#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1gn2 n GLU 3 N 0.00 -2.22 -3.53 0.00 1.02 -1.26 -5.00 120.64 109.65 1gn2 n GLU 3 Ca 0.00 -0.63 -0.34 0.00 -0.02 0.00 0.00 57.16 56.17 1gn2 n GLU 3 Cb 0.00 -1.91 -0.05 0.00 -0.02 0.00 0.00 31.44 29.46 1gn2 n GLU 3 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 1gn2 s TYR 4 N -2.30 3.57 0.03 -0.32 1.51 -1.26 -5.10 117.35 113.48 1gn2 s TYR 4 Ca 0.62 0.83 0.01 0.00 -1.01 0.00 0.00 57.07 57.52 1gn2 s TYR 4 Cb -0.18 -2.19 -0.02 0.00 -0.11 0.00 0.00 41.96 39.46 1gn2 s TYR 4 CO 0.65 0.48 -0.05 0.95 -1.11 0.00 0.00 175.55 176.48 1gn2 s THR 5 N -1.45 0.28 -0.31 -0.71 -4.23 -1.26 -4.95 115.64 103.00 1gn2 s THR 5 Ca 0.35 -0.89 -0.29 0.00 -1.18 0.00 0.00 61.69 59.69 1gn2 s THR 5 Cb -0.14 -0.38 -0.01 0.00 1.34 0.00 0.00 72.50 73.31 1gn2 s THR 5 CO 0.19 -0.40 1.64 -0.22 -0.54 0.00 0.00 174.62 175.29 1gn2 s LEU 6 N -1.36 3.65 1.01 4.79 2.96 -1.26 -5.00 118.68 123.48 1gn2 s LEU 6 Ca -0.12 1.30 -0.12 0.00 -0.22 0.00 0.00 54.13 54.96 1gn2 s LEU 6 Cb -0.09 -3.53 0.20 0.00 0.50 0.00 0.00 46.19 43.26 1gn2 s LEU 6 CO -0.00 -1.48 1.08 -2.16 -1.32 0.00 0.00 176.35 172.46 1gn2 s PRO 7 N 5.14 0.32 -0.03 0.98 0.04 -1.26 -5.04 135.00 135.15 1gn2 s PRO 7 Ca 0.72 0.65 -0.04 0.00 0.04 0.00 0.00 61.00 62.37 1gn2 s PRO 7 Cb -0.21 -1.71 -0.04 0.00 0.04 0.00 0.00 34.50 32.57 1gn2 s PRO 7 CO 0.32 -2.84 0.19 -0.51 0.04 0.00 0.00 177.00 174.20 1gn2 s ASP 8 N -3.26 6.40 0.50 6.66 1.01 -1.26 -5.07 116.67 121.66 1gn2 s ASP 8 Ca 0.66 0.42 -0.19 0.00 0.71 0.00 0.00 52.55 54.15 1gn2 s ASP 8 Cb -0.20 -2.04 -0.08 0.00 1.01 0.00 0.00 42.92 41.62 1gn2 s ASP 8 CO 0.59 0.29 1.02 -0.76 0.21 0.00 0.00 175.17 176.52 1gn2 s LEU 9 N -1.72 3.76 -0.05 1.23 1.43 -1.26 -4.89 118.68 117.18 1gn2 s LEU 9 Ca 0.25 1.82 0.05 0.00 -1.03 0.00 0.00 54.13 55.22 1gn2 s LEU 9 Cb -0.13 -4.54 0.24 0.00 0.03 0.00 0.00 46.19 41.78 1gn2 s LEU 9 CO 0.15 -0.77 0.98 0.47 0.23 0.00 0.00 176.35 177.41 1gn2 n ASP 10 N -1.22 2.03 -3.13 2.29 8.00 -1.26 -4.87 116.55 118.40 1gn2 n ASP 10 Ca 0.08 -2.19 -0.11 0.00 0.71 0.00 0.00 54.79 53.29 1gn2 n ASP 10 Cb 0.53 -0.42 -0.01 0.00 -0.02 0.00 0.00 41.12 41.21 1gn2 n ASP 10 CO 0.00 0.00 0.00 -1.66 -0.39 0.00 0.00 177.20 175.15 1gn2 s TRP 11 N -1.60 0.49 0.20 1.24 1.48 -1.26 -5.10 118.94 114.40 1gn2 s TRP 11 Ca 0.16 -0.97 -0.17 0.00 -1.06 0.00 0.00 56.10 54.07 1gn2 s TRP 11 Cb 0.11 0.45 -0.08 0.00 -1.16 0.00 0.00 33.47 32.79 1gn2 s TRP 11 CO 0.07 -1.37 0.65 0.34 -4.06 0.00 0.00 176.95 172.58 1gn2 s ASP 12 N -3.13 6.91 0.32 -2.66 3.68 -1.26 -4.96 116.67 115.58 1gn2 s ASP 12 Ca 0.21 1.24 0.10 0.00 2.13 0.00 0.00 52.55 56.24 1gn2 s ASP 12 Cb -0.03 -2.35 0.95 0.00 -1.45 0.00 0.00 42.92 40.04 1gn2 s ASP 12 CO 0.15 0.03 1.68 1.88 0.13 0.00 0.00 175.17 179.04 1gn2 h TYR 13 N 3.31 0.83 0.00 -5.34 0.05 -1.95 -1.25 116.97 112.62 1gn2 h TYR 13 Ca -0.48 0.04 0.00 0.00 0.05 0.00 0.00 58.73 58.34 1gn2 h TYR 13 Cb 1.19 -0.21 0.00 0.00 1.01 0.00 0.00 36.73 38.72 1gn2 h TYR 13 CO 0.64 -0.12 0.00 0.78 -1.05 0.00 0.00 178.16 178.41 1gn2 h GLY 14 N 0.37 0.00 0.76 3.88 0.00 -1.91 -3.36 103.07 102.81 1gn2 h GLY 14 Ca 0.67 0.00 0.00 0.00 0.00 0.00 0.00 47.33 48.00 1gn2 h GLY 14 CO -0.58 0.00 0.58 0.00 0.00 0.00 0.00 176.54 176.54 1gn2 h ALA 15 N 2.17 1.53 -0.10 3.60 0.00 -1.58 0.47 119.26 125.35 1gn2 h ALA 15 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1gn2 h ALA 15 Cb 0.69 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.48 1gn2 h ALA 15 CO 0.00 -0.53 0.00 1.28 0.00 0.00 0.00 179.25 180.00 1gn2 n LEU 16 N -2.49 2.87 -4.75 0.00 4.77 -1.26 -4.66 117.00 111.47 1gn2 n LEU 16 Ca -0.01 -1.02 -0.36 0.00 -0.03 0.00 0.00 56.01 54.58 1gn2 n LEU 16 Cb 0.60 -0.05 0.03 0.00 -2.33 0.00 0.00 43.42 41.67 1gn2 n LEU 16 CO 0.06 0.51 0.85 -1.61 -1.33 0.00 0.00 177.39 175.88 1gn2 s GLU 17 N -1.90 3.05 0.15 3.23 2.02 0.15 -1.53 118.70 123.87 1gn2 s GLU 17 Ca 0.31 1.85 0.25 0.00 0.02 0.00 0.00 54.97 57.41 1gn2 s GLU 17 Cb 0.21 -1.99 0.61 0.00 0.10 0.00 0.00 34.13 33.06 1gn2 s GLU 17 CO 0.31 -1.15 1.56 -0.35 0.02 0.00 0.00 175.26 175.64 1gn2 n PRO 18 N -1.47 0.25 -0.36 0.39 -0.04 -1.26 -4.84 135.00 127.68 1gn2 n PRO 18 Ca 0.13 0.14 0.10 0.00 -0.04 0.00 0.00 63.50 63.82 1gn2 n PRO 18 Cb 0.49 -1.72 0.27 0.00 -0.04 0.00 0.00 33.50 32.50 1gn2 n PRO 18 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1gn2 h HIS 19 N 0.00 1.10 -2.66 0.54 3.86 -1.64 -3.38 115.15 112.96 1gn2 h HIS 19 Ca 0.00 0.03 -0.31 0.00 -1.16 0.00 0.00 60.37 58.94 1gn2 h HIS 19 Cb 0.72 -0.34 -0.36 0.00 1.06 0.00 0.00 27.41 28.49 1gn2 h HIS 19 CO 0.00 0.35 -0.62 0.42 0.86 0.00 0.00 177.93 178.94 1gn2 s ILE 20 N -5.92 -0.32 0.51 2.45 1.01 -0.66 -4.88 121.20 113.39 1gn2 s ILE 20 Ca -0.12 -0.01 -0.21 0.00 0.00 0.00 0.00 60.65 60.32 1gn2 s ILE 20 Cb 0.23 -0.59 -0.08 0.00 0.01 0.00 0.00 42.46 42.03 1gn2 s ILE 20 CO 0.80 -0.12 0.88 -1.54 0.00 0.00 0.00 174.94 174.96 1gn2 n SER 21 N 5.32 0.56 -0.20 3.58 3.41 -1.26 -3.29 113.62 121.74 1gn2 n SER 21 Ca -0.05 0.89 -0.08 0.00 -0.26 0.00 0.00 58.87 59.37 1gn2 n SER 21 Cb 0.50 -1.32 0.06 0.00 -0.26 0.00 0.00 64.21 63.19 1gn2 n SER 21 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 1gn2 h GLY 22 N 0.90 1.11 0.45 5.00 0.00 -1.85 -2.64 103.07 106.04 1gn2 h GLY 22 Ca -0.46 -0.78 0.14 0.00 0.00 0.00 0.00 47.33 46.23 1gn2 h GLY 22 CO 0.53 0.72 0.61 -1.61 0.00 0.00 0.00 176.54 176.78 1gn2 h GLN 23 N 0.95 0.84 0.74 4.80 4.15 -1.91 0.31 115.11 124.99 1gn2 h GLN 23 Ca 0.18 -0.05 -0.04 0.00 0.77 0.00 0.00 58.65 59.51 1gn2 h GLN 23 Cb 0.51 -0.19 0.01 0.00 0.21 0.00 0.00 27.48 28.02 1gn2 h GLN 23 CO 0.02 0.56 -0.36 0.82 -1.93 0.00 0.00 178.83 177.94 1gn2 h ILE 24 N 0.86 0.00 -1.15 2.39 2.04 -1.84 -1.86 117.51 117.96 1gn2 h ILE 24 Ca 0.49 -0.19 0.32 0.00 1.00 0.00 0.00 64.86 66.48 1gn2 h ILE 24 Cb 0.62 0.00 -0.08 0.00 -0.74 0.00 0.00 36.82 36.62 1gn2 h ILE 24 CO -0.26 0.00 0.78 0.78 0.00 0.00 0.00 178.15 179.45 1gn2 h ASN 25 N -1.19 0.24 0.06 1.72 2.35 -1.24 0.24 115.58 117.75 1gn2 h ASN 25 Ca -0.10 0.05 -0.00 0.00 -0.55 0.00 0.00 56.30 55.70 1gn2 h ASN 25 Cb 0.76 0.02 0.00 0.00 0.05 0.00 0.00 38.32 39.15 1gn2 h ASN 25 CO 0.17 0.02 -0.03 -0.08 -1.65 0.00 0.00 177.43 175.86 1gn2 h GLU 26 N 0.19 -0.07 -0.08 0.81 4.81 -0.79 -1.74 114.58 117.71 1gn2 h GLU 26 Ca 0.62 0.00 -0.11 0.00 -0.13 0.00 0.00 59.36 59.74 1gn2 h GLU 26 Cb 1.98 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 31.36 1gn2 h GLU 26 CO -0.19 0.44 -0.46 -0.07 -0.73 0.00 0.00 179.01 178.00 1gn2 h LEU 27 N -0.63 0.22 -0.01 1.64 3.38 -0.33 -1.65 115.31 117.93 1gn2 h LEU 27 Ca -0.01 -0.10 0.00 