#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3d00 s ALA 3 N 0.00 3.63 -0.42 2.41 0.00 -1.26 -4.93 121.76 121.19 3d00 s ALA 3 Ca 0.00 0.67 0.07 0.00 0.00 0.00 0.00 51.96 52.70 3d00 s ALA 3 Cb 0.00 -3.65 0.24 0.00 0.00 0.00 0.00 23.12 19.71 3d00 s ALA 3 CO 0.00 -1.20 0.62 0.54 0.00 0.00 0.00 175.76 175.72 3d00 n ARG 4 N 6.56 0.70 -1.74 0.00 1.74 -1.26 -5.09 116.66 117.58 3d00 n ARG 4 Ca 0.15 -2.78 -0.40 0.00 -0.77 0.00 0.00 57.85 54.04 3d00 n ARG 4 Cb 0.44 -1.31 0.02 0.00 -1.02 0.00 0.00 32.46 30.59 3d00 n ARG 4 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 3d00 n ASN 5 N 1.57 3.00 -4.03 0.55 4.13 -1.26 -3.02 115.26 116.20 3d00 n ASN 5 Ca 0.18 1.11 -0.31 0.00 1.68 0.00 0.00 54.58 57.23 3d00 n ASN 5 Cb 0.56 -1.56 -0.15 0.00 -1.54 0.00 0.00 39.78 37.08 3d00 n ASN 5 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 3d00 s ILE 6 N -1.20 2.00 0.00 2.41 1.01 0.17 -4.90 121.20 120.69 3d00 s ILE 6 Ca 0.62 -1.59 0.00 0.00 0.00 0.00 0.00 60.65 59.68 3d00 s ILE 6 Cb -0.47 -2.18 0.00 0.00 0.01 0.00 0.00 42.46 39.82 3d00 s ILE 6 CO 0.57 -0.10 0.00 0.18 0.00 0.00 0.00 174.94 175.59 3d00 n LEU 7 N 4.48 0.00 0.02 2.97 4.77 -1.26 -0.76 117.00 127.23 3d00 n LEU 7 Ca -0.12 0.00 0.13 0.00 -0.03 0.00 0.00 56.01 55.99 3d00 n LEU 7 Cb 0.43 0.00 0.41 0.00 -2.33 0.00 0.00 43.42 41.93 3d00 n LEU 7 CO 0.20 0.00 0.71 -1.54 -1.33 0.00 0.00 177.39 175.43 3d00 n SER 8 N 3.80 0.37 -4.88 -1.43 3.41 -1.26 -4.89 113.62 108.74 3d00 n SER 8 Ca 0.00 0.23 -0.32 0.00 -0.26 0.00 0.00 58.87 58.52 3d00 n SER 8 Cb 0.00 -0.23 -0.05 0.00 -0.26 0.00 0.00 64.21 63.67 3d00 n SER 8 CO 0.00 0.00 0.00 -0.31 -0.16 0.00 0.00 175.04 174.57 3d00 s TYR 9 N -3.04 3.43 0.76 7.33 2.02 0.06 -5.10 117.35 122.82 3d00 s TYR 9 Ca 0.12 0.82 -0.11 0.00 -0.37 0.00 0.00 57.07 57.52 3d00 s TYR 9 Cb 0.17 -2.22 0.04 0.00 -0.40 0.00 0.00 41.96 39.56 3d00 s TYR 9 CO 0.62 0.30 1.08 -1.54 -1.57 0.00 0.00 175.55 174.44 3d00 s SER 10 N -2.36 4.83 0.37 2.29 1.04 -1.26 0.44 113.70 119.05 3d00 s SER 10 Ca 0.46 1.49 0.04 0.00 0.48 0.00 0.00 55.95 58.43 3d00 s SER 10 Cb -0.11 -2.28 0.73 0.00 0.10 0.00 0.00 66.02 64.45 3d00 s SER 10 CO 0.22 -1.78 2.02 0.22 0.98 0.00 0.00 173.24 174.90 3d00 h TYR 11 N -0.95 0.65 -0.09 5.02 3.20 -1.88 0.10 116.97 123.01 3d00 h TYR 11 Ca -0.45 0.01 -0.22 0.00 3.14 0.00 0.00 58.73 61.20 3d00 h TYR 11 Cb 1.24 -0.22 0.01 0.00 1.54 0.00 0.00 36.73 39.30 3d00 h TYR 11 CO 0.54 0.43 -0.83 0.93 -1.64 0.00 0.00 178.16 177.59 3d00 h GLU 12 N 0.69 0.63 -0.87 1.82 3.07 -1.92 0.21 114.58 118.21 3d00 h GLU 12 Ca 0.18 -0.55 -0.02 0.00 -0.50 0.00 0.00 59.36 58.47 3d00 h GLU 12 Cb -0.04 0.13 -0.04 0.00 -0.84 0.00 0.00 28.75 27.96 3d00 h GLU 12 CO -0.04 1.17 0.46 0.93 -1.40 0.00 0.00 179.01 180.13 3d00 h GLU 13 N 0.41 1.23 -0.22 2.33 5.08 -1.80 -1.82 114.58 119.79 3d00 h GLU 13 Ca -0.06 -0.16 -0.09 0.00 -1.00 0.00 0.00 59.36 58.06 3d00 h GLU 13 Cb 1.45 -0.23 -0.00 0.00 0.50 0.00 0.00 28.75 30.46 3d00 h GLU 13 CO 0.16 0.91 -0.20 -0.92 -1.00 0.00 0.00 179.01 177.96 3d00 h TYR 14 N 1.23 0.62 -0.44 4.33 3.20 -0.78 -0.89 116.97 124.24 3d00 h TYR 14 Ca 0.30 -0.18 0.07 0.00 3.14 0.00 0.00 58.73 62.06 3d00 h TYR 14 Cb 0.06 -0.13 -0.06 0.00 1.54 0.00 0.00 36.73 38.14 3d00 h TYR 14 CO 0.01 0.85 0.11 0.28 -1.64 0.00 0.00 178.16 177.77 3d00 h VAL 15 N 0.21 0.79 0.14 1.81 2.07 -0.89 0.18 116.25 120.56 3d00 h VAL 15 Ca 0.04 -0.09 0.02 0.00 0.82 0.00 0.00 66.70 67.49 3d00 h VAL 15 Cb 0.74 0.52 -0.04 0.00 -1.52 0.00 0.00 31.29 30.99 3d00 h VAL 15 CO 0.05 0.05 -0.31 -0.08 0.02 0.00 0.00 177.57 177.29 3d00 h GLU 16 N 0.25 -0.53 -0.70 1.57 4.57 -1.19 -0.92 114.58 117.63 3d00 h GLU 16 Ca 0.21 0.04 0.06 0.00 -1.18 0.00 0.00 59.36 58.49 3d00 h GLU 16 Cb 0.26 0.12 -0.06 0.00 -0.16 0.00 0.00 28.75 28.91 3d00 h GLU 16 CO -0.26 -0.35 0.40 0.87 -1.18 0.00 0.00 179.01 178.48 3d00 h LYS 17 N -0.55 0.70 -0.02 1.92 1.57 -0.84 -2.27 116.57 117.08 3d00 h LYS 17 Ca 0.03 -0.04 -0.20 0.00 -1.87 0.00 0.00 60.65 58.56 3d00 h LYS 17 Cb 0.57 -0.16 -0.00 0.00 0.08 0.00 0.00 32.23 32.71 3d00 h LYS 17 CO -0.17 0.47 -0.86 -0.84 -0.57 0.00 0.00 179.45 177.48 3d00 h ILE 18 N 0.73 1.42 -0.73 1.86 3.07 -0.74 -2.17 117.51 120.95 3d00 h ILE 18 Ca 0.32 -2.40 -0.02 0.00 1.55 0.00 0.00 64.86 64.31 3d00 h ILE 18 Cb 0.20 2.34 -0.03 0.00 -0.27 0.00 0.00 36.82 39.06 3d00 h ILE 18 CO -0.19 0.71 0.39 0.74 -1.05 0.00 0.00 178.15 178.76 3d00 h THR 19 N 0.21 1.22 -0.58 0.16 2.02 -1.08 0.15 112.91 115.01 3d00 h THR 19 Ca -0.06 -0.57 0.06 0.00 0.77 0.00 0.00 66.41 66.61 3d00 h THR 19 Cb 1.47 0.27 -0.05 0.00 -1.74 0.00 0.00 68.15 68.10 3d00 h THR 19 CO 0.14 0.25 0.29 0.00 0.37 0.00 0.00 175.52 176.57 3d00 h ALA 20 N 1.20 0.75 0.02 6.16 0.00 -1.30 0.15 119.26 126.23 3d00 h ALA 20 Ca 0.26 0.03 -0.14 0.00 0.00 0.00 0.00 54.91 55.06 3d00 h ALA 20 Cb 0.05 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 3d00 h ALA 20 CO -0.04 -0.06 -0.74 0.35 0.00 0.00 0.00 179.25 178.76 3d00 h PHE 21 N 0.54 0.06 0.00 0.00 3.57 -1.18 -3.39 116.94 116.55 3d00 h PHE 21 Ca 0.26 -0.04 -0.13 0.00 3.53 0.00 0.00 57.97 61.59 3d00 h PHE 21 Cb 0.19 -0.00 -0.02 0.00 2.79 0.00 0.00 35.95 38.91 3d00 h PHE 21 CO -0.11 1.29 -1.08 1.25 -2.23 0.00 0.00 178.31 177.44 3d00 h HIS 22 N -0.91 0.00 0.00 0.41 2.76 -0.82 -3.49 115.15 113.11 3d00 h HIS 22 Ca -0.19 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 57.98 3d00 h HIS 22 Cb 1.24 0.00 0.00 0.00 1.55 0.00 0.00 27.41 30.20 3d00 h HIS 22 CO 0.18 0.47 0.00 0.41 -1.30 0.00 0.00 177.93 177.69 3d00 n GLY 23 N 1.31 2.68 3.52 5.26 0.00 0.04 -5.03 105.19 112.98 3d00 n GLY 23 Ca -0.05 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.81 3d00 n GLY 23 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3d00 s TYR 24 N -2.72 -0.65 -1.42 1.61 5.04 -1.24 -4.94 117.35 113.04 3d00 s TYR 