 0.00 0.00 41.12 40.52 1w00 n ASP 108 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 1w00 n GLU 109 N -1.68 0.11 -0.04 0.11 4.71 -1.26 -1.17 120.64 121.41 1w00 n GLU 109 Ca 0.09 0.22 0.06 0.00 -0.01 0.00 0.00 57.16 57.51 1w00 n GLU 109 Cb 0.34 -1.50 0.08 0.00 -1.01 0.00 0.00 31.44 29.35 1w00 n GLU 109 CO 0.00 0.00 0.00 0.72 0.09 0.00 0.00 177.13 177.94 1w00 n HIS 110 N -1.30 0.12 -1.01 -0.32 8.25 -1.26 -4.72 115.22 114.97 1w00 n HIS 110 Ca 0.04 -0.12 -0.00 0.00 -0.26 0.00 0.00 57.72 57.37 1w00 n HIS 110 Cb 0.07 -0.01 -0.00 0.00 1.12 0.00 0.00 29.99 31.17 1w00 n HIS 110 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1w00 n GLY 111 N 0.63 0.44 3.69 -1.41 0.00 -0.32 -5.04 105.19 103.18 1w00 n GLY 111 Ca 0.08 -0.86 -0.30 0.00 0.00 0.00 0.00 46.02 44.94 1w00 n GLY 111 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1w00 s ARG 112 N -1.66 2.56 -0.06 1.61 0.52 -1.26 -4.81 118.95 115.85 1w00 s ARG 112 Ca 0.00 -0.87 -0.30 0.00 -0.52 0.00 0.00 55.73 54.05 1w00 s ARG 112 Cb 0.00 -2.53 -0.06 0.00 0.52 0.00 0.00 34.95 32.88 1w00 s ARG 112 CO 0.00 0.53 1.68 0.42 0.02 0.00 0.00 175.30 177.94 1w00 s ILE 113 N -1.38 3.55 -0.17 1.52 1.01 0.20 0.38 121.20 126.31 1w00 s ILE 113 Ca 0.26 0.66 -0.11 0.00 0.00 0.00 0.00 60.65 61.46 1w00 s ILE 113 Cb -0.11 -3.43 -0.23 0.00 0.01 0.00 0.00 42.46 38.70 1w00 s ILE 113 CO 0.19 -0.07 0.24 1.67 0.00 0.00 0.00 174.94 176.97 1w00 n GLN 114 N 7.18 0.68 -3.86 2.79 -0.06 0.14 -1.33 117.38 122.92 1w00 n GLN 114 Ca 0.18 0.36 -0.12 0.00 -2.00 0.00 0.00 57.00 55.41 1w00 n GLN 114 Cb 0.43 -1.70 -0.14 0.00 -4.06 0.00 0.00 30.24 24.77 1w00 n GLN 114 CO 0.00 0.00 0.00 0.95 -0.20 0.00 0.00 177.06 177.81 1w00 s THR 115 N -2.49 -0.00 -0.10 1.69 -4.23 -1.01 -2.06 115.64 107.43 1w00 s THR 115 Ca -0.26 0.02 0.00 0.00 -1.18 0.00 0.00 61.69 60.27 1w00 s THR 115 Cb 0.07 -0.04 0.02 0.00 1.34 0.00 0.00 72.50 73.89 1w00 s THR 115 CO 0.69 0.01 -0.10 -0.32 -0.54 0.00 0.00 174.62 174.36 1w00 s MET 116 N 0.10 1.65 -0.17 3.99 1.75 -0.57 -1.25 119.30 124.78 1w00 s MET 116 Ca -0.01 -0.33 -0.01 0.00 -1.25 0.00 0.00 55.69 54.10 1w00 s MET 116 Cb -0.01 -1.59 0.05 0.00 2.84 0.00 0.00 34.83 36.12 1w00 s MET 116 CO -0.00 -0.18 -0.04 -0.65 -0.65 0.00 0.00 175.02 173.49 1w00 s GLN 117 N 1.40 1.37 -0.31 4.11 -0.21 0.25 -1.17 119.66 125.10 1w00 s GLN 117 Ca -0.00 -0.55 -0.09 0.00 0.02 0.00 0.00 55.36 54.74 1w00 s GLN 117 Cb -0.13 -2.07 -0.00 0.00 1.00 0.00 0.00 33.01 31.81 1w00 s GLN 117 CO -0.05 -0.47 0.13 0.00 -2.12 0.00 0.00 175.29 172.78 1w00 s ALA 118 N 1.63 3.21 -0.14 6.09 0.00 -0.62 -0.81 121.76 131.13 1w00 s ALA 118 Ca -0.00 -1.42 -0.18 0.00 0.00 0.00 