0.00 0.09 0.00 0.00 57.88 57.86 1gn2 h LEU 27 Cb 0.54 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 41.23 1gn2 h LEU 27 CO 0.01 0.65 0.01 -0.74 0.09 0.00 0.00 178.44 178.46 1gn2 h HIS 28 N 0.17 0.01 0.19 1.13 2.76 -0.63 0.15 115.15 118.93 1gn2 h HIS 28 Ca 0.01 0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.17 1gn2 h HIS 28 Cb 0.88 -0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.83 1gn2 h HIS 28 CO 0.01 0.03 -0.09 1.25 -1.30 0.00 0.00 177.93 177.83 1gn2 h HIS 29 N -0.01 -0.24 0.00 5.26 -0.00 -1.29 0.32 115.15 119.19 1gn2 h HIS 29 Ca 0.00 -0.01 -0.01 0.00 -0.00 0.00 0.00 60.37 60.36 1gn2 h HIS 29 Cb 0.02 0.08 -0.00 0.00 -0.00 0.00 0.00 27.41 27.51 1gn2 h HIS 29 CO -0.07 -0.05 -0.04 0.66 -0.00 0.00 0.00 177.93 178.43 1gn2 h SER 30 N -1.04 0.00 0.00 3.26 4.64 -1.41 -2.91 113.55 116.09 1gn2 h SER 30 Ca -0.03 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.29 1gn2 h SER 30 Cb 0.30 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.39 1gn2 h SER 30 CO 0.04 0.04 -0.25 0.29 -0.87 0.00 0.00 176.83 176.09 1gn2 n LYS 31 N -3.16 0.12 0.47 4.77 4.76 0.45 -4.52 118.16 121.04 1gn2 n LYS 31 Ca 0.00 0.05 -0.18 0.00 -2.87 0.00 0.00 58.31 55.31 1gn2 n LYS 31 Cb 0.31 -0.72 -0.09 0.00 -1.84 0.00 0.00 35.03 32.69 1gn2 n LYS 31 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1gn2 h HIS 32 N -0.23 -1.11 -0.80 2.13 3.86 -1.27 -2.25 115.15 115.47 1gn2 h HIS 32 Ca -0.00 -0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 59.17 1gn2 h HIS 32 Cb 0.24 0.37 -0.04 0.00 1.06 0.00 0.00 27.41 29.04 1gn2 h HIS 32 CO -0.10 -0.69 0.45 1.25 0.86 0.00 0.00 177.93 179.70 1gn2 h HIS 33 N -1.28 1.09 -0.78 2.45 -0.00 -0.96 -2.03 115.15 113.65 1gn2 h HIS 33 Ca -0.12 -0.02 0.05 0.00 -0.00 0.00 0.00 60.37 60.28 1gn2 h HIS 33 Cb 0.92 -0.35 -0.05 0.00 -0.00 0.00 0.00 27.41 27.93 1gn2 h HIS 33 CO 0.01 0.74 0.51 0.00 -0.00 0.00 0.00 177.93 179.19 1gn2 h ALA 34 N 1.38 1.60 -0.50 5.26 0.00 -1.51 -1.68 119.26 123.80 1gn2 h ALA 34 Ca 0.29 -0.03 -0.06 0.00 0.00 0.00 0.00 54.91 55.11 1gn2 h ALA 34 Cb 0.01 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 1gn2 h ALA 34 CO -0.05 0.30 0.06 1.15 0.00 0.00 0.00 179.25 180.72 1gn2 h THR 35 N 0.89 1.23 -0.24 0.00 2.02 -0.75 -1.68 112.91 114.38 1gn2 h THR 35 Ca 0.32 -0.90 -0.12 0.00 0.77 0.00 0.00 66.41 66.49 1gn2 h THR 35 Cb 0.15 0.78 -0.00 0.00 -1.74 0.00 0.00 68.15 67.34 1gn2 h THR 35 CO -0.10 0.32 -0.31 1.88 0.37 0.00 0.00 175.52 177.68 1gn2 h TYR 36 N 0.76 0.77 -0.76 3.16 0.05 -1.02 -1.76 116.97 118.18 1gn2 h TYR 36 Ca 0.16 -0.25 -0.00 0.00 0.05 0.00 0.00 58.73 58.69 1gn2 h TYR 36 Cb 0.37 -0.16 -0.04 0.00 1.01 0.00 0.00 36.73 37.91 1gn2 h TYR 36 CO 0.02 0.98 0.46 0.28 -1.05 0.00 0.00 178.16 178.85 1gn2 h VAL 37 N 0.34 1.21 -0.47 -2.88 2.07 -1.23 0.46 116.25 115.75 1gn2 h VAL 37 Ca 0.03 -0.47 -0.09 0.00 0.82 0.00 0.00 66.70 66.99 1gn2 h VAL 37 Cb 0.88 0.16 -0.02 0.00 -1.52 0.00 0.00 31.29 30.80 1gn2 h VAL 37 CO 0.07 0.22 -0.05 0.50 0.02 0.00 0.00 177.57 178.33 1gn2 h LYS 38 N 1.04 0.87 -0.61 1.57 1.63 -1.27 -2.04 116.57 117.75 1gn2 h LYS 38 Ca 0.27 -0.30 -0.02 0.00 -0.85 0.00 0.00 60.65 59.75 1gn2 h LYS 38 Cb -0.04 -0.06 -0.03 0.00 -0.60 0.00 0.00 32.23 31.50 1gn2 h LYS 38 CO -0.05 0.94 0.31 0.78 -3.45 0.00 0.00 179.45 177.97 1gn2 h GLY 39 N 0.71 0.92 0.93 5.01 0.00 -0.73 0.37 103.07 110.27 1gn2 h GLY 39 Ca 0.13 -0.42 -0.06 0.00 0.00 0.00 0.00 47.33 46.97 1gn2 h GLY 39 CO 0.03 0.40 -0.02 0.00 0.00 0.00 0.00 176.54 176.95 1gn2 h ALA 40 N 1.48 0.49 -0.29 3.60 0.00 0.15 -1.20 119.26 123.49 1gn2 h ALA 40 Ca 0.22 -0.26 -0.05 0.00 0.00 0.00 0.00 54.91 54.81 1gn2 h ALA 40 Cb 0.07 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 1gn2 h ALA 40 CO -0.03 0.28 -0.01 -0.91 0.00 0.00 0.00 179.25 178.58 1gn2 h ASN 41 N 0.46 0.51 -0.77 0.00 2.35 -0.94 -2.03 115.58 115.16 1gn2 h ASN 41 Ca 0.10 -0.31 0.05 0.00 -0.55 0.00 0.00 56.30 55.59 1gn2 h ASN 41 Cb 0.50 -0.14 -0.06 0.00 0.05 0.00 0.00 38.32 38.67 1gn2 h ASN 41 CO 0.02 0.70 0.47 0.44 -1.65 0.00 0.00 177.43 177.41 1gn2 h ASP 42 N 0.30 0.73 -0.55 5.81 3.45 -0.86 -1.07 116.42 124.24 1gn2 h ASP 42 Ca 0.08 0.02 0.01 0.00 0.43 0.00 0.00 57.03 57.57 1gn2 h ASP 42 Cb 0.44 -0.13 -0.03 0.00 -0.56 0.00 0.00 39.33 39.05 1gn2 h ASP 42 CO 0.02 0.48 0.35 0.00 -1.57 0.00 0.00 179.24 178.51 1gn2 h ALA 43 N 1.37 0.70 -0.69 3.45 0.00 -0.99 0.19 119.26 123.28 1gn2 h ALA 43 Ca 0.34 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 55.21 1gn2 h ALA 43 Cb 0.15 -0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.70 1gn2 h ALA 43 CO -0.16 0.10 0.41 0.28 0.00 0.00 0.00 179.25 179.88 1gn2 h VAL 44 N 0.71 1.20 -0.40 0.00 2.07 -0.79 -2.66 116.25 116.37 1gn2 h VAL 44 Ca 0.21 -0.45 -0.07 0.00 0.82 0.00 0.00 66.70 67.21 1gn2 h VAL 44 Cb -0.04 0.25 -0.01 0.00 -1.52 0.00 0.00 31.29 29.96 1gn2 h VAL 44 CO -0.06 0.21 -0.01 0.00 0.02 0.00 0.00 177.57 177.73 1gn2 h ALA 45 N 1.21 0.54 -0.59 1.67 0.00 -0.35 -2.73 119.26 119.02 1gn2 h ALA 45 Ca 0.25 -0.26 0.13 0.00 0.00 0.00 0.00 54.91 55.02 1gn2 h ALA 45 Cb -0.02 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.59 1gn2 h ALA 45 CO -0.05 0.33 0.41 0.87 0.00 0.00 0.00 179.25 180.81 1gn2 h LYS 46 N 0.54 0.25 -0.31 0.00 1.79 -0.73 -0.52 116.57 117.58 1gn2 h LYS 46 Ca 0.11 -0.01 -0.08 0.00 -2.18 0.00 0.00 60.65 58.49 1gn2 h LYS 46 Cb 0.49 -0.06 -0.01 0.00 -1.58 0.00 0.00 32.23 31.07 1gn2 h LYS 46 CO 0.02 0.16 -0.11 -0.07 -1.08 0.00 0.00 179.45 178.38 1gn2 h LEU 47 N 0.25 0.64 0.35 2.94 3.38 -1.19 0.15 115.31 121.84 1gn2 h LEU 47 Ca 0.28 -0.38 -0.02 0.00 0.09 0.00 0.00 57.88 57.85 1gn2 h LEU 47 Cb 0.76 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 41.34 1gn2 h LEU 47 CO -0.06 0.88 -0.17 -0.08 0.09 0.00 0.00 178.44 179.10 1gn2 h GLU 48 N 0.39 -0.46 -0.71 1.13 4.81 -0.88 0.30 114.58 119.18 1gn2 h GLU 48 Ca 0.08 0.03 0.06 0.00 -0.13 0.00 0.00 59.36 59.39 1gn2 h GLU 48 Cb 0.62 0.10 -0.04 0.00 0.63 0.00 0.00 28.75 30.06 1gn2 h GLU 48 CO 0.04 -0.30 0.46 1.49 -0.73 0.00 0.00 179.01 179.97 1gn2 h GLU 49 N -0.47 0.74 -0.24 1.92 4.81 -1.10 0.13 114.58 120.36 1gn2 h GLU 49 Ca -0.05 -0.04 -0.13 0.00 -0.13 0.00 0.00 59.36 59.00 1gn2 h GLU 49 Cb 0.36 -0.17 -0.01 0.00 0.63 0.00 0.00 28.75 29.57 1gn2 h GLU 49 CO 0.08 0.49 -0.41 0.00 -0.73 0.00 0.00 179.01 178.44 1gn2 h ALA 50 N 1.61 0.84 -0.41 2.92 0.00 -0.06 -2.44 119.26 121.71 1gn2 h ALA 50 Ca 0.30 -0.44 -0.14 0.00 0.00 0.00 0.00 54.91 54.62 1gn2 h ALA 50 Cb 0.21 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1gn2 h ALA 50 CO -0.10 0.65 -0.31 0.00 0.00 0.00 0.00 179.25 179.49 1gn2 h ARG 51 N 0.47 