24 Ca 0.00 1.33 -0.14 0.00 -2.44 0.00 0.00 57.07 55.83 3d00 s TYR 24 Cb 0.00 0.31 0.06 0.00 0.35 0.00 0.00 41.96 42.69 3d00 s TYR 24 CO 0.00 -0.48 2.13 -0.35 -1.34 0.00 0.00 175.55 175.51 3d00 n PRO 25 N 1.73 3.00 -2.02 4.97 -0.04 -1.26 -4.37 135.00 137.00 3d00 n PRO 25 Ca -0.17 -2.81 -0.41 0.00 -0.04 0.00 0.00 63.50 60.07 3d00 n PRO 25 Cb 0.56 -3.25 -0.02 0.00 -0.04 0.00 0.00 33.50 30.76 3d00 n PRO 25 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3d00 s ALA 26 N 2.84 3.55 0.28 0.55 0.00 -1.26 -4.86 121.76 122.87 3d00 s ALA 26 Ca 0.46 1.34 0.01 0.00 0.00 0.00 0.00 51.96 53.78 3d00 s ALA 26 Cb 0.12 -3.53 0.68 0.00 0.00 0.00 0.00 23.12 20.39 3d00 s ALA 26 CO -0.06 -0.75 1.65 -1.35 0.00 0.00 0.00 175.76 175.24 3d00 h PRO 27 N 3.85 0.20 -1.01 0.00 0.11 -1.99 -1.96 132.00 131.20 3d00 h PRO 27 Ca -0.48 -0.01 0.05 0.00 0.11 0.00 0.00 66.00 65.67 3d00 h PRO 27 Cb 1.23 -0.05 -0.06 0.00 0.11 0.00 0.00 31.00 32.23 3d00 h PRO 27 CO 0.69 0.13 0.66 0.78 -0.21 0.00 0.00 178.00 180.05 3d00 h GLY 28 N 0.21 1.50 1.79 -0.55 0.00 -1.96 0.13 103.07 104.20 3d00 h GLY 28 Ca 0.53 -0.49 -0.23 0.00 0.00 0.00 0.00 47.33 47.14 3d00 h GLY 28 CO -0.65 0.39 -1.06 -0.39 0.00 0.00 0.00 176.54 174.83 3d00 h VAL 29 N 1.23 1.57 0.34 4.60 -1.51 -1.62 0.11 116.25 120.97 3d00 h VAL 29 Ca 0.42 -3.04 -0.02 0.00 -1.23 0.00 0.00 66.70 62.83 3d00 h VAL 29 Cb 0.08 2.77 0.00 0.00 -2.13 0.00 0.00 31.29 32.02 3d00 h VAL 29 CO -0.15 0.88 -0.17 -0.07 -1.23 0.00 0.00 177.57 176.84 3d00 h LEU 30 N 0.06 -0.39 -0.55 4.19 3.38 -1.05 -1.19 115.31 119.75 3d00 h LEU 30 Ca -0.07 -0.08 0.02 0.00 0.09 0.00 0.00 57.88 57.85 3d00 h LEU 30 Cb 1.77 0.10 -0.03 0.00 0.09 0.00 0.00 40.66 42.58 3d00 h LEU 30 CO 0.16 -0.16 0.34 0.40 0.09 0.00 0.00 178.44 179.27 3d00 h ILE 31 N -0.61 1.07 -0.97 1.22 2.04 -0.78 -1.66 117.51 117.81 3d00 h ILE 31 Ca -0.05 -0.23 0.24 0.00 1.00 0.00 0.00 64.86 65.83 3d00 h ILE 31 Cb 0.45 0.34 -0.13 0.00 -0.74 0.00 0.00 36.82 36.74 3d00 h ILE 31 CO 0.08 0.12 0.54 1.23 0.00 0.00 0.00 178.15 180.12 3d00 h GLY 32 N 0.67 1.82 0.74 5.37 0.00 -0.67 -0.14 103.07 110.87 3d00 h GLY 32 Ca 0.22 -0.27 0.05 0.00 0.00 0.00 0.00 47.33 47.33 3d00 h GLY 32 CO -0.09 -0.27 0.48 -1.33 0.00 0.00 0.00 176.54 175.34 3d00 h GLY 33 N 0.52 1.17 -1.70 4.60 0.00 -0.22 -1.05 103.07 106.38 3d00 h GLY 33 Ca 0.63 -0.35 0.00 0.00 0.00 0.00 0.00 47.33 47.61 3d00 h GLY 33 CO -0.50 0.25 0.00 0.69 0.00 0.00 0.00 176.54 176.98 3d00 n PHE 34 N -4.66 0.00 0.00 5.60 3.72 -0.07 -1.42 117.46 120.63 3d00 n PHE 34 Ca 0.10 -0.13 0.00 0.00 -0.05 0.00 0.00 57.45 57.37 3d00 n PHE 34 Cb 0.16 -0.12 0.00 0.00 -0.94 0.00 0.00 39.48 38.57 3d00 n PHE 34 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 176.76 176.99 3d00 n VAL 36 N 0.67 0.00 -0.07 -4.37 0.31 -0.40 -1.66 118.33 112.80 3d00 n VAL 36 Ca 0.00 0.00 -0.08 0.00 -0.01 0.00 0.00 64.34 64.25 3d00 n VAL 36 Cb 0.16 0.00 -0.01 0.00 -0.91 0.00 0.00 33.84 33.08 3d00 n VAL 36 CO 0.00 0.00 0.00 -0.78 -1.32 0.00 0.00 176.83 174.73 3d00 h ASP 37 N 0.00 0.07 -0.65 4.52 3.58 -1.49 0.18 116.42 122.64 3d00 h ASP 37 Ca 0.00 0.03 -0.04 0.00 0.42 0.00 0.00 57.03 57.44 3d00 h ASP 37 Cb 0.00 0.03 -0.03 0.00 1.72 0.00 0.00 39.33 41.05 3d00 h ASP 37 CO 0.00 0.08 0.23 0.25 -2.88 0.00 0.00 179.24 176.92 3d00 h LEU 38 N 0.20 0.91 0.30 2.28 5.85 -1.57 -2.10 115.31 121.18 3d00 h LEU 38 Ca 0.12 -0.19 -0.01 0.00 0.84 0.00 0.00 57.88 58.64 3d00 h LEU 38 Cb 0.10 -0.24 -0.00 0.00 0.37 0.00 0.00 40.66 40.89 3d00 h LEU 38 CO -0.14 0.86 -0.17 0.00 -0.34 0.00 0.00 178.44 178.65 3d00 h ALA 39 N 1.09 -0.43 -0.97 1.25 0.00 -1.78 -2.64 119.26 115.78 3d00 h ALA 39 Ca 0.21 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 55.05 3d00 h ALA 39 Cb 0.25 0.20 -0.05 0.00 0.00 0.00 0.00 17.79 18.19 3d00 h ALA 39 CO -0.01 -0.75 0.64 0.28 0.00 0.00 0.00 179.25 179.41 3d00 h VAL 40 N -0.44 1.23 0.00 0.00 2.07 -0.92 -1.17 116.25 117.03 3d00 h VAL 40 Ca -0.03 -0.45 0.00 0.00 0.82 0.00 0.00 66.70 67.04 3d00 h VAL 40 Cb 0.36 -0.18 0.00 0.00 -1.52 0.00 0.00 31.29 29.95 3d00 h VAL 40 CO 0.04 0.24 0.00 0.29 0.02 0.00 0.00 177.57 178.16 3d00 n LYS 41 N -4.40 0.14 -0.26 1.57 5.02 -0.79 -2.44 118.16 117.00 3d00 n LYS 41 Ca 0.12 0.49 0.07 0.00 -2.02 0.00 0.00 58.31 56.97 3d00 n LYS 41 Cb 0.03 -1.83 0.18 0.00 -0.02 0.00 0.00 35.03 33.39 3d00 n LYS 41 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3d00 n ASN 42 N -2.11 3.14 -4.87 4.39 3.02 -0.45 -4.97 115.26 113.41 3d00 n ASN 42 Ca 0.01 -2.68 -0.31 0.00 -0.03 0.00 0.00 54.58 51.57 3d00 n ASN 42 Cb 0.13 -0.39 -0.05 0.00 -0.61 0.00 0.00 39.78 38.87 3d00 n ASN 42 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 3d00 s LEU 43 N -2.20 4.16 0.43 3.41 1.43 -1.02 -4.88 118.68 120.01 3d00 s LEU 43 Ca 0.31 0.17 -0.23 0.00 -1.03 0.00 0.00 54.13 53.34 3d00 s LEU 43 Cb 0.24 -2.79 -0.11 0.00 0.03 0.00 0.00 46.19 43.56 3d00 s LEU 43 CO 0.08 0.17 0.83 -2.65 0.23 0.00 0.00 176.35 175.01 3d00 n PRO 44 N 0.31 1.01 -1.92 1.29 -0.02 -1.26 -4.87 135.00 129.54 3d00 n PRO 44 Ca -0.06 0.37 -0.42 0.00 -2.02 0.00 0.00 63.50 61.36 3d00 n PRO 44 Cb 0.51 -1.84 -0.03 0.00 -0.02 0.00 0.00 33.50 32.12 3d00 n PRO 44 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 3d00 s GLU 45 N -1.89 4.20 0.00 -0.52 2.12 -1.26 -3.10 118.70 118.25 3d00 s GLU 45 Ca 0.64 2.34 0.00 0.00 0.36 0.00 0.00 54.97 58.31 3d00 s GLU 45 Cb -0.57 -3.58 0.00 0.00 0.26 0.00 0.00 34.13 30.24 3d00 s GLU 45 CO 0.56 -0.73 0.00 0.41 -0.54 0.00 0.00 175.26 174.96 3d00 n GLY 46 N 3.99 0.69 3.87 -1.50 0.00 -1.26 -5.03 105.19 105.94 3d00 n GLY 46 Ca 0.16 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.87 3d00 n GLY 46 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3d00 s ILE 47 N -2.63 4.71 -0.28 -0.61 -4.36 -1.18 -5.04 121.20 111.81 3d00 s ILE 47 Ca 0.00 0.87 -0.17 