0.00 51.96 50.35 1w00 s ALA 118 Cb -0.16 -2.32 -0.04 0.00 0.00 0.00 0.00 23.12 20.60 1w00 s ALA 118 CO -0.07 -0.93 0.49 0.71 0.00 0.00 0.00 175.76 175.95 1w00 s TYR 119 N 1.58 3.47 0.00 0.00 1.51 -0.48 -0.47 117.35 122.96 1w00 s TYR 119 Ca 0.04 0.85 0.00 0.00 -1.01 0.00 0.00 57.07 56.94 1w00 s TYR 119 Cb -0.17 -2.58 0.00 0.00 -0.11 0.00 0.00 41.96 39.09 1w00 s TYR 119 CO 0.05 0.09 0.00 -2.67 -1.11 0.00 0.00 175.55 171.91 1w00 n TRP 120 N 4.01 0.00 -3.77 2.71 4.27 -1.26 -2.69 117.44 120.71 1w00 n TRP 120 Ca -0.06 0.00 -0.09 0.00 -3.89 0.00 0.00 57.50 53.46 1w00 n TRP 120 Cb 0.51 0.00 -0.01 0.00 -1.36 0.00 0.00 31.31 30.46 1w00 n TRP 120 CO 0.00 0.00 0.00 -1.13 -2.29 0.00 0.00 177.69 174.27 1w00 n SER 121 N 0.00 -1.19 -0.18 -0.67 3.41 -1.26 -4.74 113.62 108.99 1w00 n SER 121 Ca 0.00 -2.24 0.18 0.00 -0.26 0.00 0.00 58.87 56.55 1w00 n SER 121 Cb 0.00 2.11 0.54 0.00 -0.26 0.00 0.00 64.21 66.60 1w00 n SER 121 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1w00 h GLU 122 N 0.00 0.33 0.00 4.33 3.07 -2.00 0.75 114.58 121.05 1w00 h GLU 122 Ca -0.21 -0.02 -0.01 0.00 -0.50 0.00 0.00 59.36 58.63 1w00 h GLU 122 Cb 0.84 -0.07 -0.00 0.00 -0.84 0.00 0.00 28.75 28.68 1w00 h GLU 122 CO 0.27 0.22 -0.03 -0.39 -1.40 0.00 0.00 179.01 177.68 1w00 h VAL 123 N 0.34 0.26 -0.45 3.13 -1.51 -2.00 -1.48 116.25 114.53 1w00 h VAL 123 Ca 0.40 -0.21 0.00 0.00 -1.23 0.00 0.00 66.70 65.66 1w00 h VAL 123 Cb 1.06 1.16 0.00 0.00 -2.13 0.00 0.00 31.29 31.38 1w00 h VAL 123 CO -0.12 0.03 0.00 0.59 -1.23 0.00 0.00 177.57 176.84 1w00 n ASN 124 N -3.39 2.65 -4.75 4.19 4.13 0.25 -4.87 115.26 113.47 1w00 n ASN 124 Ca -0.02 -2.07 -0.36 0.00 1.68 0.00 0.00 54.58 53.81 1w00 n ASN 124 Cb 0.15 -0.35 -0.08 0.00 -1.54 0.00 0.00 39.78 37.96 1w00 n ASN 124 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 1w00 s LEU 125 N -1.08 3.92 -0.07 3.41 2.96 -0.56 -1.11 118.68 126.14 1w00 s LEU 125 Ca 0.31 0.26 -0.02 0.00 -0.22 0.00 0.00 54.13 54.46 1w00 s LEU 125 Cb 0.17 -1.93 0.03 0.00 0.50 0.00 0.00 46.19 44.96 1w00 s LEU 125 CO 0.20 0.36 0.02 -0.94 -1.32 0.00 0.00 176.35 174.67 1w00 s SER 126 N -0.75 1.56 0.30 3.68 1.04 0.75 -4.99 113.70 115.28 1w00 s SER 126 Ca 0.12 -0.09 0.05 0.00 0.48 0.00 0.00 55.95 56.51 1w00 s SER 126 Cb -0.12 -0.38 0.05 0.00 0.10 0.00 0.00 66.02 65.67 1w00 s SER 126 CO 0.03 -0.21 0.39 0.55 0.98 0.00 0.00 173.24 174.97 1w00 n VAL 127 N 5.18 0.00 0.00 5.02 3.14 -1.26 0.21 118.33 130.62 1w00 n VAL 127 Ca -0.06 -1.03 0.00 0.00 -2.96 0.00 0.00 64.34 60.28 1w00 n VAL 127 Cb 0.50 -0.67 0.00 0.00 -1.06 0.00 0.00 33.84 32.61 1w00 n VAL 127 CO 0.00 0.00 0.00 -1.14 -6.46 0.00 0.00 176.83 169.23