0.91 -0.03 0.00 3.08 0.88 -1.96 114.38 117.73 1gn2 h ARG 51 Ca 0.04 -0.43 -0.01 0.00 0.07 0.00 0.00 59.98 59.65 1gn2 h ARG 51 Cb 0.91 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.95 1gn2 h ARG 51 CO 0.08 1.08 -0.01 0.00 -1.07 0.00 0.00 179.97 180.05 1gn2 h ALA 52 N 0.88 0.05 0.00 0.04 0.00 -0.72 -2.94 119.26 116.57 1gn2 h ALA 52 Ca 0.08 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1gn2 h ALA 52 Cb 0.88 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.66 1gn2 h ALA 52 CO 0.08 -0.24 0.00 1.63 0.00 0.00 0.00 179.25 180.72 1gn2 n LYS 53 N -4.85 0.16 -3.55 0.00 5.02 -0.93 -4.87 118.16 109.14 1gn2 n LYS 53 Ca -0.08 0.15 -0.19 0.00 -2.02 0.00 0.00 58.31 56.17 1gn2 n LYS 53 Cb 0.22 -1.50 0.06 0.00 -0.02 0.00 0.00 35.03 33.80 1gn2 n LYS 53 CO 0.00 0.00 0.00 0.39 -0.52 0.00 0.00 177.40 177.27 1gn2 n GLU 54 N -1.37 -5.73 -3.46 1.97 1.02 -0.86 -4.97 120.64 107.25 1gn2 n GLU 54 Ca 0.07 0.74 -0.29 0.00 -0.02 0.00 0.00 57.16 57.66 1gn2 n GLU 54 Cb 0.16 -5.54 -0.12 0.00 -0.02 0.00 0.00 31.44 25.92 1gn2 n GLU 54 CO 0.00 0.00 0.00 0.34 1.18 0.00 0.00 177.13 178.65 1gn2 s ASP 55 N -4.34 2.95 -0.49 1.62 2.15 -0.79 -4.99 116.67 112.77 1gn2 s ASP 55 Ca 0.01 -2.19 0.00 0.00 0.43 0.00 0.00 52.55 50.80 1gn2 s ASP 55 Cb -0.00 -0.39 0.44 0.00 -0.30 0.00 0.00 42.92 42.66 1gn2 s ASP 55 CO 0.77 -0.31 1.94 1.41 -0.17 0.00 0.00 175.17 178.81 1gn2 n HIS 56 N 4.04 2.64 0.16 -5.34 8.25 -1.26 -4.56 115.22 119.15 1gn2 n HIS 56 Ca 0.12 -2.32 0.03 0.00 -0.26 0.00 0.00 57.72 55.29 1gn2 n HIS 56 Cb 0.37 -1.13 0.41 0.00 1.12 0.00 0.00 29.99 30.75 1gn2 n HIS 56 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 1gn2 h SER 57 N 1.48 0.11 -0.84 0.41 4.64 -1.95 -2.77 113.55 114.63 1gn2 h SER 57 Ca 0.51 -0.03 -0.47 0.00 -0.47 0.00 0.00 61.79 61.34 1gn2 h SER 57 Cb 1.44 -0.03 -0.26 0.00 -0.31 0.00 0.00 62.40 63.23 1gn2 h SER 57 CO 1.18 0.34 0.46 0.00 -0.87 0.00 0.00 176.83 177.94 1gn2 n ALA 58 N -2.49 5.42 -0.19 5.18 0.00 -1.26 -4.72 120.51 122.44 1gn2 n ALA 58 Ca -0.02 -3.10 0.00 0.00 0.00 0.00 0.00 53.44 50.32 1gn2 n ALA 58 Cb 0.31 -1.29 0.11 0.00 0.00 0.00 0.00 19.45 18.57 1gn2 n ALA 58 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.50 178.47 1gn2 h ILE 59 N 1.05 0.65 -0.92 0.00 6.09 -1.84 -1.04 117.51 121.49 1gn2 h ILE 59 Ca 0.52 -0.09 0.09 0.00 -1.37 0.00 0.00 64.86 64.02 1gn2 h ILE 59 Cb 2.17 0.37 -0.07 0.00 0.47 0.00 0.00 36.82 39.75 1gn2 h ILE 59 CO 1.01 0.05 0.57 0.25 -3.07 0.00 0.00 178.15 176.96 1gn2 h LEU 60 N 0.26 0.85 0.04 2.19 6.46 -1.87 0.12 115.31 123.36 1gn2 h LEU 60 Ca 0.31 0.04 -0.24 0.00 -0.12 0.00 0.00 57.88 57.86 1gn2 h LEU 60 Cb 0.45 -0.14 0.02 0.00 -0.73 0.00 0.00 40.66 40.27 1gn2 h LEU 60 CO -0.39 0.50 -0.97 0.25 -0.62 0.00 0.00 178.44 177.20 1gn2 h LEU 61 N 0.96 0.78 -0.83 2.25 5.85 -1.83 -2.34 115.31 120.16 1gn2 h LEU 61 Ca 0.43 -0.78 -0.08 0.00 0.84 0.00 0.00 57.88 58.30 1gn2 h LEU 61 Cb 0.33 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.10 1gn2 h LEU 61 CO -0.23 1.47 0.05 0.78 -0.34 0.00 0.00 178.44 180.17 1gn2 h ASN 62 N 0.18 0.89 0.69 1.25 -0.26 -0.80 0.55 115.58 118.09 1gn2 h ASN 62 Ca -0.13 -0.21 -0.14 0.00 -0.56 0.00 0.00 56.30 55.25 1gn2 h ASN 62 Cb 1.66 -0.24 -0.02 0.00 -1.06 0.00 0.00 38.32 38.66 1gn2 h ASN 62 CO 0.19 0.92 -0.67 -0.33 -1.06 0.00 0.00 177.43 176.48 1gn2 h GLU 63 N 0.87 0.00 0.00 0.81 4.39 -0.82 -2.47 114.58 117.35 1gn2 h GLU 63 Ca 0.17 0.00 -0.18 0.00 0.34 0.00 0.00 59.36 59.69 1gn2 h GLU 63 Cb 0.44 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 29.07 1gn2 h GLU 63 CO 0.02 0.67 -0.87 -0.22 -1.16 0.00 0.00 179.01 177.45 1gn2 h LYS 64 N 0.00 0.00 -0.10 2.33 3.64 -1.06 -2.51 116.57 118.87 1gn2 h LYS 64 Ca -0.01 0.00 -0.21 0.00 -1.27 0.00 0.00 60.65 59.16 1gn2 h LYS 64 Cb 1.20 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 33.03 1gn2 h LYS 64 CO 0.09 0.87 -0.79 -0.91 -2.27 0.00 0.00 179.45 176.43 1gn2 h ASN 65 N 0.00 0.75 -0.30 4.20 2.35 -0.87 -1.89 115.58 119.82 1gn2 h ASN 65 Ca -0.01 -0.51 -0.03 0.00 -0.55 0.00 0.00 56.30 55.20 1gn2 h ASN 65 Cb 1.65 -0.22 -0.01 0.00 0.05 0.00 0.00 38.32 39.78 1gn2 h ASN 65 CO 0.11 1.29 0.07 0.25 -1.65 0.00 0.00 177.43 177.51 1gn2 h LEU 66 N 0.42 0.45 -0.24 1.61 5.85 -1.46 -1.18 115.31 120.75 1gn2 h LEU 66 Ca -0.05 -0.23 -0.06 0.00 0.84 0.00 0.00 57.88 58.38 1gn2 h LEU 66 Cb 1.41 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 42.31 1gn2 h LEU 66 CO 0.15 0.56 -0.09 0.00 -0.34 0.00 0.00 178.44 178.72 1gn2 h ALA 67 N 0.91 0.34 0.51 1.25 0.00 -1.47 0.27 119.26 121.06 1gn2 h ALA 67 Ca 0.09 -0.29 -0.03 0.00 0.00 0.00 0.00 54.91 54.69 1gn2 h ALA 67 Cb 0.28 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.00 1gn2 h ALA 67 CO 0.00 0.17 -0.25 0.35 0.00 0.00 0.00 179.25 179.52 1gn2 h PHE 68 N 0.22 -0.64 -0.28 0.00 3.57 -1.33 -1.83 116.94 116.64 1gn2 h PHE 68 Ca 0.06 -0.02 -0.12 0.00 3.53 0.00 0.00 57.97 61.42 1gn2 h PHE 68 Cb 0.58 0.21 -0.01 0.00 2.79 0.00 0.00 35.95 39.52 1gn2 h PHE 68 CO 0.06 -0.33 -0.33 -0.91 -2.23 0.00 0.00 178.31 174.57 1gn2 h ASN 69 N -0.86 0.64 0.39 0.41 2.35 -1.29 -0.68 115.58 116.53 1gn2 h ASN 69 Ca -0.07 -0.26 -0.10 0.00 -0.55 0.00 0.00 56.30 55.32 1gn2 h ASN 69 Cb 0.60 -0.18 -0.01 0.00 0.05 0.00 0.00 38.32 38.78 1gn2 h ASN 69 CO 0.12 0.92 -0.44 0.25 -1.65 0.00 0.00 177.43 176.63 1gn2 h LEU 70 N 0.52 0.07 -0.58 1.61 5.85 -0.98 -2.03 115.31 119.77 1gn2 h LEU 70 Ca 0.06 -0.03 -0.15 0.00 0.84 0.00 0.00 57.88 58.59 1gn2 h LEU 70 Cb 0.82 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.82 1gn2 h LEU 70 CO 0.07 0.50 -0.57 0.00 -0.34 0.00 0.00 178.44 178.10 1gn2 h ALA 71 N 1.50 0.76 -0.18 1.25 0.00 -1.01 -0.37 119.26 121.21 1gn2 h ALA 71 Ca 0.00 -0.52 -0.19 0.00 0.00 0.00 0.00 54.91 54.20 1gn2 h ALA 71 Cb 0.80 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.51 1gn2 h ALA 71 CO 0.06 0.70 -0.65 0.78 0.00 0.00 0.00 179.25 180.14 1gn2 h GLY 72 N 1.22 0.74 0.90 0.00 0.00 -0.85 -1.98 103.07 103.10 1gn2 h GLY 72 Ca 0.00 -0.94 -0.01 0.00 0.00 0.00 0.00 47.33 46.38 1gn2 h GLY 72 CO 0.10 0.84 -0.09 0.84 0.00 0.00 0.00 176.54 178.23 1gn2 h HIS 73 N 0.49 -0.24 -0.97 5.60 6.17 -1.23 -0.92 115.15 124.05 1gn2 h HIS 73 Ca -0.01 -0.01 0.08 0.00 0.71 0.00 0.00 60.37 61.14 1gn2 h HIS 73 Cb 1.24 0.08 -0.07 0.00 2.52 0.00 0.00 27.41 31.18 1gn2 h HIS 73 CO 0.06 -0.07 0.63 0.28 0.71 0.00 0.00 177.93 179.54 1gn2 h VAL 74 N -0.36 1.03 0.01 5.26 2.07 -1.06 -0.65 116.25 122.55 1gn2 h VAL 74 Ca -0.03 -0.37 -0.00 0.00 0.82 0.00 0.00 66.70 67.13 1gn2 h VAL 74 Cb 0.28 -0.13 0.00 0.00 -1.52 0.00 0.00 31.29 29.91 1gn2 h VAL 74 CO 0.04 0.19 -0.01 0.78 