0.00 -0.26 0.00 0.00 60.65 61.08 3d00 s ILE 47 Cb 0.00 -3.86 -0.03 0.00 1.25 0.00 0.00 42.46 39.82 3d00 s ILE 47 CO 0.00 -1.11 0.48 -1.48 0.24 0.00 0.00 174.94 173.07 3d00 s LEU 48 N -5.10 4.10 0.06 0.37 0.05 -1.26 -5.07 118.68 111.84 3d00 s LEU 48 Ca 0.55 0.37 0.08 0.00 0.05 0.00 0.00 54.13 55.18 3d00 s LEU 48 Cb -0.11 -2.59 -0.03 0.00 -2.05 0.00 0.00 46.19 41.41 3d00 s LEU 48 CO 0.52 -0.30 -0.22 -0.72 -0.55 0.00 0.00 176.35 175.08 3d00 s TYR 49 N 2.27 1.93 0.45 3.48 -0.85 -1.26 -2.12 117.35 121.26 3d00 s TYR 49 Ca 0.19 -0.39 0.06 0.00 -0.52 0.00 0.00 57.07 56.41 3d00 s TYR 49 Cb -0.16 -1.12 0.02 0.00 0.38 0.00 0.00 41.96 41.08 3d00 s TYR 49 CO 0.10 0.14 0.63 -0.51 -1.52 0.00 0.00 175.55 174.39 3d00 s ASP 50 N -1.41 5.57 0.08 -0.18 1.11 0.20 -4.85 116.67 117.18 3d00 s ASP 50 Ca 0.08 -0.27 0.06 0.00 0.18 0.00 0.00 52.55 52.60 3d00 s ASP 50 Cb -0.09 -0.77 -0.03 0.00 1.07 0.00 0.00 42.92 43.10 3d00 s ASP 50 CO 0.03 -0.85 -0.17 0.00 1.18 0.00 0.00 175.17 175.35 3d00 s ALA 51 N -2.47 1.42 -0.08 5.23 0.00 -0.09 -1.20 121.76 124.57 3d00 s ALA 51 Ca 0.55 -1.07 0.01 0.00 0.00 0.00 0.00 51.96 51.44 3d00 s ALA 51 Cb -0.10 -0.17 0.02 0.00 0.00 0.00 0.00 23.12 22.87 3d00 s ALA 51 CO 0.35 0.25 -0.08 0.42 0.00 0.00 0.00 175.76 176.69 3d00 s ILE 52 N -1.18 0.94 -0.12 0.00 1.01 0.76 -1.72 121.20 120.89 3d00 s ILE 52 Ca 0.02 -0.31 -0.04 0.00 0.00 0.00 0.00 60.65 60.31 3d00 s ILE 52 Cb -0.10 -0.92 -0.04 0.00 0.01 0.00 0.00 42.46 41.42 3d00 s ILE 52 CO 0.03 0.33 0.04 0.00 0.00 0.00 0.00 174.94 175.34 3d00 n GLU 54 N 2.59 2.55 -4.00 0.00 1.02 -0.73 -0.74 120.64 121.32 3d00 n GLU 54 Ca -0.18 -2.39 -0.09 0.00 -0.02 0.00 0.00 57.16 54.48 3d00 n GLU 54 Cb 0.53 -1.53 -0.11 0.00 -0.02 0.00 0.00 31.44 30.32 3d00 n GLU 54 CO 0.00 0.00 0.00 -0.08 1.18 0.00 0.00 177.13 178.23 3d00 s THR 55 N -1.21 0.17 -0.70 2.62 -1.32 -1.10 -1.94 115.64 112.17 3d00 s THR 55 Ca 0.44 -1.05 0.25 0.00 -1.21 0.00 0.00 61.69 60.12 3d00 s THR 55 Cb 0.24 -0.46 0.17 0.00 -1.51 0.00 0.00 72.50 70.93 3d00 s THR 55 CO 0.31 -0.56 1.55 -2.11 -2.21 0.00 0.00 174.62 171.61 3d00 n ARG 56 N 1.38 0.27 -2.87 7.08 1.85 -1.26 -4.47 116.66 118.64 3d00 n ARG 56 Ca -0.23 0.14 -0.42 0.00 -1.00 0.00 0.00 57.85 56.35 3d00 n ARG 56 Cb 0.56 -1.74 -0.04 0.00 -1.05 0.00 0.00 32.46 30.19 3d00 n ARG 56 CO 0.00 0.00 0.00 0.99 -0.01 0.00 0.00 177.63 178.61 3d00 s THR 57 N -3.13 4.71 0.00 8.89 2.01 -1.26 -4.54 115.64 122.33 3d00 s THR 57 Ca 0.09 1.30 0.00 0.00 0.31 0.00 0.00 61.69 63.38 3d00 s THR 57 Cb 0.13 -4.22 0.00 0.00 0.01 0.00 0.00 72.50 68.42 3d00 s THR 57 CO 0.66 -0.33 0.00 0.00 -0.69 0.00 0.00 174.62 174.26 3d00 h LEU 59 N 0.00 0.96 -1.35 0.00 5.85 -1.82 -1.10 115.31 117.86 3d00 h LEU 59 Ca 0.00 0.02 0.15 0.00 0.84 0.00 0.00 57.88 58.90 3d00 h LEU 59 Cb 0.00 -0.18 -0.07 0.00 0.37 0.00 0.00 40.66 40.79 3d00 h LEU 59 CO 0.00 0.58 0.57 -0.65 -0.34 0.00 0.00 178.44 178.59 3d00 h PRO 60 N 1.07 0.60 0.00 5.25 0.11 -1.79 -2.35 132.00 134.89 3d00 h PRO 60 Ca 0.45 -0.04 -0.08 0.00 0.11 0.00 0.00 66.00 66.44 3d00 h PRO 60 Cb 0.31 -0.14 -0.01 0.00 0.11 0.00 0.00 31.00 31.27 3d00 h PRO 60 CO -0.20 0.40 -0.39 -0.44 -0.21 0.00 0.00 178.00 177.16 3d00 h ASP 61 N 0.62 0.00 -0.14 -2.05 3.32 -1.56 -0.39 116.42 116.22 3d00 h ASP 61 Ca 0.44 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.48 3d00 h ASP 61 Cb 0.79 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.33 3d00 h ASP 61 CO -0.19 0.39 0.05 0.00 -1.72 0.00 0.00 179.24 177.76 3d00 h ALA 62 N 1.61 0.18 0.50 3.45 0.00 -1.39 -0.29 119.26 123.32 3d00 h ALA 62 Ca -0.00 -0.11 -0.02 0.00 0.00 0.00 0.00 54.91 54.77 3d00 h ALA 62 Cb 0.78 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.52 3d00 h ALA 62 CO 0.05 -0.22 -0.25 0.28 0.00 0.00 0.00 179.25 179.11 3d00 h VAL 63 N 0.06 0.49 -0.89 0.00 2.07 -1.32 -2.01 116.25 114.65 3d00 h VAL 63 Ca 0.05 0.00 0.07 0.00 0.82 0.00 0.00 66.70 67.64 3d00 h VAL 63 Cb 0.19 0.49 -0.06 0.00 -1.52 0.00 0.00 31.29 30.39 3d00 h VAL 63 CO -0.00 0.00 0.58 1.56 0.02 0.00 0.00 177.57 179.72 3d00 h GLN 64 N -0.68 0.95 0.00 1.57 4.20 -1.03 -0.57 115.11 119.54 3d00 h GLN 64 Ca -0.07 -0.06 -0.11 0.00 0.06 0.00 0.00 58.65 58.48 3d00 h GLN 64 Cb 0.53 -0.21 -0.02 0.00 0.30 0.00 0.00 27.48 28.08 3d00 h GLN 64 CO 0.10 0.63 -0.50 -0.07 -0.67 0.00 0.00 178.83 178.32 3d00 h LEU 65 N 0.97 0.00 0.00 1.46 3.38 -0.96 -3.37 115.31 116.79 3d00 h LEU 65 Ca 0.39 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.36 3d00 h LEU 65 Cb 0.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.00 3d00 h LEU 65 CO -0.15 0.50 -1.37 0.18 0.09 0.00 0.00 178.44 177.69 3d00 n LEU 66 N -3.62 0.06 -4.42 1.67 4.77 -0.76 -5.04 117.00 109.65 3d00 n LEU 66 Ca -0.00 -0.06 -0.21 0.00 -0.03 0.00 0.00 56.01 55.70 3d00 n LEU 66 Cb 0.58 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.56 3d00 n LEU 66 CO 0.39 0.02 -0.35 0.42 -1.33 0.00 0.00 177.39 176.54 3d00 s THR 67 N -2.66 1.51 -1.28 -5.08 -4.23 -0.29 -5.03 115.64 98.58 3d00 s THR 67 Ca -0.03 -2.09 0.20 0.00 -1.18 0.00 0.00 61.69 58.59 3d00 s THR 67 Cb 0.07 -2.49 0.29 0.00 1.34 0.00 0.00 72.50 71.70 3d00 s THR 67 CO 0.45 -0.26 1.64 -2.65 -0.54 0.00 0.00 174.62 173.26 3d00 n PRO 68 N -0.58 0.19 -2.70 3.99 -0.02 -1.26 -4.71 135.00 129.90 3d00 n PRO 68 Ca -0.05 0.12 -0.43 0.00 -2.02 0.00 0.00 63.50 61.12 3d00 n PRO 68 Cb 0.64 -1.50 -0.02 0.00 -0.02 0.00 0.00 33.50 32.59 3d00 n PRO 68 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 3d00 s THR 70 N 2.52 1.68 0.16 0.00 -4.23 -1.26 -3.87 115.64 110.64 3d00 s THR 70 Ca 0.46 -2.18 -0.15 0.00 -1.18 0.00 0.00 61.69 58.63 3d00 s THR 70 Cb -0.17 -2.17 0.03 0.00 1.34 0.00 0.00 72.50 71.53 3d00 s THR 70 CO 0.12 -0.50 1.80 0.15 -0.54 0.00 0.00 174.62 175.66 3d00 h PHE 71 N 2.47 0.59 0.00 3.99 3.57 -1.95 -2.62 116.94 122.99 3d00 h PHE 71 