0.02 0.00 0.00 177.57 178.60 1gn2 h ASN 75 N 1.07 -0.01 0.29 0.57 2.35 -1.08 -2.91 115.58 115.85 1gn2 h ASN 75 Ca 0.44 -0.38 -0.08 0.00 -0.55 0.00 0.00 56.30 55.73 1gn2 h ASN 75 Cb 0.28 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.64 1gn2 h ASN 75 CO -0.19 0.38 -0.34 0.45 -1.65 0.00 0.00 177.43 176.07 1gn2 h HIS 76 N -0.41 0.10 -0.61 1.19 3.86 -1.00 -0.71 115.15 117.56 1gn2 h HIS 76 Ca -0.00 -0.02 0.08 0.00 -1.16 0.00 0.00 60.37 59.27 1gn2 h HIS 76 Cb 0.40 -0.02 -0.06 0.00 1.06 0.00 0.00 27.41 28.78 1gn2 h HIS 76 CO 0.06 0.42 0.27 1.15 0.86 0.00 0.00 177.93 180.70 1gn2 h THR 77 N 0.08 0.84 0.00 2.45 2.02 -1.06 -1.35 112.91 115.89 1gn2 h THR 77 Ca 0.01 -0.17 -0.17 0.00 0.77 0.00 0.00 66.41 66.84 1gn2 h THR 77 Cb 0.65 0.31 -0.02 0.00 -1.74 0.00 0.00 68.15 67.34 1gn2 h THR 77 CO 0.05 0.09 -0.83 0.40 0.37 0.00 0.00 175.52 175.60 1gn2 h ILE 78 N 0.49 1.54 -0.42 3.11 2.04 -1.27 -3.29 117.51 119.72 1gn2 h ILE 78 Ca 0.30 -2.90 -0.05 0.00 1.00 0.00 0.00 64.86 63.20 1gn2 h ILE 78 Cb 0.31 2.59 -0.02 0.00 -0.74 0.00 0.00 36.82 38.96 1gn2 h ILE 78 CO -0.26 0.82 0.06 -0.25 0.00 0.00 0.00 178.15 178.52 1gn2 h TRP 79 N 0.00 0.74 -0.53 1.37 2.91 -0.16 -0.02 115.95 120.26 1gn2 h TRP 79 Ca -0.01 -0.10 0.02 0.00 1.13 0.00 0.00 58.89 59.93 1gn2 h TRP 79 Cb 1.52 -0.20 -0.03 0.00 -0.51 0.00 0.00 29.16 29.94 1gn2 h TRP 79 CO 0.00 0.72 0.35 -1.49 -1.03 0.00 0.00 178.44 176.99 1gn2 h TRP 80 N 0.55 0.63 0.03 2.65 -0.00 -1.37 -2.04 115.95 116.41 1gn2 h TRP 80 Ca 0.13 0.02 -0.21 0.00 -0.00 0.00 0.00 58.89 58.82 1gn2 h TRP 80 Cb 0.38 -0.21 -0.01 0.00 -0.00 0.00 0.00 29.16 29.31 1gn2 h TRP 80 CO 0.03 0.38 -0.98 0.87 -0.00 0.00 0.00 178.44 178.74 1gn2 h LYS 81 N 0.67 0.13 0.00 0.49 1.79 -1.52 -3.11 116.57 115.02 1gn2 h LYS 81 Ca 0.21 -0.18 0.00 0.00 -2.18 0.00 0.00 60.65 58.50 1gn2 h LYS 81 Cb 0.00 0.06 0.00 0.00 -1.58 0.00 0.00 32.23 30.71 1gn2 h LYS 81 CO -0.05 1.00 0.00 0.09 -1.08 0.00 0.00 179.45 179.41 1gn2 n ASN 82 N -3.54 0.00 -4.67 0.86 5.03 -0.06 -4.73 115.26 108.16 1gn2 n ASN 82 Ca -0.03 -0.02 -0.30 0.00 0.87 0.00 0.00 54.58 55.10 1gn2 n ASN 82 Cb 0.88 -0.25 -0.08 0.00 -1.02 0.00 0.00 39.78 39.31 1gn2 n ASN 82 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 1gn2 s LEU 83 N -2.51 3.39 -0.29 3.41 1.43 -1.07 -0.20 118.68 122.86 1gn2 s LEU 83 Ca 0.17 -0.20 -0.22 0.00 -1.03 0.00 0.00 54.13 52.86 1gn2 s LEU 83 Cb 0.11 -2.12 0.13 0.00 0.03 0.00 0.00 46.19 44.35 1gn2 s LEU 83 CO 0.25 0.18 1.03 -0.55 0.23 0.00 0.00 176.35 177.49 1gn2 s SER 84 N -2.22 -0.46 0.57 2.29 0.15 0.18 -4.69 113.70 109.52 1gn2 s SER 84 Ca 0.24 0.82 0.31 0.00 0.70 0.00 0.00 55.95 58.02 1gn2 s SER 84 Cb -0.12 0.97 1.71 0.00 -1.71 0.00 0.00 66.02 66.88 1gn2 s SER 84 CO 0.17 -0.14 2.17 -0.65 1.20 0.00 0.00 173.24 175.99 1gn2 h PRO 85 N 4.88 0.00 -0.46 5.44 0.11 -1.84 -1.70 132.00 138.43 1gn2 h PRO 85 Ca -0.28 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.83 1gn2 h PRO 85 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1gn2 h PRO 85 CO 0.14 0.06 0.00 0.09 -0.21 0.00 0.00 178.00 178.08 1gn2 n ASN 86 N -3.58 4.70 -0.89 -2.05 3.02 -1.26 -4.98 115.26 110.21 1gn2 n ASN 86 Ca -0.02 -2.80 0.00 0.00 -0.03 0.00 0.00 54.58 51.72 1gn2 n ASN 86 Cb 0.17 -0.58 0.00 0.00 -0.61 0.00 0.00 39.78 38.76 1gn2 n ASN 86 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1gn2 n GLY 87 N 0.31 1.32 0.01 7.41 0.00 -0.64 -5.05 105.19 108.56 1gn2 n GLY 87 Ca 0.24 -1.86 0.00 0.00 0.00 0.00 0.00 46.02 44.40 1gn2 n GLY 87 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1gn2 n GLY 88 N 5.00 -2.80 6.84 -0.02 0.00 0.15 -4.79 105.19 109.57 1gn2 n GLY 88 Ca 0.00 -2.08 0.00 0.00 0.00 0.00 0.00 46.02 43.94 1gn2 n GLY 88 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1gn2 n ASP 89 N 0.00 0.00 -4.38 1.61 9.92 -1.26 -4.86 116.55 117.58 1gn2 n ASP 89 Ca 0.00 0.00 -0.19 0.00 -0.53 0.00 0.00 54.79 54.07 1gn2 n ASP 89 Cb 0.00 0.00 -0.10 0.00 -0.64 0.00 0.00 41.12 40.38 1gn2 n ASP 89 CO 0.00 0.00 0.00 -0.54 0.13 0.00 0.00 177.20 176.79 1gn2 s LYS 90 N 0.00 1.46 0.93 -1.24 1.02 -1.26 -5.04 119.74 115.61 1gn2 s LYS 90 Ca 0.00 -1.76 -0.11 0.00 0.02 0.00 0.00 55.97 54.11 1gn2 s LYS 90 Cb 0.00 -0.76 0.15 0.00 -0.52 0.00 0.00 37.83 36.70 1gn2 s LYS 90 CO 0.00 -0.10 1.09 -1.25 -0.92 0.00 0.00 175.35 174.17 1gn2 s PRO 91 N -3.85 0.94 0.06 -1.68 0.04 -1.26 -5.00 135.00 124.25 1gn2 s PRO 91 Ca 0.31 0.97 0.02 0.00 0.04 0.00 0.00 61.00 62.34 1gn2 s PRO 91 Cb 0.06 -1.76 -0.03 0.00 0.04 0.00 0.00 34.50 32.81 1gn2 s PRO 91 CO 0.11 -2.50 -0.08 0.99 0.04 0.00 0.00 177.00 175.57 1gn2 s THR 92 N -2.81 0.60 0.00 1.26 2.01 -1.26 -4.69 115.64 110.75 1gn2 s THR 92 Ca 0.65 -1.32 0.00 0.00 0.31 0.00 0.00 61.69 61.33 1gn2 s THR 92 Cb -0.20 -0.91 0.00 0.00 0.01 0.00 0.00 72.50 71.40 1gn2 s THR 92 CO 0.58 -0.51 0.00 0.61 -0.69 0.00 0.00 174.62 174.61 1gn2 n GLY 93 N 1.05 1.69 0.27 4.40 0.00 -1.26 -3.54 105.19 107.80 1gn2 n GLY 93 Ca -0.20 -0.63 0.05 0.00 0.00 0.00 0.00 46.02 45.24 1gn2 n GLY 93 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1gn2 h GLU 94 N 0.00 0.10 -0.50 1.61 4.39 -1.99 -1.21 114.58 116.99 1gn2 h GLU 94 Ca 0.00 -0.01 -0.00 0.00 0.34 0.00 0.00 59.36 59.69 1gn2 h GLU 94 Cb 0.00 -0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 28.60 1gn2 h GLU 94 CO 0.00 0.07 0.30 1.25 -1.16 0.00 0.00 179.01 179.47 1gn2 h LEU 95 N 0.11 0.60 -0.58 1.33 5.85 -1.92 -0.57 115.31 120.12 1gn2 h LEU 95 Ca 0.40 -0.06 -0.08 0.00 0.84 0.00 0.00 57.88 58.99 1gn2 h LEU 95 Cb 0.70 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.56 1gn2 h LEU 95 CO -0.65 0.49 0.07 0.00 -0.34 0.00 0.00 178.44 178.00 1gn2 h ALA 96 N 1.14 0.77 -0.10 1.25 0.00 -1.36 0.21 119.26 121.18 1gn2 h ALA 96 Ca 0.18 -0.27 -0.09 0.00 0.00 0.00 0.00 54.91 54.73 1gn2 h ALA 96 Cb -0.00 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.56 1gn2 h ALA 96 CO -0.03 0.55 -0.35 0.00 0.00 0.00 0.00 179.25 179.41 1gn2 h ALA 97 N 1.00 1.22 0.61 0.00 0.00 -1.13 -1.28 119.26 119.67 1gn2 h ALA 97 Ca 0.17 -0.36 -0.03 0.00 0.00 0.00 0.00 54.91 54.69 1gn2 h ALA 97 Cb 0.46 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.17 1gn2 h ALA 97 CO 0.02 0.53 -0.29 0.00 0.00 0.00 0.00 179.25 179.51 1gn2 h ALA 98 N 1.46 -0.82 -0.80 0.00 0.00 -0.53 -1.10 119.26 117.47 1gn2 h ALA 98 Ca 0.02 -0.20 0.13 0.00 0.00 0.00 0.00 54.91 54.86 1gn2 h ALA 98 Cb 0.71 0.32 -0.09 0.00 0.00 0.00 0.00 17.79 18.73 1gn2 h ALA 98 CO 0.05 -0.90 0.40 0.82 0.00 0.00 0.00 179.25 179.63 1gn2 h ILE 99 N -0.94 0.75 0.00 0.00 2.04 -0.83 0.14 117.51 118.66 1gn2 h ILE 99 Ca -0.08 -0.20 -0.11 0.00 1.00 0.00 0.00 