Ca -0.39 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.10 3d00 h PHE 71 Cb 1.22 -0.19 -0.00 0.00 2.79 0.00 0.00 35.95 39.77 3d00 h PHE 71 CO 0.70 0.40 -0.10 0.78 -2.23 0.00 0.00 178.31 177.86 3d00 h GLY 72 N 0.60 0.00 -0.89 2.40 0.00 -1.96 -3.04 103.07 100.18 3d00 h GLY 72 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.49 3d00 h GLY 72 CO -0.03 0.00 -0.23 1.16 0.00 0.00 0.00 176.54 177.44 3d00 n ASN 73 N -3.32 1.99 0.00 0.19 0.23 -1.18 -4.96 115.26 108.21 3d00 n ASN 73 Ca -0.01 -1.51 0.00 0.00 -0.53 0.00 0.00 54.58 52.54 3d00 n ASN 73 Cb 0.30 0.20 0.00 0.00 -2.08 0.00 0.00 39.78 38.20 3d00 n ASN 73 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 3d00 n GLY 74 N 1.34 0.85 0.19 4.83 0.00 -1.11 -4.86 105.19 106.43 3d00 n GLY 74 Ca 0.13 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.22 3d00 n GLY 74 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 3d00 h TRP 75 N 0.00 0.00 -3.56 1.61 6.55 -1.84 -3.41 115.95 115.30 3d00 h TRP 75 Ca 0.00 0.00 -0.61 0.00 0.95 0.00 0.00 58.89 59.23 3d00 h TRP 75 Cb 0.01 0.00 -0.14 0.00 -0.86 0.00 0.00 29.16 28.18 3d00 h TRP 75 CO 0.01 0.25 -0.39 -1.17 -1.05 0.00 0.00 178.44 176.09 3d00 s LEU 76 N -6.38 4.12 -0.10 -4.49 2.96 -1.01 -0.92 118.68 112.87 3d00 s LEU 76 Ca 0.05 0.25 -0.02 0.00 -0.22 0.00 0.00 54.13 54.19 3d00 s LEU 76 Cb 0.07 -2.26 -0.03 0.00 0.50 0.00 0.00 46.19 44.47 3d00 s LEU 76 CO 0.69 0.00 -0.02 -0.89 -1.32 0.00 0.00 176.35 174.81 3d00 s THR 77 N 1.21 4.08 -0.22 3.68 2.01 -0.70 -4.43 115.64 121.27 3d00 s THR 77 Ca 0.12 -0.32 -0.02 0.00 0.31 0.00 0.00 61.69 61.77 3d00 s THR 77 Cb -0.14 -2.72 0.01 0.00 0.01 0.00 0.00 72.50 69.66 3d00 s THR 77 CO 0.06 0.58 -0.09 -0.69 -0.69 0.00 0.00 174.62 173.79 3d00 s VAL 78 N -0.60 2.88 -0.40 3.82 1.01 -1.26 -1.13 120.40 124.71 3d00 s VAL 78 Ca 0.10 -0.78 -0.13 0.00 0.00 0.00 0.00 61.98 61.17 3d00 s VAL 78 Cb -0.12 -2.34 0.03 0.00 0.00 0.00 0.00 36.38 33.95 3d00 s VAL 78 CO 0.02 0.38 0.27 -0.76 0.00 0.00 0.00 175.10 175.01 3d00 s LEU 79 N 1.38 5.01 0.01 3.92 1.43 0.08 -4.97 118.68 125.54 3d00 s LEU 79 Ca 0.04 -1.02 -0.30 0.00 -1.03 0.00 0.00 54.13 51.81 3d00 s LEU 79 Cb -0.15 -2.10 -0.04 0.00 0.03 0.00 0.00 46.19 43.93 3d00 s LEU 79 CO -0.06 -0.45 1.17 -2.16 0.23 0.00 0.00 176.35 175.08 3d00 s PRO 80 N 1.61 4.42 0.00 1.29 0.04 -1.26 -3.32 135.00 137.78 3d00 s PRO 80 Ca 0.04 1.69 0.00 0.00 0.04 0.00 0.00 61.00 62.76 3d00 s PRO 80 Cb -0.20 -3.44 0.00 0.00 0.04 0.00 0.00 34.50 30.91 3d00 s PRO 80 CO 0.08 -0.30 0.38 0.41 0.04 0.00 0.00 177.00 177.61 3d00 n GLY 82 N 3.23 0.56 3.57 0.56 0.00 -0.82 -4.96 105.19 107.33 3d00 n GLY 82 Ca 0.09 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.76 3d00 n GLY 82 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3d00 s LEU 83 N 0.00 3.70 -1.29 0.99 1.43 -0.88 -4.94 118.68 117.68 3d00 s LEU 83 Ca 0.00 -0.01 -0.17 0.00 -1.03 0.00 0.00 54.13 52.92 3d00 s LEU 83 Cb 0.00 -1.95 0.09 0.00 0.03 0.00 0.00 46.19 44.36 3d00 s LEU 83 CO 0.00 0.10 1.70 0.33 0.23 0.00 0.00 176.35 178.71 3d00 n PHE 84 N 4.00 4.68 -3.75 0.29 7.35 -1.26 -2.69 117.46 126.08 3d00 n PHE 84 Ca -0.16 -2.94 -0.13 0.00 -0.76 0.00 0.00 57.45 53.45 3d00 n PHE 84 Cb 0.52 -2.55 -0.09 0.00 0.35 0.00 0.00 39.48 37.71 3d00 n PHE 84 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 3d00 s ALA 85 N 3.66 -0.86 0.01 3.13 0.00 -1.26 -3.75 121.76 122.69 3d00 s ALA 85 Ca 0.52 0.55 0.03 0.00 0.00 0.00 0.00 51.96 53.05 3d00 s ALA 85 Cb 0.03 -0.10 -0.01 0.00 0.00 0.00 0.00 23.12 23.04 3d00 s ALA 85 CO 0.06 -0.24 -0.09 0.54 0.00 0.00 0.00 175.76 176.03 3d00 s VAL 86 N -0.93 0.70 -0.00 0.00 0.11 -0.50 -1.77 120.40 118.01 3d00 s VAL 86 Ca -0.10 -0.62 0.08 0.00 -2.93 0.00 0.00 61.98 58.41 3d00 s VAL 86 Cb -0.04 -0.63 -0.02 0.00 -1.53 0.00 0.00 36.38 34.15 3d00 s VAL 86 CO 0.04 0.03 -0.24 -0.44 -3.33 0.00 0.00 175.10 171.16 3d00 s SER 87 N -0.66 3.30 -0.11 3.54 0.01 0.23 -0.41 113.70 119.61 3d00 s SER 87 Ca 0.00 -0.46 0.01 0.00 1.31 0.00 0.00 55.95 56.81 3d00 s SER 87 Cb -0.05 -0.43 -0.02 0.00 0.21 0.00 0.00 66.02 65.73 3d00 s SER 87 CO 0.00 0.30 -0.15 -0.76 0.41 0.00 0.00 173.24 173.05 3d00 s LEU 88 N -0.88 2.64 0.03 2.44 1.43 -0.77 -0.17 118.68 123.40 3d00 s LEU 88 Ca 0.11 -0.33 0.01 0.00 -1.03 0.00 0.00 54.13 52.88 3d00 s LEU 88 Cb -0.10 -1.58 -0.02 0.00 0.03 0.00 0.00 46.19 44.52 3d00 s LEU 88 CO 0.01 0.20 -0.04 -0.72 0.23 0.00 0.00 176.35 176.02 3d00 s TYR 89 N 0.15 0.42 0.02 0.29 1.13 -0.34 -1.34 117.35 117.69 3d00 s TYR 89 Ca -0.08 -0.60 -0.30 0.00 -1.41 0.00 0.00 57.07 54.68 3d00 s TYR 89 Cb -0.15 -0.28 -0.08 0.00 -1.10 0.00 0.00 41.96 40.35 3d00 s TYR 89 CO 0.05 -0.18 1.80 0.34 -2.51 0.00 0.00 175.55 175.05 3d00 s ASP 90 N -1.72 6.54 0.54 -0.18 -1.08 0.46 -0.63 116.67 120.60 3d00 s ASP 90 Ca -0.11 2.51 0.24 0.00 -0.52 0.00 0.00 52.55 54.67 3d00 s ASP 90 Cb -0.07 -2.54 1.50 0.00 -1.46 0.00 0.00 42.92 40.35 3d00 s ASP 90 CO -0.02 -0.98 2.16 0.50 0.52 0.00 0.00 175.17 177.35 3d00 h LYS 91 N 9.69 0.00 0.16 4.34 3.64 -1.76 0.40 116.57 133.04 3d00 h LYS 91 Ca -0.45 0.00 -0.33 0.00 -1.27 0.00 0.00 60.65 58.60 3d00 h LYS 91 Cb 1.21 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.04 3d00 h LYS 91 CO 0.94 0.05 -1.62 0.74 -2.27 0.00 0.00 179.45 177.29 3d00 h PHE 92 N 0.00 0.62 0.00 1.91 0.04 -1.90 -3.41 116.94 114.20 3d00 h PHE 92 Ca -0.00 -0.45 -0.13 0.00 2.80 0.00 0.00 57.97 60.19 3d00 h PHE 92 Cb 0.11 -0.02 -0.02 0.00 2.20 0.00 0.00 35.95 38.21 3d00 h PHE 92 CO 0.00 1.52 -1.65 0.25 -0.60 0.00 0.00 178.31 177.83 3d00 n THR 93 N -3.54 0.50 -0.99 -1.55 -2.24 -1.13 -5.01 114.28 100.33 3d00 n THR 93 Ca -0.20 -0.38 0.00 0.00 -2.27 0.00 0.00 64.05 61.20 3d00 n THR 93 Cb 1.06 -0.43 0.00 0.00 -2.10 0.00 0.00 70.33 68.86 3d00 n THR 93 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3d00 n GLY 94 N 2.21 0.93 3.72 3.38 0.00 0.14 -4.85 105.19 110.72 3d00 n GLY 94 Ca -0.12 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.48 3d00 n GLY 94 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3d00 s GLU 95 N -0.01 4.60 0.00 1.61 8.01 -1.26 -0.78 118.70 130.87 3d00 s GLU 95 Ca 0.00 1.51 0.00 0.00 0.01 0.00 0.00 54.97 56.49 3d00 s GLU 95 Cb 0.00 -3.39 0.00 0.00 -4.31 0.00 0.00 34.13 26.43 3d00 s GLU 95 CO 0.00 0.04 0.00 0.41 0.01 0.00 0.00 175.26 175.72 3d00 n GLY 96 N 2.59 2.95 2.97 -1.39 0.00 0.21 -0.40 105.19 112.11 3d00 n GLY 96 Ca 0.05 -0.80 -0.18 0.00 0.00 0.00 0.00 46.02 45.08 3d00 n GLY 96 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3d00 s VAL 97 N -2.96 0.56 -0.10 1.61 -7.23 -0.45 -1.12 120.40 110.72 3d00 s VAL 97 Ca 0.00 -0.26 -0.01 0.00 -1.81 0.00 0.00 61.98 59.90 3d00 s VAL 97 Cb 0.00 -0.50 -0.03 0.00 0.56 0.00 0.00 36.38 36.42 3d00 s VAL 97 CO 0.00 0.18 -0.05 -0.60 -0.31 0.00 0.00 175.10 174.32 3d00 s ARG 98 N 0.09 3.05 -0.04 4.82 3.52 0.15 -1.85 118.95 128.69 3d00 s ARG 98 Ca -0.01 -0.52 0.05 0.00 -0.13 0.00 0.00 55.73 55.12 3d00 s ARG 98 Cb -0.06 -2.71 -0.01 0.00 -1.56 0.00 0.00 34.95 30.61 3d00 s ARG 98 CO -0.00 0.55 -0.19 0.08 -0.81 0.00 0.00 175.30 174.94 3d00 s VAL 99 N -0.50 1.54 0.25 7.11 1.01 0.45 -0.60 120.40 129.65 3d00 s VAL 99 Ca 0.08 -0.79 -0.10 0.00 0.00 0.00 0.00 61.98 61.18 3d00 s VAL 99 Cb -0.12 -1.31 -0.01 0.00 0.00 0.00 0.00 36.38 34.94 3d00 s VAL 99 CO 0.02 0.44 0.42 0.72 0.00 0.00 0.00 175.10 176.70 3d00 s PHE 100 N -0.06 0.58 0.11 5.22 -0.71 -0.72 -1.41 117.98 120.99 3d00 s PHE 100 Ca -0.02 -0.90 -0.26 0.00 -1.04 0.00 0.00 56.93 54.71 3d00 s PHE 100 Cb -0.11 0.03 -0.07 0.00 -1.21 0.00 0.00 43.02 41.66 3d00 s PHE 100 CO 0.02 -0.95 0.79 -0.51 -1.34 0.00 0.00 175.22 173.23 3d00 s LEU 101 N -3.07 4.52 -0.46 -1.99 1.02 -1.25 -0.38 118.68 117.08 3d00 s LEU 101 Ca 0.26 1.57 -0.04 0.00 0.02 0.00 0.00 54.13 55.94 3d00 s LEU 101 Cb 0.01 -3.29 0.12 0.00 0.02 0.00 0.00 46.19 43.05 3d00 s LEU 101 CO 0.11 0.10 0.28 -0.62 0.02 0.00 0.00 176.35 176.24 3d00 s ASP 102 N -0.56 5.37 0.52 2.29 2.15 0.37 -4.82 116.67 122.00 3d00 s ASP 102 Ca 0.38 -2.15 0.23 0.00 0.43 0.00 0.00 52.55 51.44 3d00 s ASP 102 Cb -0.22 -1.88 1.42 0.00 -0.30 0.00 0.00 42.92 41.94 3d00 s ASP 102 CO 0.25 -0.55 2.12 0.58 -0.17 0.00 0.00 175.17 177.40 3d00 h VAL 103 N 6.12 0.77 -0.80 1.11 2.07 -1.96 -0.56 116.25 123.00 3d00 h VAL 103 Ca -0.13 -0.30 0.21 0.00 0.82 0.00 0.00 66.70 67.30 3d00 h VAL 103 Cb 1.04 1.18 -0.04 0.00 -1.52 0.00 0.00 31.29 31.95 3d00 h VAL 103 CO 0.74 0.08 0.56 -0.33 0.02 0.00 0.00 177.57 178.63 3d00 h GLU 104 N 0.00 0.12 -3.93 1.57 5.08 -1.95 -3.40 114.58 112.08 3d00 h GLU 104 Ca -0.00 -0.01 -0.74 0.00 -1.00 0.00 0.00 59.36 57.61 3d00 h GLU 104 Cb 0.17 -0.03 -0.14 0.00 0.50 0.00 0.00 28.75 29.25 3d00 h GLU 104 CO 0.01 0.08 2.00 1.63 -1.00 0.00 0.00 179.01 181.73 3d00 n LYS 105 N -4.37 3.47 0.00 2.33 4.01 -0.22 -5.03 118.16 118.36 3d00 n LYS 105 Ca 0.16 -3.50 0.00 0.00 -0.51 0.00 0.00 58.31 54.47 3d00 n LYS 105 Cb 0.78 -3.01 0.00 0.00 -0.51 0.00 0.00 35.03 32.29 3d00 n LYS 105 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 3d00 n GLY 107 N 3.32 2.84 0.00 0.72 0.00 -1.26 -4.75 105.19 106.06 3d00 n GLY 107 Ca 0.41 -0.83 0.00 0.00 0.00 0.00 0.00 46.02 45.59 3d00 n GLY 107 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3d00 n PRO 108 N 0.00 0.00 -3.43 1.61 -0.02 -1.26 -4.07 135.00 127.83 3d00 n PRO 108 Ca 0.00 0.09 -0.26 0.00 -2.02 0.00 0.00 63.50 61.30 3d00 n PRO 108 Cb 0.00 -1.50 -0.09 0.00 -0.02 0.00 0.00 33.50 31.88 3d00 n PRO 108 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 3d00 n TRP 109 N -1.07 0.46 0.15 6.00 7.02 -1.26 -4.96 117.44 123.78 3d00 n TRP 109 Ca 0.00 -3.64 0.01 0.00 -1.02 0.00 0.00 57.50 52.85 3d00 n TRP 109 Cb 0.00 -0.14 0.19 0.00 -2.42 0.00 0.00 31.31 28.94 3d00 n TRP 109 CO 0.00 0.00 0.00 1.96 -2.02 0.00 0.00 177.69 177.63 3d00 h GLN 110 N 5.00 0.00 -0.20 -0.99 1.08 -1.99 -1.92 115.11 116.09 3d00 h GLN 110 Ca 0.19 0.00 -0.06 0.00 -1.45 0.00 0.00 58.65 57.33 3d00 h GLN 110 Cb 0.85 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.27 3d00 h GLN 110 CO 0.51 0.55 -0.10 0.93 -0.95 0.00 0.00 178.83 179.77 3d00 h GLU 111 N 0.00 0.42 -0.84 1.46 4.39 -1.95 0.24 114.58 118.31 3d00 h GLU 111 Ca -0.01 -0.19 0.04 0.00 0.34 0.00 0.00 59.36 59.54 3d00 h GLU 111 Cb 1.12 -0.01 -0.05 0.00 -0.10 0.00 0.00 28.75 29.71 3d00 h GLU 111 CO 0.07 0.72 0.54 0.82 -1.16 0.00 0.00 179.01 179.99 3d00 h ILE 112 N 0.12 1.12 -0.58 3.13 2.04 -1.86 -1.52 117.51 119.96 3d00 h ILE 112 Ca 0.04 -0.36 -0.08 0.00 1.00 0.00 0.00 64.86 65.47 3d00 h ILE 112 Cb 0.59 -0.00 -0.02 0.00 -0.74 0.00 0.00 36.82 36.65 3d00 h ILE 112 CO 0.03 0.19 0.04 -0.09 0.00 0.00 0.00 178.15 178.32 3d00 h ARG 113 N 1.04 1.00 -0.64 2.37 2.43 -1.05 0.24 114.38 119.77 3d00 h ARG 113 Ca 0.34 -0.30 -0.09 0.00 -0.81 0.00 0.00 59.98 59.12 3d00 h ARG 113 Cb 0.03 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 29.45 3d00 h ARG 113 CO -0.12 0.97 0.06 -0.91 -1.51 0.00 0.00 179.97 178.46 3d00 h ASN 114 N 0.90 1.05 0.16 -3.80 2.35 -0.28 0.20 115.58 116.16 3d00 h ASN 114 Ca 0.17 -0.27 -0.01 0.00 -0.55 0.00 0.00 56.30 55.64 3d00 h ASN 114 Cb 0.49 -0.28 0.00 0.00 0.05 0.00 0.00 38.32 38.59 3d00 h ASN 114 CO 0.02 1.06 -0.08 -0.25 -1.65 0.00 0.00 177.43 176.53 3d00 h TRP 115 N 1.00 -0.20 -0.68 1.19 7.01 -1.01 0.58 115.95 123.83 3d00 h TRP 115 Ca 0.19 -0.00 -0.01 0.00 2.11 0.00 0.00 58.89 61.18 3d00 h TRP 115 Cb 0.49 0.07 -0.03 0.00 -2.10 0.00 0.00 29.16 27.58 3d00 h TRP 115 CO 0.03 0.00 0.39 0.35 -2.79 0.00 0.00 178.44 176.43 3d00 h PHE 116 N -0.38 0.92 -0.22 2.65 3.57 -0.24 -2.41 116.94 120.83 3d00 h PHE 116 Ca -0.02 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.47 3d00 h PHE 116 Cb 