64.86 65.46 1gn2 h ILE 99 Cb 0.67 0.10 -0.02 0.00 -0.74 0.00 0.00 36.82 36.83 1gn2 h ILE 99 CO 0.14 0.11 -0.51 0.00 0.00 0.00 0.00 178.15 177.88 1gn2 h ALA 100 N 1.53 1.00 0.00 1.87 0.00 -1.18 0.77 119.26 123.24 1gn2 h ALA 100 Ca 0.43 -0.47 -0.16 0.00 0.00 0.00 0.00 54.91 54.71 1gn2 h ALA 100 Cb 0.57 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.26 1gn2 h ALA 100 CO -0.34 0.64 -0.77 0.22 0.00 0.00 0.00 179.25 179.00 1gn2 h ASP 101 N 0.00 0.00 0.51 0.00 3.58 0.31 -0.20 116.42 120.63 1gn2 h ASP 101 Ca -0.01 0.00 -0.17 0.00 0.42 0.00 0.00 57.03 57.27 1gn2 h ASP 101 Cb 1.00 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 42.02 1gn2 h ASP 101 CO 0.07 0.77 -1.63 0.00 -2.88 0.00 0.00 179.24 175.57 1gn2 n ALA 102 N -2.33 1.98 -0.97 -0.78 0.00 0.29 -4.29 120.51 114.40 1gn2 n ALA 102 Ca 0.00 -0.65 0.08 0.00 0.00 0.00 0.00 53.44 52.87 1gn2 n ALA 102 Cb 0.80 -0.82 0.12 0.00 0.00 0.00 0.00 19.45 19.55 1gn2 n ALA 102 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1gn2 n PHE 103 N -2.79 0.00 0.00 0.00 3.72 0.25 -5.00 117.46 113.64 1gn2 n PHE 103 Ca -0.12 -0.89 0.00 0.00 -0.05 0.00 0.00 57.45 56.39 1gn2 n PHE 103 Cb 0.85 -0.13 0.00 0.00 -0.94 0.00 0.00 39.48 39.26 1gn2 n PHE 103 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1gn2 n GLY 104 N -1.25 1.11 3.53 1.37 0.00 -0.09 -3.99 105.19 105.86 1gn2 n GLY 104 Ca 0.13 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.05 1gn2 n GLY 104 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1gn2 s SER 105 N 0.00 -0.40 0.52 1.61 1.04 -1.21 -4.68 113.70 110.58 1gn2 s SER 105 Ca 0.00 0.22 0.17 0.00 0.48 0.00 0.00 55.95 56.81 1gn2 s SER 105 Cb 0.00 0.37 1.27 0.00 0.10 0.00 0.00 66.02 67.76 1gn2 s SER 105 CO 0.00 -0.52 2.13 0.15 0.98 0.00 0.00 173.24 175.97 1gn2 h PHE 106 N 2.30 0.02 -0.30 5.02 3.57 -1.88 -1.11 116.94 124.56 1gn2 h PHE 106 Ca -0.21 0.00 -0.13 0.00 3.53 0.00 0.00 57.97 61.15 1gn2 h PHE 106 Cb 1.20 -0.01 -0.01 0.00 2.79 0.00 0.00 35.95 39.93 1gn2 h PHE 106 CO 0.28 0.01 -0.36 -0.44 -2.23 0.00 0.00 178.31 175.57 1gn2 h ASP 107 N 0.02 0.72 0.65 0.41 3.32 -1.95 -2.09 116.42 117.50 1gn2 h ASP 107 Ca 0.04 -0.31 -0.15 0.00 0.02 0.00 0.00 57.03 56.63 1gn2 h ASP 107 Cb 0.12 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 39.45 1gn2 h ASP 107 CO -0.00 1.01 -0.69 0.11 -1.72 0.00 0.00 179.24 177.95 1gn2 h LYS 108 N 0.57 0.03 -0.06 3.56 1.57 -1.48 -1.84 116.57 118.93 1gn2 h LYS 108 Ca 0.06 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.80 1gn2 h LYS 108 Cb 0.88 0.01 -0.00 0.00 0.08 0.00 0.00 32.23 33.20 1gn2 h LYS 108 CO 0.08 0.71 0.01 0.35 -0.57 0.00 0.00 179.45 180.02 1gn2 h PHE 109 N 0.02 0.10 0.00 -1.35 3.57 -1.23 -2.50 116.94 115.55 1gn2 h PHE 109 Ca -0.01 -0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.46 1gn2 h PHE 109 Cb 1.21 -0.03 -0.00 0.00 2.79 0.00 0.00 35.95 39.92 1gn2 h PHE 109 CO 0.00 0.31 -0.09 -0.09 -2.23 0.00 0.00 178.31 176.21 1gn2 h ARG 110 N -0.14 0.00 0.06 1.11 2.43 -1.30 0.06 114.38 116.60 1gn2 h ARG 110 Ca 0.02 0.00 -0.25 0.00 -0.81 0.00 0.00 59.98 58.93 1gn2 h ARG 110 Cb 0.26 0.00 0.01 0.00 -0.42 0.00 0.00 29.97 29.82 1gn2 h ARG 110 CO 0.00 0.09 -1.09 0.00 -1.51 0.00 0.00 179.97 177.46 1gn2 h ALA 111 N 1.91 0.22 0.06 2.80 0.00 -0.96 -2.80 119.26 120.49 1gn2 h ALA 111 Ca -0.00 -0.77 -0.00 0.00 0.00 0.00 0.00 54.91 54.13 1gn2 h ALA 111 Cb 0.20 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.01 1gn2 h ALA 111 CO 0.01 0.84 -0.03 0.37 0.00 0.00 0.00 179.25 180.44 1gn2 h GLN 112 N 0.19 -0.08 -1.01 0.00 4.15 -0.98 -1.99 115.11 115.39 1gn2 h GLN 112 Ca -0.12 0.01 0.12 0.00 0.77 0.00 0.00 58.65 59.43 1gn2 h GLN 112 Cb 1.76 0.02 -0.08 0.00 0.21 0.00 0.00 27.48 29.38 1gn2 h GLN 112 CO 0.19 0.25 0.64 0.35 -1.93 0.00 0.00 178.83 178.32 1gn2 h PHE 113 N -0.42 1.15 -0.68 3.99 3.57 -1.09 -0.38 116.94 123.08 1gn2 h PHE 113 Ca -0.01 0.03 -0.07 0.00 3.53 0.00 0.00 57.97 61.45 1gn2 h PHE 113 Cb 0.37 -0.37 -0.03 0.00 2.79 0.00 0.00 35.95 38.72 1gn2 h PHE 113 CO 0.04 0.46 0.13 1.25 -2.23 0.00 0.00 178.31 177.96 1gn2 h HIS 114 N 1.01 1.17 -0.25 0.41 2.76 -1.42 -1.75 115.15 117.08 1gn2 h HIS 114 Ca 0.50 -0.15 -0.01 0.00 -2.20 0.00 0.00 60.37 58.50 1gn2 h HIS 114 Cb 0.48 -0.33 -0.01 0.00 1.55 0.00 0.00 27.41 29.10 1gn2 h HIS 114 CO -0.00 0.97 0.13 0.00 -1.30 0.00 0.00 177.93 177.72 1gn2 h ALA 115 N 1.06 0.33 -0.61 5.26 0.00 -0.36 -1.88 119.26 123.07 1gn2 h ALA 115 Ca 0.21 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.03 1gn2 h ALA 115 Cb 0.41 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.07 1gn2 h ALA 115 CO 0.01 -0.12 0.37 0.00 0.00 0.00 0.00 179.25 179.51 1gn2 h ALA 116 N 0.99 1.50 0.06 0.00 0.00 -0.94 -2.63 119.26 118.24 1gn2 h ALA 116 Ca 0.09 -0.07 -0.26 0.00 0.00 0.00 0.00 54.91 54.67 1gn2 h ALA 116 Cb 0.11 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1gn2 h ALA 116 CO -0.01 0.43 -1.24 0.00 0.00 0.00 0.00 179.25 178.43 1gn2 h ALA 117 N 1.57 0.30 -0.00 0.00 0.00 -1.13 -3.34 119.26 116.66 1gn2 h ALA 117 Ca 0.22 -0.99 0.00 0.00 0.00 0.00 0.00 54.91 54.13 1gn2 h ALA 117 Cb -0.03 0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1gn2 h ALA 117 CO -0.04 1.18 -0.08 0.25 0.00 0.00 0.00 179.25 180.55 1gn2 n THR 118 N -3.40 0.00 -0.19 0.00 -2.24 -0.72 -3.85 114.28 103.89 1gn2 n THR 118 Ca -0.07 -0.02 0.06 0.00 -2.27 0.00 0.00 64.05 61.74 1gn2 n THR 118 Cb 1.00 -0.27 0.16 0.00 -2.10 0.00 0.00 70.33 69.12 1gn2 n THR 118 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1gn2 n THR 119 N -1.20 1.00 -1.73 4.28 -2.24 -1.01 -5.02 114.28 108.36 1gn2 n THR 119 Ca 0.13 -1.00 -0.42 0.00 -2.27 0.00 0.00 64.05 60.49 1gn2 n THR 119 Cb 0.28 0.50 -0.00 0.00 -2.10 0.00 0.00 70.33 69.01 1gn2 n THR 119 CO 0.00 0.00 0.00 0.52 -0.57 0.00 0.00 175.07 175.02 1gn2 n VAL 120 N 0.60 2.08 -3.26 2.28 0.31 -1.25 -4.88 118.33 114.20 1gn2 n VAL 120 Ca 0.12 -0.50 -0.45 0.00 -0.01 0.00 0.00 64.34 63.50 1gn2 n VAL 120 Cb 0.44 -1.75 -0.01 0.00 -0.91 0.00 0.00 33.84 31.61 1gn2 n VAL 120 CO 0.00 0.00 0.00 -1.10 -1.32 0.00 0.00 176.83 174.41 1gn2 s GLN 121 N -2.03 3.98 0.00 5.55 -0.21 -1.26 -4.84 119.66 120.86 1gn2 s GLN 121 Ca 0.55 -2.84 0.00 0.00 0.02 0.00 0.00 55.36 53.10 1gn2 s GLN 121 Cb -0.52 -4.60 0.00 0.00 1.00 0.00 0.00 33.01 28.89 1gn2 s GLN 121 CO 0.62 -1.35 0.00 0.41 -2.12 0.00 0.00 175.29 172.85 1gn2 n GLY 122 N 3.41 0.14 3.69 3.09 0.00 -1.26 -5.00 105.19 109.27 1gn2 n GLY 122 Ca 0.23 -1.73 -0.35 0.00 0.00 0.00 0.00 46.02 44.17 1gn2 n GLY 122 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1gn2 n GLY 124 N 1.97 0.98 3.33 0.00 0.00 -1.26 0.11 105.19 110.32 