0.30 -0.30 0.00 0.00 2.79 0.00 0.00 35.95 38.74 3d00 h PHE 116 CO -0.02 0.64 0.00 -0.11 -2.23 0.00 0.00 178.31 176.59 3d00 n LEU 117 N -4.53 2.32 -3.28 0.59 7.94 0.03 -4.94 117.00 115.13 3d00 n LEU 117 Ca 0.06 -0.95 -0.23 0.00 -1.11 0.00 0.00 56.01 53.77 3d00 n LEU 117 Cb 0.07 -0.14 0.01 0.00 0.53 0.00 0.00 43.42 43.89 3d00 n LEU 117 CO 0.37 0.48 -0.03 0.29 -1.11 0.00 0.00 177.39 177.39 3d00 n LYS 118 N 0.76 -3.79 -2.43 1.96 5.02 -0.11 -4.94 118.16 114.63 3d00 n LYS 118 Ca 0.17 0.58 -0.41 0.00 -2.02 0.00 0.00 58.31 56.63 3d00 n LYS 118 Cb 0.44 -5.33 -0.03 0.00 -0.02 0.00 0.00 35.03 30.08 3d00 n LYS 118 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 3d00 s LEU 119 N -6.54 4.44 -0.09 -0.35 1.43 0.00 -5.01 118.68 112.56 3d00 s LEU 119 Ca 0.38 2.13 0.01 0.00 -1.03 0.00 0.00 54.13 55.62 3d00 s LEU 119 Cb -0.19 -3.60 0.02 0.00 0.03 0.00 0.00 46.19 42.45 3d00 s LEU 119 CO 0.46 -0.35 -0.10 -0.54 0.23 0.00 0.00 176.35 176.05 3d00 s LYS 120 N 0.06 1.64 0.00 1.70 1.02 -1.26 -4.79 119.74 118.11 3d00 s LYS 120 Ca 0.53 -0.34 0.00 0.00 0.02 0.00 0.00 55.97 56.18 3d00 s LYS 120 Cb -0.31 -1.53 0.00 0.00 -0.52 0.00 0.00 37.83 35.47 3d00 s LYS 120 CO 0.34 -0.14 0.00 -1.13 -0.92 0.00 0.00 175.35 173.50 3d00 n SER 127 N 4.44 0.00 -0.08 2.83 3.41 -1.26 -5.23 113.62 117.73 3d00 n SER 127 Ca -0.17 -0.07 -0.09 0.00 -0.26 0.00 0.00 58.87 58.28 3d00 n SER 127 Cb 0.51 0.00 0.07 0.00 -0.26 0.00 0.00 64.21 64.52 3d00 n SER 127 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 3d00 h GLU 128 N 0.00 0.77 -0.08 4.33 3.07 -2.06 -2.93 114.58 117.70 3d00 h GLU 128 Ca 0.00 -0.35 -0.02 0.00 -0.50 0.00 0.00 59.36 58.49 3d00 h GLU 128 Cb 0.04 -0.02 -0.00 0.00 -0.84 0.00 0.00 28.75 27.93 3d00 h GLU 128 CO 0.00 0.97 -0.05 0.00 -1.40 0.00 0.00 179.01 178.53 3d00 h ARG 129 N 0.66 0.17 -0.72 2.33 3.08 -2.03 -2.37 114.38 115.50 3d00 h ARG 129 Ca 0.08 -0.08 0.16 0.00 0.07 0.00 0.00 59.98 60.21 3d00 h ARG 129 Cb 0.82 -0.00 -0.12 0.00 0.08 0.00 0.00 29.97 30.75 3d00 h ARG 129 CO 0.07 0.56 0.09 1.25 -1.07 0.00 0.00 179.97 180.87 3d00 h LEU 130 N -0.23 -0.16 -0.38 3.04 5.85 -1.92 -1.03 115.31 120.49 3d00 h LEU 130 Ca 0.02 0.16 -0.15 0.00 0.84 0.00 0.00 57.88 58.75 3d00 h LEU 130 Cb 0.52 0.26 -0.01 0.00 0.37 0.00 0.00 40.66 41.80 3d00 h LEU 130 CO 0.01 -0.10 -0.34 -0.26 -0.34 0.00 0.00 178.44 177.41 3d00 h PHE 131 N 0.18 1.07 -0.74 1.25 0.04 -1.43 -1.68 116.94 115.63 3d00 h PHE 131 Ca 0.40 -0.31 -0.05 0.00 2.80 0.00 0.00 57.97 60.80 3d00 h PHE 131 Cb 0.68 -0.23 -0.03 0.00 2.20 0.00 0.00 35.95 38.58 3d00 h PHE 131 CO -0.33 1.13 0.25 0.87 -0.60 0.00 0.00 178.31 179.63 3d00 h LYS 132 N 0.70 1.13 -0.34 1.51 6.56 -1.09 -3.03 116.57 122.01 3d00 h LYS 132 Ca 0.06 -0.23 -0.03 0.00 -1.06 0.00 0.00 60.65 59.40 3d00 h LYS 132 Cb 0.93 -0.17 -0.01 0.00 -0.57 0.00 0.00 32.23 32.41 3d00 h LYS 132 CO 0.09 0.95 0.11 0.93 -2.06 0.00 0.00 179.45 179.47 3d00 h GLU 133 N 1.08 0.52 -0.62 3.15 5.08 -0.89 -0.76 114.58 122.14 3d00 h GLU 133 Ca 0.24 -0.11 0.11 0.00 -1.00 0.00 0.00 59.36 58.60 3d00 h GLU 133 Cb 0.27 -0.08 -0.08 0.00 0.50 0.00 0.00 28.75 29.37 3d00 h GLU 133 CO -0.01 0.54 0.20 0.82 -1.00 0.00 0.00 179.01 179.56 3d00 h ILE 134 N 0.39 0.71 -0.29 3.13 2.04 -1.28 0.28 117.51 122.49 3d00 h ILE 134 Ca 0.11 -0.12 -0.08 0.00 1.00 0.00 0.00 64.86 65.77 3d00 h ILE 134 Cb 0.24 0.33 -0.01 0.00 -0.74 0.00 0.00 36.82 36.64 3d00 h ILE 134 CO -0.00 0.06 -0.12 -0.09 0.00 0.00 0.00 178.15 178.00 3d00 h ARG 135 N 0.35 0.60 -0.56 2.37 2.43 -1.37 -1.86 114.38 116.34 3d00 h ARG 135 Ca 0.32 -0.25 -0.02 0.00 -0.81 0.00 0.00 59.98 59.21 3d00 h ARG 135 Cb 0.44 -0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 29.94 3d00 h ARG 135 CO -0.35 0.82 0.25 0.93 -1.51 0.00 0.00 179.97 180.11 3d00 h GLU 136 N 0.35 0.81 -0.52 0.20 5.08 -0.53 -3.09 114.58 116.87 3d00 h GLU 136 Ca 0.07 -0.13 -0.04 0.00 -1.00 0.00 0.00 59.36 58.26 3d00 h GLU 136 Cb 0.63 -0.14 -0.02 0.00 0.50 0.00 0.00 28.75 29.71 3d00 h GLU 136 CO 0.04 0.68 0.18 0.00 -1.00 0.00 0.00 179.01 178.91 3d00 h ALA 137 N 1.09 0.68 -0.68 3.43 0.00 -0.41 -3.48 119.26 119.89 3d00 h ALA 137 Ca 0.19 -0.17 0.00 0.00 0.00 0.00 0.00 54.91 54.92 3d00 h ALA 137 Cb 0.15 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 17.74 3d00 h ALA 137 CO -0.02 0.32 0.00 0.41 0.00 0.00 0.00 179.25 179.96 3d00 n GLY 138 N -0.74 3.02 0.00 0.00 0.00 -0.71 -1.24 105.19 105.53 3d00 n GLY 138 Ca 0.02 -0.15 0.15 0.00 0.00 0.00 0.00 46.02 46.04 3d00 n GLY 138 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3d00 n PRO 139 N 14.00 1.00 0.31 1.61 -0.04 -1.26 -4.05 135.00 146.57 3d00 n PRO 139 Ca 0.00 -0.00 0.18 0.00 -0.04 0.00 0.00 63.50 63.64 3d00 n PRO 139 Cb 0.00 -1.48 1.01 0.00 -0.04 0.00 0.00 33.50 32.99 3d00 n PRO 139 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 3d00 h ASP 140 N 0.00 0.00 -0.41 3.54 3.32 -1.54 -1.51 116.42 119.82 3d00 h ASP 140 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3d00 h ASP 140 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 3d00 h ASP 140 CO 0.00 0.02 0.00 2.30 -1.72 0.00 0.00 179.24 179.84 3d00 n ILE 141 N -3.42 0.55 -4.05 0.35 -5.35 -1.26 -4.84 119.36 101.34 3d00 n ILE 141 Ca -0.03 -0.59 -0.31 0.00 -0.27 0.00 0.00 62.75 61.55 3d00 n ILE 141 Cb 0.11 0.38 -0.06 0.00 -1.74 0.00 0.00 39.64 38.33 3d00 n ILE 141 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 3d00 s LEU 142 N -1.14 3.88 0.14 7.28 1.43 -0.57 -0.48 118.68 129.22 3d00 s LEU 142 Ca 0.32 0.05 0.08 0.00 -1.03 0.00 0.00 54.13 53.56 3d00 s LEU 142 Cb 0.17 -2.48 -0.04 0.00 0.03 0.00 0.00 46.19 43.87 3d00 s LEU 142 CO 0.23 0.20 -0.18 -0.70 0.23 0.00 0.00 176.35 176.13 3d00 s GLU 143 N -2.25 1.19 0.05 1.70 2.56 0.49 -4.76 118.70 117.68 3d00 s GLU 143 Ca 0.28 -1.32 0.07 0.00 0.00 0.00 0.00 54.97 54.01 3d00 s GLU 143 Cb -0.12 -1.27 -0.03 0.00 2.00 0.00 0.00 34.13 34.71 3d00 s GLU 143 CO 0.21 0.27 -0.20 -0.51 -0.56 0.00 0.00 175.26 174.47 3d00 s LEU 144 N -2.44 2.18 -0.11 2.70 1.43 -1.26 -1.75 118.68 119.43 3d00 s LEU 144 Ca 0.12 -0.53 -0.08 0.00 -1.03 0.00 0.00 54.13 52.62 3d00 s LEU 144 Cb -0.07 -0.90 0.04 0.00 0.03 0.00 0.00 46.19 45.29 3d00 s LEU 144 CO 0.05 0.13 0.27 -0.60 0.23 0.00 0.00 176.35 176.43 3d00 s ARG 145 N -1.25 0.27 0.27 1.70 3.52 0.23 -4.98 118.95 118.72 3d00 s ARG 145 Ca 0.06 0.46 -0.30 0.00 -0.13 0.00 0.00 55.73 55.82 3d00 s ARG 145 Cb -0.09 0.03 -0.10 0.00 -1.56 0.00 0.00 34.95 33.23 3d00 s ARG 145 CO 0.02 -0.09 1.44 -0.80 -0.81 0.00 0.00 175.30 175.06 3d00 s ASN 146 N 0.67 6.62 0.09 -2.12 0.01 -1.26 -0.67 114.94 118.27 3d00 s ASN 146 Ca -0.04 2.72 0.02 0.00 -0.71 0.00 0.00 52.86 54.85 3d00 s ASN 146 Cb -0.06 -2.63 -0.04 0.00 0.41 0.00 0.00 41.25 38.93 3d00 s ASN 146 CO -0.04 -0.71 -0.07 0.68 -1.51 0.00 0.00 177.10 175.44 3d00 s VAL 147 N -0.21 0.70 -0.05 1.60 -7.23 -0.27 -4.88 120.40 110.05 3d00 s VAL 147 Ca 0.58 -1.80 0.03 0.00 -1.81 0.00 0.00 61.98 58.98 3d00 s VAL 147 Cb -0.42 -1.52 0.01 0.00 0.56 0.00 0.00 36.38 35.00 3d00 s VAL 147 CO 0.46 -0.78 -0.14 -0.75 -0.31 0.00 0.00 175.10 173.58 3d00 s LYS 148 N -3.46 1.65 0.50 4.82 2.47 -1.26 -0.62 119.74 123.84 3d00 s LYS 148 Ca 0.09 -0.48 -0.21 0.00 -1.56 0.00 0.00 55.97 53.81 3d00 s LYS 148 Cb 0.03 -1.40 -0.07 0.00 -1.46 0.00 0.00 37.83 34.93 3d00 s LYS 148 CO -0.04 0.12 1.13 -0.51 0.16 0.00 0.00 175.35 176.21 3d00 s LEU 149 N 0.35 3.87 0.41 5.43 2.01 0.04 -4.99 118.68 125.81 3d00 s LEU 149 Ca -0.09 2.18 -0.26 0.00 0.01 0.00 0.00 54.13 55.97 3d00 s LEU 149 Cb -0.13 -4.44 -0.09 0.00 0.01 0.00 0.00 46.19 41.54 3d00 s LEU 149 CO 0.03 -1.03 1.36 -0.54 1.01 0.00 0.00 176.35 177.18 3d00 s LYS 150 N -3.04 3.90 0.30 1.70 1.02 -1.26 -4.94 119.74 117.43 3d00 s LYS 150 Ca 0.68 2.28 0.10 0.00 0.02 0.00 0.00 55.97 59.05 3d00 s LYS 150 Cb -0.25 -2.76 0.93 0.00 -0.52 0.00 0.00 37.83 35.24 3d00 s LYS 150 CO 0.29 -0.59 1.41 -2.30 -0.92 0.00 0.00 175.35 173.24 3d00 n PRO 151 N 0.08 -0.06 0.33 -1.68 -0.02 -1.26 -1.67 135.00 130.72 3d00 n PRO 151 Ca 0.04 1.29 0.21 0.00 -2.02 0.00 0.00 63.50 63.02 3d00 n PRO 151 Cb 0.43 -2.18 1.13 0.00 -0.02 0.00 0.00 33.50 32.86 3d00 n PRO 151 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 3d00 h GLY 152 N 0.00 0.00 0.90 -1.23 0.00 -2.00 -1.02 103.07 99.72 3d00 h GLY 152 Ca 0.65 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.98 3d00 h GLY 152 CO -0.77 0.00 -0.07 0.69 0.00 0.00 0.00 176.54 176.39 3d00 n PHE 153 N -3.24 0.00 -2.03 5.60 3.01 -0.67 -3.55 117.46 116.59 3d00 n PHE 153 Ca -0.03 0.00 0.01 0.00 1.01 0.00 0.00 57.45 58.45 3d00 n PHE 153 Cb 0.09 -0.15 0.11 0.00 -0.01 0.00 0.00 39.48 39.52 3d00 n PHE 153 CO 0.00 0.00 0.00 1.28 1.01 0.00 0.00 176.76 179.05 3d00 n LEU 154 N -0.91 2.35 -4.81 4.37 4.77 -0.39 -5.07 117.00 117.30 3d00 n LEU 154 Ca 0.16 -3.34 -0.33 0.00 -0.03 0.00 0.00 56.01 52.47 3d00 n LEU 154 Cb 0.25 -0.26 -0.05 0.00 -2.33 0.00 0.00 43.42 41.03 3d00 n LEU 154 CO 0.22 1.18 0.68 -1.83 -1.33 0.00 0.00 177.39 176.31 3d00 s GLU 155 N -2.30 4.00 0.15 3.23 1.03 -1.22 -5.00 118.70 118.59 3d00 s GLU 155 Ca 0.37 1.23 -0.31 0.00 0.03 0.00 0.00 54.97 56.29 3d00 s GLU 155 Cb 0.38 -2.13 -0.11 0.00 -0.80 0.00 0.00 34.13 31.46 3d00 s GLU 155 CO -0.09 -0.24 1.81 1.63 -1.33 0.00 0.00 175.26 177.04 3d00 n LYS 156 N -0.86 2.82 -2.55 -4.83 5.02 -1.26 -4.98 118.16 111.52 3d00 n LYS 156 Ca 0.08 1.02 -0.41 0.00 -2.02 0.00 0.00 58.31 56.99 3d00 n LYS 156 Cb 0.53 -2.91 -0.04 0.00 -0.02 0.00 0.00 35.03 32.59 3d00 n LYS 156 CO 0.00 0.00 0.00 -1.59 -0.52 0.00 0.00 177.40 175.29 3d00 s LYS 157 N 2.29 4.65 0.04 1.97 0.00 -1.26 -4.99 119.74 122.44 3d00 s LYS 157 Ca 0.80 1.69 -0.28 0.00 0.00 0.00 0.00 55.97 58.18 3d00 s LYS 157 Cb -0.48 -3.27 -0.05 0.00 0.00 0.00 0.00 37.83 34.04 3d00 s LYS 157 CO 0.35 0.17 0.87 -1.01 0.00 0.00 0.00 175.35 175.74 3d00 s HIS 158 N -0.55 3.72 -1.09 1.78 0.09 -1.26 -4.95 115.29 113.04 3d00 s HIS 158 Ca 0.47 1.61 -0.11 0.00 -0.00 0.00 0.00 55.06 57.02 3d00 s HIS 158 Cb -0.29 -2.97 -0.07 0.00 -0.00 0.00 0.00 32.58 29.25 3d00 s HIS 158 CO 0.35 0.16 2.24 1.63 -0.00 0.00 0.00 174.74 179.13 3d00 n LYS 159 N 3.19 2.35 -1.72 1.40 5.02 -1.26 -4.96 118.16 122.19 3d00 n LYS 159 Ca 0.01 -1.84 -0.40 0.00 -2.02 0.00 0.00 58.31 54.07 3d00 n LYS 159 Cb 0.50 -2.74 0.03 0.00 -0.02 0.00 0.00 35.03 32.80 3d00 n LYS 159 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3d00 n GLY 160 N 3.96 0.61 3.73 0.72 0.00 -1.26 -5.01 105.19 107.94 3d00 n GLY 160 Ca 0.53 0.11 -0.40 0.00 0.00 0.00 0.00 46.02 46.26 3d00 n GLY 160 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3d00 s LYS 161 N -2.50 4.47 -0.24 1.61 2.20 -1.26 -4.99 119.74 119.03 3d00 s LYS 161 Ca 0.66 1.00 -0.16 0.00 -0.36 0.00 0.00 55.97 57.11 3d00 s LYS 161 Cb -0.46 -3.40 -0.04 0.00 -1.51 0.00 0.00 37.83 32.42 3d00 s LYS 161 CO 0.54 0.18 0.40 0.42 -0.36 0.00 0.00 175.35 176.53 3d00 s ILE 162 N 0.35 5.17 0.51 5.43 -1.09 -1.26 -0.79 121.20 129.54 3d00 s ILE 162 Ca 0.39 0.67 0.01 0.00 -2.23 0.00 0.00 60.65 59.48 3d00 s ILE 162 Cb -0.19 -3.73 -0.01 0.00 -1.58 0.00 0.00 42.46 36.95 3d00 s ILE 162 CO 0.21 0.19 0.00 0.68 -1.23 0.00 0.00 174.94 174.80 3d00 s VAL 163 N 1.75 1.11 -0.22 2.92 -7.23 0.03 -4.92 120.40 113.85 3d00 s VAL 163 Ca 0.17 -2.00 -0.06 0.00 -1.81 0.00 0.00 61.98 58.29 3d00 s VAL 163 Cb -0.15 -2.12 -0.03 0.00 0.56 0.00 0.00 36.38 34.64 3d00 s VAL 163 CO 0.09 0.00 0.02 -0.22 -0.31 0.00 0.00 175.10 174.68 3d00 s LEU 164 N -3.88 3.31 0.01 1.32 2.96 -1.26 -1.32 118.68 119.82 3d00 s LEU 164 Ca 0.04 -0.20 -0.30 0.00 -0.22 0.00 0.00 54.13 53.45 3d00 s LEU 164 Cb 0.01 -1.86 -0.06 0.00 0.50 0.00 0.00 46.19 44.79 3d00 s LEU 164 CO 0.02 0.03 1.47 0.00 -1.32 0.00 0.00 176.35 176.56 3d00 h PRO 166 N 8.04 0.00 0.08 0.00 0.13 -1.91 0.29 132.00 138.63 3d00 h PRO 166 Ca -0.39 0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 64.56 3d00 h PRO 166 Cb 1.18 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.31 3d00 h PRO 166 CO 0.91 0.16 -0.92 0.37 -0.23 0.00 0.00 178.00 178.29 3d00 h GLN 167 N 0.00 0.16 -0.00 0.86 4.15 -1.91 -3.39 115.11 114.98 3d00 h GLN 167 Ca -0.00 -0.28 0.00 0.00 0.77 0.00 0.00 58.65 59.14 3d00 h GLN 167 Cb 0.42 0.10 0.00 0.00 0.21 0.00 0.00 27.48 28.22 3d00 h GLN 167 CO 0.02 1.13 -0.55 0.00 -1.93 0.00 0.00 178.83 177.51 3d00 n ARG 169 N -1.05 -4.95 -4.29 0.00 1.74 0.10 -5.00 116.66 103.22 3d00 n ARG 169 Ca 0.03 0.60 -0.27 0.00 -0.77 0.00 0.00 57.85 57.44 3d00 n ARG 169 Cb 0.23 -5.21 -0.09 0.00 -1.02 0.00 0.00 32.46 26.36 3d00 n ARG 169 CO 0.00 0.00 0.00 -1.21 -1.52 0.00 0.00 177.63 174.90 3d00 s GLU 170 N -6.21 2.06 0.26 5.56 2.02 -1.25 -4.85 118.70 116.30 3d00 s GLU 170 Ca 0.19 -1.25 -0.30 0.00 0.02 0.00 0.00 54.97 53.63 3d00 s GLU 170 Cb -0.09 -2.17 -0.09 0.00 0.10 0.00 0.00 34.13 31.88 3d00 s GLU 170 CO 0.82 0.44 1.09 0.00 0.02 0.00 0.00 175.26 177.63 3d00 s ALA 171 N -1.67 3.40 0.15 5.21 0.00 -1.26 -1.05 121.76 126.54 3d00 s ALA 171 Ca 0.25 0.87 -0.16 0.00 0.00 0.00 0.00 51.96 52.92 3d00 s ALA 171 Cb -0.09 -3.32 0.03 0.00 0.00 0.00 0.00 23.12 19.74 3d00 s ALA 171 CO 0.15 -0.14 0.42 1.52 0.00 0.00 0.00 175.76 177.71 3d00 s TYR 172 N -1.04 -0.12 0.11 0.00 1.13 -0.43 -4.94 117.35 112.06 3d00 s TYR 172 Ca 0.45 -0.21 -0.31 0.00 -1.41 0.00 0.00 57.07 55.59 3d00 s TYR 172 Cb -0.31 0.26 -0.09 0.00 -1.10 0.00 0.00 41.96 40.72 3d00 s TYR 172 CO 0.40 -0.76 1.58 -2.14 -2.51 0.00 0.00 175.55 172.12 3d00 s PRO 173 N -3.84 4.22 0.57 -3.49 0.02 -1.26 -0.79 135.00 130.43 3d00 s PRO 173 Ca 0.06 2.30 0.25 0.00 0.02 0.00 0.00 61.00 63.64 3d00 s PRO 173 Cb 0.01 -3.37 1.63 0.00 0.02 0.00 0.00 34.50 32.79 3d00 s PRO 173 CO -0.08 -0.64 2.21 0.00 -0.33 0.00 0.00 177.00 178.15 3d00 h ALA 174 N 7.51 1.72 0.00 -1.55 0.00 -1.29 -1.84 119.26 123.81 3d00 h ALA 174 Ca -0.42 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 54.46 3d00 h ALA 174 Cb 1.20 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.99 3d00 h ALA 174 CO 0.92 -0.03 -0.10 -0.56 0.00 0.00 0.00 179.25 179.47 3d00 h GLN 175 N 0.00 0.00 0.00 0.00 3.07 -1.91 -2.76 115.11 113.51 3d00 h GLN 175 Ca 0.01 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.75 3d00 h GLN 175 Cb 0.05 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.61 3d00 h GLN 175 CO -0.00 0.10 0.00 -0.44 0.09 0.00 0.00 178.83 178.58 3d00 h ASP 176 N 0.00 0.00 -3.65 0.06 3.32 -1.66 -3.48 116.42 111.00 3d00 h ASP 176 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 3d00 h ASP 176 Cb 0.23 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.78 3d00 h ASP 176 CO 0.01 0.00 0.00 0.61 -1.72 0.00 0.00 179.24 178.14 3d00 n GLY 177 N -0.24 0.55 0.10 2.75 0.00 -1.04 -4.78 105.19 102.52 3d00 n GLY 177 Ca 0.01 -2.16 0.13 0.00 0.00 0.00 0.00 46.02 44.00 3d00 n GLY 177 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3d00 n GLU 178 N 0.00 0.28 -4.45 1.61 1.02 -1.26 -4.69 120.64 113.14 3d00 n GLU 178 Ca 0.00 0.19 -0.22 0.00 -0.02 0.00 0.00 57.16 57.11 3d00 n GLU 178 Cb 0.00 -1.79 -0.11 0.00 -0.02 0.00 0.00 31.44 29.53 3d00 n GLU 178 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3d00 s LEU 179 N -4.51 2.35 0.78 -4.62 1.43 -1.26 -4.53 118.68 108.32 3d00 s LEU 179 Ca 0.10 -1.31 -0.12 0.00 -1.03 0.00 0.00 54.13 51.77 3d00 s LEU 179 Cb 0.12 -0.51 0.06 0.00 0.03 0.00 0.00 46.19 45.90 3d00 s LEU 179 CO 0.63 -0.50 1.11 0.00 0.23 0.00 0.00 176.35 177.81 3d00 h LEU 181 N -0.99 0.00 0.19 0.00 3.38 -1.96 0.17 115.31 116.10 3d00 h LEU 181 Ca -0.47 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.49 3d00 h LEU 181 Cb 1.27 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.03 3d00 h LEU 181 CO 0.61 0.20 -0.09 -1.28 0.09 0.00 0.00 178.44 177.97 3d00 h SER 182 N 0.00 -0.21 0.40 -0.43 0.87 -1.92 0.09 113.55 112.34 3d00 h SER 182 Ca -0.00 -0.27 -0.04 0.00 -1.23 0.00 0.00 61.79 60.25 3d00 h SER 182 Cb 0.47 0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 62.47 3d00 h SER 182 CO 0.03 0.18 -0.21 0.00 -0.53 0.00 0.00 176.83 176.30 3d00 h GLN 184 N 0.00 0.00 0.00 0.00 4.20 -0.68 -3.46 115.11 115.17 3d00 h GLN 184 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 3d00 h GLN 184 Cb 0.46 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.24 3d00 h GLN 184 CO 0.03 0.07 0.00 0.41 -0.67 0.00 0.00 178.83 178.67 3d00 n GLY 185 N -0.41 0.14 0.04 3.46 0.00 -0.03 -5.01 105.19 103.38 3d00 n GLY 185 Ca -0.01 0.00 0.10 0.00 0.00 0.00 0.00 46.02 46.11 3d00 n GLY 185 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3d00 n GLY 186 N 0.00 -1.25 3.66 -0.02 0.00 0.00 -4.85 105.19 102.74 3d00 n GLY 186 Ca 0.00 -0.03 -0.55 0.00 0.00 0.00 0.00 46.02 45.44 3d00 n GLY 186 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3d00 n SER 187 N -1.73 2.10 0.00 1.61 2.88 -0.82 -4.84 113.62 112.82 3d00 n SER 187 Ca 0.04 1.09 0.15 0.00 -1.33 0.00 0.00 58.87 58.83 3d00 n SER 187 Cb 0.25 -1.17 0.86 0.00 -0.75 0.00 0.00 64.21 63.40 3d00 n SER 187 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 3d00 n PRO 188 N 4.17 0.80 -4.13 -1.46 -0.04 -1.26 -4.93 135.00 128.16 3d00 n PRO 188 Ca 0.23 0.00 -0.28 0.00 -0.04 0.00 0.00 63.50 63.42 3d00 n PRO 188 Cb 0.16 -1.50 -0.07 0.00 -0.04 0.00 0.00 33.50 32.05 3d00 n PRO 188 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 3d00 s TYR 189 N -2.18 3.03 -2.00 0.54 2.02 -1.26 -5.31 117.35 112.19 3d00 s TYR 189 Ca 0.41 -0.05 0.25 0.00 -0.37 0.00 0.00 57.07 57.31 3d00 s TYR 189 Cb 0.21 -1.49 1.48 0.00 -0.40 0.00 0.00 41.96 41.76 3d00 s TYR 189 CO 0.39 0.51 1.84 1.28 -1.57 0.00 0.00 175.55 178.00