1gn2 n GLY 124 Ca -0.18 -0.69 -0.13 0.00 0.00 0.00 0.00 46.02 45.03 1gn2 n GLY 124 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1gn2 s TRP 125 N -2.51 1.04 -0.10 1.61 0.52 -0.40 -0.89 118.94 118.22 1gn2 s TRP 125 Ca 0.00 -1.26 0.02 0.00 0.02 0.00 0.00 56.10 54.88 1gn2 s TRP 125 Cb 0.00 -0.36 -0.01 0.00 -1.15 0.00 0.00 33.47 31.95 1gn2 s TRP 125 CO 0.00 -0.80 -0.17 0.00 0.02 0.00 0.00 176.95 176.00 1gn2 s ALA 126 N -3.92 2.49 0.00 0.98 0.00 -0.66 -1.35 121.76 119.30 1gn2 s ALA 126 Ca 0.35 -0.94 -0.01 0.00 0.00 0.00 0.00 51.96 51.36 1gn2 s ALA 126 Cb 0.04 -1.04 -0.01 0.00 0.00 0.00 0.00 23.12 22.12 1gn2 s ALA 126 CO 0.14 0.33 0.01 0.00 0.00 0.00 0.00 175.76 176.24 1gn2 s ALA 127 N 0.11 -0.01 -0.18 0.00 0.00 -0.41 -1.23 121.76 120.04 1gn2 s ALA 127 Ca -0.08 -0.17 -0.08 0.00 0.00 0.00 0.00 51.96 51.63 1gn2 s ALA 127 Cb -0.15 0.03 -0.04 0.00 0.00 0.00 0.00 23.12 22.96 1gn2 s ALA 127 CO 0.05 -0.07 0.08 -1.17 0.00 0.00 0.00 175.76 174.65 1gn2 s LEU 128 N -0.57 3.96 0.25 0.00 2.96 0.81 -0.37 118.68 125.71 1gn2 s LEU 128 Ca -0.06 0.16 0.00 0.00 -0.22 0.00 0.00 54.13 54.01 1gn2 s LEU 128 Cb -0.04 -2.00 -0.03 0.00 0.50 0.00 0.00 46.19 44.62 1gn2 s LEU 128 CO -0.00 0.21 0.22 -0.83 -1.32 0.00 0.00 176.35 174.63 1gn2 s GLY 129 N 0.17 1.61 -0.19 7.98 0.00 0.11 -0.96 107.32 116.04 1gn2 s GLY 129 Ca 0.06 -1.72 -0.04 0.00 0.00 0.00 0.00 44.72 43.02 1gn2 s GLY 129 CO -0.00 -1.33 -0.03 0.86 0.00 0.00 0.00 173.10 172.61 1gn2 s TRP 130 N -3.88 3.01 -0.29 1.90 -0.11 0.20 -1.08 118.94 118.68 1gn2 s TRP 130 Ca 0.38 -0.51 -0.19 0.00 1.22 0.00 0.00 56.10 57.00 1gn2 s TRP 130 Cb 0.05 -2.04 -0.02 0.00 -1.50 0.00 0.00 33.47 29.96 1gn2 s TRP 130 CO 0.17 -0.24 0.57 0.34 -4.62 0.00 0.00 176.95 173.17 1gn2 s ASP 131 N 0.87 6.45 0.28 5.86 2.15 0.13 -1.06 116.67 131.35 1gn2 s ASP 131 Ca -0.00 0.40 0.15 0.00 0.43 0.00 0.00 52.55 53.52 1gn2 s ASP 131 Cb -0.14 -2.30 0.20 0.00 -0.30 0.00 0.00 42.92 40.37 1gn2 s ASP 131 CO 0.02 -0.41 1.50 0.71 -0.17 0.00 0.00 175.17 176.82 1gn2 h THR 132 N 5.50 0.99 -0.17 1.71 1.35 -1.87 0.47 112.91 120.88 1gn2 h THR 132 Ca -0.28 -2.19 -0.02 0.00 -0.55 0.00 0.00 66.41 63.37 1gn2 h THR 132 Cb 1.13 2.34 -0.01 0.00 -1.73 0.00 0.00 68.15 69.89 1gn2 h THR 132 CO 0.76 0.53 0.05 0.25 -0.25 0.00 0.00 175.52 176.86 1gn2 h LEU 133 N 0.00 0.26 -1.72 3.87 5.85 -1.92 -3.23 115.31 118.42 1gn2 h LEU 133 Ca -0.01 -0.22 0.00 0.00 0.84 0.00 0.00 57.88 58.50 1gn2 h LEU 133 Cb 1.30 -0.07 0.00 0.00 0.37 0.00 0.00 40.66 42.26 1gn2 h LEU 133 CO 0.07 0.41 0.00 0.61 -0.34 0.00 0.00 178.44 179.19 1gn2 n GLY 134 N -0.56 0.42 3.53 3.75 0.00 -1.24 -5.00 105.19 106.09 1gn2 n GLY 134 Ca -0.04 -0.52 -0.23 0.00 0.00 0.00 0.00 46.02 45.22 1gn2 n GLY 134 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1gn2 n ASN 135 N 1.02 -5.87 -4.03 1.61 5.03 0.16 -5.00 115.26 108.18 1gn2 n ASN 135 Ca 0.11 -0.82 -0.08 0.00 0.87 0.00 0.00 54.58 54.66 1gn2 n ASN 135 Cb 0.46 -3.75 -0.11 0.00 -1.02 0.00 0.00 39.78 35.36 1gn2 n ASN 135 CO 0.00 0.00 0.00 -0.54 -1.83 0.00 0.00 177.26 174.89 1gn2 s LYS 136 N -5.16 0.44 -0.17 3.52 1.02 -0.95 -4.95 119.74 113.48 1gn2 s LYS 136 Ca 0.35 -0.86 -0.17 0.00 0.02 0.00 0.00 55.97 55.30 1gn2 s LYS 136 Cb -0.11 0.14 -0.04 0.00 -0.52 0.00 0.00 37.83 37.30 1gn2 s LYS 136 CO 0.83 -0.07 0.43 -0.51 -0.92 0.00 0.00 175.35 175.11 1gn2 s LEU 137 N -2.06 4.20 0.04 3.17 1.43 -1.26 0.23 118.68 124.42 1gn2 s LEU 137 Ca -0.06 0.63 -0.02 0.00 -1.03 0.00 0.00 54.13 53.65 1gn2 s LEU 137 Cb -0.03 -2.59 -0.02 0.00 0.03 0.00 0.00 46.19 43.58 1gn2 s LEU 137 CO -0.05 -0.06 0.01 -0.76 0.23 0.00 0.00 176.35 175.73 1gn2 s LEU 138 N 1.08 2.17 -0.14 1.79 1.43 -0.24 -4.97 118.68 119.80 1gn2 s LEU 138 Ca 0.22 -0.69 -0.04 0.00 -1.03 0.00 0.00 54.13 52.59 1gn2 s LEU 138 Cb -0.15 0.32 -0.03 0.00 0.03 0.00 0.00 46.19 46.35 1gn2 s LEU 138 CO 0.08 -0.48 0.02 -0.63 0.23 0.00 0.00 176.35 175.57 1gn2 s ILE 139 N -2.74 4.39 0.22 -0.59 1.01 -1.26 0.04 121.20 122.28 1gn2 s ILE 139 Ca -0.04 -0.19 0.11 0.00 0.00 0.00 0.00 60.65 60.53 1gn2 s ILE 139 Cb -0.01 -2.92 -0.05 0.00 0.01 0.00 0.00 42.46 39.50 1gn2 s ILE 139 CO -0.05 0.52 -0.21 -0.36 0.00 0.00 0.00 174.94 174.84 1gn2 s PHE 140 N -0.08 2.16 -0.44 3.97 0.08 0.50 -4.97 117.98 119.20 1gn2 s PHE 140 Ca 0.04 -0.39 -0.02 0.00 0.12 0.00 0.00 56.93 56.69 1gn2 s PHE 140 Cb -0.13 -1.01 0.12 0.00 -0.57 0.00 0.00 43.02 41.43 1gn2 s PHE 140 CO 0.02 0.55 0.22 -1.14 -0.10 0.00 0.00 175.22 174.77 1gn2 s GLN 141 N -3.12 2.02 0.12 0.44 0.74 -1.26 -1.29 119.66 117.31 1gn2 s GLN 141 Ca 0.24 -1.98 -0.30 0.00 0.05 0.00 0.00 55.36 53.36 1gn2 s GLN 141 Cb -0.06 -3.55 -0.07 0.00 1.10 0.00 0.00 33.01 30.44 1gn2 s GLN 141 CO 0.11 -1.07 1.14 0.08 -0.55 0.00 0.00 175.29 174.99 1gn2 s VAL 142 N 0.84 3.98 -0.15 1.34 1.01 -0.46 -4.74 120.40 122.23 1gn2 s VAL 142 Ca 0.10 1.56 -0.08 0.00 0.00 0.00 0.00 61.98 63.56 1gn2 s VAL 142 Cb -0.22 -4.00 -0.04 0.00 0.00 0.00 0.00 36.38 32.12 1gn2 s VAL 142 CO -0.04 0.20 0.13 -0.31 0.00 0.00 0.00 175.10 175.08 1gn2 s TYR 143 N 0.37 3.51 0.00 5.22 2.02 0.17 -1.27 117.35 127.37 1gn2 s TYR 143 Ca 0.53 0.43 0.00 0.00 -0.37 0.00 0.00 57.07 57.67 1gn2 s TYR 143 Cb -0.29 -2.02 0.00 0.00 -0.40 0.00 0.00 41.96 39.25 1gn2 s TYR 143 CO 0.32 0.55 0.00 -0.25 -1.57 0.00 0.00 175.55 174.60 1gn2 n ASP 144 N 2.61 0.00 0.00 2.29 8.00 0.30 -2.52 116.55 127.23 1gn2 n ASP 144 Ca -0.18 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.32 1gn2 n ASP 144 Cb 0.54 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.64 1gn2 n ASP 144 CO 0.00 0.00 0.00 1.41 -0.39 0.00 0.00 177.20 178.22 1gn2 n HIS 145 N 1.73 0.00 -1.58 1.24 8.25 -1.26 -4.31 115.22 119.29 1gn2 n HIS 145 Ca 0.00 0.00 -0.03 0.00 -0.26 0.00 0.00 57.72 57.43 1gn2 n HIS 145 Cb 0.00 0.00 0.18 0.00 1.12 0.00 0.00 29.99 31.29 1gn2 n HIS 145 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1gn2 n GLN 146 N -0.48 1.96 -3.96 -0.41 0.00 -1.24 -4.79 117.38 108.46 1gn2 n GLN 146 Ca 0.00 -3.36 -0.09 0.00 0.00 0.00 0.00 57.00 53.55 1gn2 n GLN 146 Cb 0.03 -1.81 -0.11 0.00 0.00 0.00 0.00 30.24 28.35 1gn2 n GLN 146 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.06 178.05 1gn2 s THR 147 N -3.44 0.10 0.00 -0.39 2.01 -1.05 -4.94 115.64 107.92 1gn2 s THR 147 Ca 0.43 -0.79 0.00 0.00 0.31 0.00 0.00 61.69 61.65 1gn2 s THR 147 Cb 0.40 -0.24 0.00 0.00 0.01 0.00 0.00 72.50 72.66 1gn2 s THR 147 CO -0.03 -0.43 0.00 -3.20 -0.69 0.00 0.00 174.62 170.27 1gn2 n ASN 148 N 1.77 -0.82 -3.51 3.53 5.15 -1.26 -0.66 115.26 119.46 1gn2 n ASN 148 Ca -0.22 0.00 -0.12 0.00 -0.60 0.00 0.00 54.58 53.64 1gn2 n ASN 148 Cb 0.56 -0.25 -0.04 0.00 -0.53 0.00 0.00 39.78 39.52 1gn2 n ASN 148 CO 0.00 0.00 0.00 0.72 1.40 0.00 0.00 177.26 179.38 1gn2 s PHE 149 N -2.32 -0.46 0.74 1.20 -0.71 -1.26 -4.52 117.98 110.64 1gn2 s PHE 149 Ca 0.00 0.57 -0.11 0.00 -1.04 0.00 0.00 56.93 56.35 1gn2 s PHE 149 Cb 0.00 0.49 0.03 0.00 -1.21 0.00 0.00 43.02 42.33 1gn2 s PHE 149 CO 0.00 -0.55 1.07 -1.25 -1.34 0.00 0.00 175.22 173.15 1gn2 s PRO 150 N -2.21 2.57 0.61 1.99 0.05 -1.26 -5.04 135.00 131.72 1gn2 s PRO 150 Ca -0.01 0.98 -0.16 0.00 0.05 0.00 0.00 61.00 61.86 1gn2 s PRO 150 Cb -0.01 -1.95 -0.03 0.00 0.05 0.00 0.00 34.50 32.57 1gn2 s PRO 150 CO -0.02 -1.37 1.08 -0.51 0.05 0.00 0.00 177.00 176.23 1gn2 s LEU 151 N -5.72 3.49 -0.76 -3.56 1.43 -1.26 -3.69 118.68 108.61 1gn2 s LEU 151 Ca 0.59 1.92 0.00 0.00 -1.03 0.00 0.00 54.13 55.61 1gn2 s LEU 151 Cb -0.15 -4.54 0.00 0.00 0.03 0.00 0.00 46.19 41.52 1gn2 s LEU 151 CO 0.55 -1.33 0.00 0.61 0.23 0.00 0.00 176.35 176.41 1gn2 n GLY 152 N -0.70 0.88 3.73 -3.19 0.00 -1.26 -5.00 105.19 99.65 1gn2 n GLY 152 Ca 0.10 -0.33 -0.40 0.00 0.00 0.00 0.00 46.02 45.39 1gn2 n GLY 152 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1gn2 s ILE 153 N -2.07 4.94 -0.19 -0.61 -1.09 -1.24 -4.40 121.20 116.53 1gn2 s ILE 153 Ca 0.00 1.53 -0.20 0.00 -2.23 0.00 0.00 60.65 59.75 1gn2 s ILE 153 Cb 0.00 -4.07 -0.03 0.00 -1.58 0.00 0.00 42.46 36.78 1gn2 s ILE 153 CO 0.00 0.28 0.57 -0.69 -1.23 0.00 0.00 174.94 173.87 1gn2 s VAL 154 N 0.53 5.07 0.11 2.92 1.01 -0.22 -4.84 120.40 124.97 1gn2 s VAL 154 Ca 0.38 1.06 -0.30 0.00 0.00 0.00 0.00 61.98 63.13 1gn2 s VAL 154 Cb -0.19 -3.89 -0.06 0.00 0.00 0.00 0.00 36.38 32.24 1gn2 s VAL 154 CO 0.20 0.15 1.12 -2.16 0.00 0.00 0.00 175.10 174.41 1gn2 s PRO 155 N 1.72 4.53 -0.08 2.72 0.04 -1.26 0.60 135.00 143.26 1gn2 s PRO 155 Ca 0.26 1.70 -0.05 0.00 0.04 0.00 0.00 61.00 62.95 1gn2 s PRO 155 Cb -0.16 -3.33 -0.04 0.00 0.04 0.00 0.00 34.50 31.02 1gn2 s PRO 155 CO 0.10 -0.06 -0.12 1.28 0.04 0.00 0.00 177.00 178.24 1gn2 n LEU 156 N 3.15 0.73 -3.86 -3.56 4.77 -0.14 -4.93 117.00 113.17 1gn2 n LEU 156 Ca 0.05 0.12 -0.13 0.00 -0.03 0.00 0.00 56.01 56.03 1gn2 n LEU 156 Cb 0.47 -0.29 -0.14 0.00 -2.33 0.00 0.00 43.42 41.12 1gn2 n LEU 156 CO 0.54 0.11 -0.36 -0.22 -1.33 0.00 0.00 177.39 176.13 1gn2 s LEU 157 N -6.59 1.90 0.08 2.23 2.96 -1.17 -4.59 118.68 113.50 1gn2 s LEU 157 Ca -0.13 -0.00 0.03 0.00 -0.22 0.00 0.00 54.13 53.81 1gn2 s LEU 157 Cb 0.05 -0.02 -0.03 0.00 0.50 0.00 0.00 46.19 46.68 1gn2 s LEU 157 CO 0.16 -0.01 -0.09 -0.76 -1.32 0.00 0.00 176.35 174.33 1gn2 s LEU 158 N 0.11 2.37 -0.19 -0.68 1.43 -1.26 -0.14 118.68 120.33 1gn2 s LEU 158 Ca -0.01 -0.76 -0.02 0.00 -1.03 0.00 0.00 54.13 52.31 1gn2 s LEU 158 Cb -0.02 -0.21 0.06 0.00 0.03 0.00 0.00 46.19 46.05 1gn2 s LEU 158 CO -0.00 -0.28 0.02 -0.22 0.23 0.00 0.00 176.35 176.09 1gn2 s LEU 159 N -2.26 1.33 -0.29 1.79 2.96 -0.37 -4.92 118.68 116.92 1gn2 s LEU 159 Ca 0.01 -0.80 -0.29 0.00 -0.22 0.00 0.00 54.13 52.84 1gn2 s LEU 159 Cb -0.04 -0.68 -0.02 0.00 0.50 0.00 0.00 46.19 45.96 1gn2 s LEU 159 CO -0.01 -0.28 1.78 -0.62 -1.32 0.00 0.00 176.35 175.90 1gn2 s ASP 160 N 1.80 6.00 0.00 3.68 -1.08 -1.26 -1.65 116.67 124.15 1gn2 s ASP 160 Ca -0.01 1.44 0.23 0.00 -0.52 0.00 0.00 52.55 53.69 1gn2 s ASP 160 Cb -0.17 -2.53 0.47 0.00 -1.46 0.00 0.00 42.92 39.24 1gn2 s ASP 160 CO -0.07 -1.60 1.42 0.23 0.52 0.00 0.00 175.17 175.67 1gn2 n MET 161 N 8.25 2.37 -2.10 4.34 2.81 -0.06 -4.82 117.12 127.91 1gn2 n MET 161 Ca 0.22 -2.07 -0.35 0.00 -1.81 0.00 0.00 57.70 53.69 1gn2 n MET 161 Cb 0.46 -1.49 0.02 0.00 -0.71 0.00 0.00 33.22 31.50 1gn2 n MET 161 CO 0.00 0.00 0.00 -1.58 1.51 0.00 0.00 175.97 175.90 1gn2 s TRP 162 N -1.57 2.56 0.45 2.03 0.52 -1.14 -4.44 118.94 117.35 1gn2 s TRP 162 Ca 0.37 1.54 0.14 0.00 0.02 0.00 0.00 56.10 58.17 1gn2 s TRP 162 Cb 0.22 -3.33 1.06 0.00 -1.15 0.00 0.00 33.47 30.26 1gn2 s TRP 162 CO 0.31 -1.80 2.01 0.93 0.02 0.00 0.00 176.95 178.42 1gn2 h GLU 163 N 0.92 0.34 0.00 4.98 5.08 -1.93 -0.44 114.58 123.54 1gn2 h GLU 163 Ca -0.50 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 57.84 1gn2 h GLU 163 Cb 1.27 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.44 1gn2 h GLU 163 CO 0.56 0.23 0.00 -2.39 -1.00 0.00 0.00 179.01 176.41 1gn2 n HIS 164 N -4.47 0.79 1.30 4.33 1.44 -1.26 -0.87 115.22 116.47 1gn2 n HIS 164 Ca 0.07 0.38 0.14 0.00 -2.01 0.00 0.00 57.72 56.31 1gn2 n HIS 164 Cb 0.30 -1.12 0.65 0.00 0.12 0.00 0.00 29.99 29.95 1gn2 n HIS 164 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 1gn2 n ALA 165 N -1.79 2.60 -1.32 1.59 0.00 -0.17 -4.55 120.51 116.87 1gn2 n ALA 165 Ca -0.01 -0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.25 1gn2 n ALA 165 Cb 0.08 -1.42 0.00 0.00 0.00 0.00 0.00 19.45 18.12 1gn2 n ALA 165 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.50 179.47 1gn2 n PHE 166 N -1.26 0.00 -0.32 0.00 1.16 -0.76 -4.98 117.46 111.30 1gn2 n PHE 166 Ca 0.12 0.00 0.03 0.00 -1.87 0.00 0.00 57.45 55.73 1gn2 n PHE 166 Cb 0.28 0.02 0.17 0.00 -1.61 0.00 0.00 39.48 38.34 1gn2 n PHE 166 CO 0.00 0.00 0.00 -0.92 -1.87 0.00 0.00 176.76 173.97 1gn2 h TYR 167 N 0.00 0.99 -0.94 2.97 3.20 -1.21 0.15 116.97 122.15 1gn2 h TYR 167 Ca 0.00 0.03 0.05 0.00 3.14 0.00 0.00 58.73 61.95 1gn2 h TYR 167 Cb 0.20 -0.32 -0.06 0.00 1.54 0.00 0.00 36.73 38.10 1gn2 h TYR 167 CO 0.00 0.46 0.60 -0.07 -1.64 0.00 0.00 178.16 177.51 1gn2 h LEU 168 N 0.94 0.98 0.04 2.82 3.38 -1.89 0.96 115.31 122.55 1gn2 h LEU 168 Ca 0.41 0.00 -0.38 0.00 0.09 0.00 0.00 57.88 58.00 1gn2 h LEU 168 Cb 0.28 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 40.77 1gn2 h LEU 168 CO -0.21 0.65 -2.31 1.67 0.09 0.00 0.00 178.44 178.33 1gn2 n GLN 169 N -4.53 0.69 0.00 1.13 7.27 -0.76 -4.55 117.38 116.63 1gn2 n GLN 169 Ca 0.13 0.19 0.11 0.00 0.07 0.00 0.00 57.00 57.50 1gn2 n GLN 169 Cb 0.14 -1.59 -0.01 0.00 2.41 0.00 0.00 30.24 31.20 1gn2 n GLN 169 CO 0.00 0.00 0.00 0.66 0.07 0.00 0.00 177.06 177.79 1gn2 n TYR 170 N -3.32 0.00 -0.31 3.69 4.01 0.47 -5.05 117.16 116.65 1gn2 n TYR 170 Ca -0.41 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.33 1gn2 n TYR 170 Cb 1.01 -0.02 0.00 0.00 -0.31 0.00 0.00 39.34 40.03 1gn2 n TYR 170 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 1gn2 n LYS 171 N -0.55 0.00 0.00 -0.72 5.02 0.33 -1.35 118.16 120.89 1gn2 n LYS 171 Ca 0.08 0.00 0.14 0.00 -2.02 0.00 0.00 58.31 56.51 1gn2 n LYS 171 Cb 0.42 0.00 0.60 0.00 -0.02 0.00 0.00 35.03 36.02 1gn2 n LYS 171 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 1gn2 n ASN 172 N 4.29 0.43 -2.36 4.39 6.94 -1.26 -4.37 115.26 123.32 1gn2 n ASN 172 Ca 0.00 -0.47 -0.12 0.00 -0.02 0.00 0.00 54.58 53.97 1gn2 n ASN 172 Cb 0.00 -0.09 -0.10 0.00 -2.36 0.00 0.00 39.78 37.23 1gn2 n ASN 172 CO 0.00 0.00 0.00 0.52 -1.03 0.00 0.00 177.26 176.75 1gn2 n VAL 173 N -1.03 2.31 0.25 3.53 0.31 -0.46 -4.65 118.33 118.58 1gn2 n VAL 173 Ca 0.13 -1.21 0.16 0.00 -0.01 0.00 0.00 64.34 63.42 1gn2 n VAL 173 Cb 0.28 -1.94 0.74 0.00 -0.91 0.00 0.00 33.84 32.02 1gn2 n VAL 173 CO 0.00 0.00 0.00 0.07 -1.32 0.00 0.00 176.83 175.58 1gn2 h LYS 174 N 4.27 0.00 -0.23 5.55 2.10 -1.81 0.02 116.57 126.46 1gn2 h LYS 174 Ca 0.23 0.00 -0.08 0.00 -2.00 0.00 0.00 60.65 58.80 1gn2 h LYS 174 Cb 0.90 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 32.22 1gn2 h LYS 174 CO 0.55 0.00 -0.19 0.28 -2.00 0.00 0.00 179.45 178.09 1gn2 h VAL 175 N 0.00 1.24 -0.23 0.07 2.07 -1.96 -2.30 116.25 115.14 1gn2 h VAL 175 Ca 0.07 -1.10 -0.07 0.00 0.82 0.00 0.00 66.70 66.42 1gn2 h VAL 175 Cb 0.92 1.28 -0.01 0.00 -1.52 0.00 0.00 31.29 31.96 1gn2 h VAL 175 CO -0.00 0.35 -0.15 0.44 0.02 0.00 0.00 177.57 178.23 1gn2 h ASP 176 N 0.38 0.53 -0.84 0.57 3.32 -1.38 -2.91 116.42 116.08 1gn2 h ASP 176 Ca 0.06 -0.43 0.01 0.00 0.02 0.00 0.00 57.03 56.69 1gn2 h ASP 176 Cb 0.56 -0.15 -0.04 0.00 0.22 0.00 0.00 39.33 39.91 1gn2 h ASP 176 CO 0.04 0.85 0.56 0.15 -1.72 0.00 0.00 179.24 179.11 1gn2 h PHE 177 N 0.22 1.06 0.00 4.55 3.57 -1.53 -1.03 116.94 123.77 1gn2 h PHE 177 Ca 0.05 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.56 1gn2 h PHE 177 Cb 0.66 -0.36 -0.00 0.00 2.79 0.00 0.00 35.95 39.05 1gn2 h PHE 177 CO 0.07 0.66 -0.07 0.00 -2.23 0.00 0.00 178.31 176.73 1gn2 h ALA 178 N 1.48 1.07 0.14 2.41 0.00 -1.33 -2.51 119.26 120.52 1gn2 h ALA 178 Ca 0.31 -0.07 -0.33 0.00 0.00 0.00 0.00 54.91 54.83 1gn2 h ALA 178 Cb -0.11 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1gn2 h ALA 178 CO -0.07 0.09 -1.74 0.87 0.00 0.00 0.00 179.25 178.40 1gn2 h LYS 179 N 0.00 0.29 -0.15 0.00 1.57 -1.10 -3.35 116.57 113.83 1gn2 h LYS 179 Ca -0.00 -0.49 0.02 0.00 -1.87 0.00 0.00 60.65 58.30 1gn2 h LYS 179 Cb 0.43 0.18 -0.01 0.00 0.08 0.00 0.00 32.23 32.92 1gn2 h LYS 179 CO 0.01 1.23 0.10 0.00 -0.57 0.00 0.00 179.45 180.23 1gn2 h ALA 180 N 0.02 1.97 -0.77 3.86 0.00 -1.06 -2.84 119.26 120.44 1gn2 h ALA 180 Ca -0.37 -0.01 0.09 0.00 0.00 0.00 0.00 54.91 54.63 1gn2 h ALA 180 Cb 1.95 -0.04 -0.07 0.00 0.00 0.00 0.00 17.79 19.63 1gn2 h ALA 180 CO 0.09 0.01 0.42 0.35 0.00 0.00 0.00 179.25 180.12 1gn2 h PHE 181 N 0.14 0.75 0.00 0.00 3.57 -1.59 -1.68 116.94 118.13 1gn2 h PHE 181 Ca 0.06 0.03 0.00 0.00 3.53 0.00 0.00 57.97 61.59 1gn2 h PHE 181 Cb 0.08 -0.22 0.00 0.00 2.79 0.00 0.00 35.95 38.60 1gn2 h PHE 181 CO -0.00 0.29 0.22 -1.49 -2.23 0.00 0.00 178.31 175.11 1gn2 h TRP 182 N 0.70 0.00 0.00 0.41 4.06 -1.71 0.17 115.95 119.58 1gn2 h TRP 182 Ca 0.37 0.00 -0.05 0.00 2.06 0.00 0.00 58.89 61.27 1gn2 h TRP 182 Cb 0.36 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.52 1gn2 h TRP 182 CO -0.08 0.00 -0.41 -0.91 -3.56 0.00 0.00 178.44 173.48 1gn2 h ASN 183 N 0.00 0.00 -0.37 -3.49 2.35 -1.50 -3.33 115.58 109.24 1gn2 h ASN 183 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1gn2 h ASN 183 Cb 0.45 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.82 1gn2 h ASN 183 CO 0.00 0.23 0.00 1.33 -1.65 0.00 0.00 177.43 177.34 1gn2 n VAL 184 N -3.08 1.00 -2.06 2.81 0.24 0.56 -3.19 118.33 114.60 1gn2 n VAL 184 Ca 0.02 -1.00 -0.41 0.00 -2.04 0.00 0.00 64.34 60.91 1gn2 n VAL 184 Cb 0.63 0.50 -0.02 0.00 -1.47 0.00 0.00 33.84 33.49 1gn2 n VAL 184 CO 0.00 0.00 0.00 -0.69 -2.14 0.00 0.00 176.83 174.00 1gn2 s VAL 185 N -1.00 2.66 -1.06 3.34 1.01 -1.06 -0.65 120.40 123.65 1gn2 s VAL 185 Ca 0.25 0.63 -0.08 0.00 0.00 0.00 0.00 61.98 62.77 1gn2 s VAL 185 Cb 0.13 -3.40 0.26 0.00 0.00 0.00 0.00 36.38 33.37 1gn2 s VAL 185 CO 0.17 0.13 1.03 0.21 0.00 0.00 0.00 175.10 176.64 1gn2 s ASN 186 N -0.17 7.06 0.58 3.32 2.47 0.73 -0.67 114.94 128.25 1gn2 s ASN 186 Ca 0.53 -3.56 0.26 0.00 0.42 0.00 0.00 52.86 50.51 1gn2 s ASN 186 Cb -0.41 -2.16 1.40 0.00 -1.45 0.00 0.00 41.25 38.63 1gn2 s ASN 186 CO 0.50 -0.29 1.76 -0.50 -3.72 0.00 0.00 177.10 174.86 1gn2 h TRP 187 N 6.63 0.00 0.00 0.43 4.06 -1.89 -0.26 115.95 124.92 1gn2 h TRP 187 Ca 0.17 0.00 -0.08 0.00 2.06 0.00 0.00 58.89 61.04 1gn2 h TRP 187 Cb 0.88 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 29.02 1gn2 h TRP 187 CO 0.77 0.00 -0.40 0.00 -3.56 0.00 0.00 178.44 175.25 1gn2 h ALA 188 N 1.32 0.94 0.08 1.49 0.00 -1.97 -1.80 119.26 119.33 1gn2 h ALA 188 Ca 0.00 -0.36 -0.00 0.00 0.00 0.00 0.00 54.91 54.54 1gn2 h ALA 188 Cb 0.63 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.36 1gn2 h ALA 188 CO 0.00 0.50 -0.04 0.22 0.00 0.00 0.00 179.25 179.93 1gn2 h ASP 189 N 0.00 -0.09 -0.26 0.00 1.82 -1.36 -2.50 116.42 114.03 1gn2 h ASP 189 Ca -0.00 -0.36 0.06 0.00 -0.39 0.00 0.00 57.03 56.34 1gn2 h ASP 189 Cb 0.97 0.02 -0.07 0.00 0.68 0.00 0.00 39.33 40.94 1gn2 h ASP 189 CO 0.05 0.54 -0.18 0.58 -1.61 0.00 0.00 179.24 178.62 1gn2 h VAL 190 N -0.97 0.49 -0.79 2.25 2.07 -1.59 0.59 116.25 118.30 1gn2 h VAL 190 Ca -0.01 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.65 1gn2 h VAL 190 Cb 0.44 0.49 -0.09 0.00 -1.52 0.00 0.00 31.29 30.61 1gn2 h VAL 190 CO 0.02 0.00 0.36 1.56 0.02 0.00 0.00 177.57 179.53 1gn2 h GLN 191 N -0.17 0.51 -0.03 1.57 4.20 -1.45 0.21 115.11 119.95 1gn2 h GLN 191 Ca 0.14 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.82 1gn2 h GLN 191 Cb 0.39 -0.12 -0.00 0.00 0.30 0.00 0.00 27.48 28.05 1gn2 h GLN 191 CO -0.36 0.34 0.02 1.03 -0.67 0.00 0.00 178.83 179.19 1gn2 h SER 192 N 0.53 0.04 -0.59 1.46 0.87 -0.63 -1.86 113.55 113.36 1gn2 h SER 192 Ca 0.43 -0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.96 1gn2 h SER 192 Cb 0.62 -0.01 -0.03 0.00 -0.44 0.00 0.00 62.40 62.54 1gn2 h SER 192 CO -0.37 0.04 0.33 0.03 -0.53 0.00 0.00 176.83 176.32 1gn2 h ARG 193 N 0.03 0.85 -0.45 2.24 3.08 0.39 -2.18 114.38 118.34 1gn2 h ARG 193 Ca 0.01 -0.09 -0.12 0.00 0.07 0.00 0.00 59.98 59.85 1gn2 h ARG 193 Cb 0.01 -0.17 -0.02 0.00 0.08 0.00 0.00 29.97 29.87 1gn2 h ARG 193 CO -0.00 0.63 -0.18 -0.92 -1.07 0.00 0.00 179.97 178.43 1gn2 h TYR 194 N 0.86 0.98 -0.67 3.04 3.20 -0.41 0.10 116.97 124.07 1gn2 h TYR 194 Ca 0.22 -0.22 -0.01 0.00 3.14 0.00 0.00 58.73 61.86 1gn2 h TYR 194 Cb 0.04 -0.24 -0.03 0.00 1.54 0.00 0.00 36.73 38.04 1gn2 h TYR 194 CO 0.01 0.98 0.38 0.00 -1.64 0.00 0.00 178.16 177.88 1gn2 h ALA 195 N 1.02 0.85 -0.10 1.82 0.00 -0.86 0.33 119.26 122.32 1gn2 h ALA 195 Ca 0.11 -0.10 -0.20 0.00 0.00 0.00 0.00 54.91 54.73 1gn2 h ALA 195 Cb 0.71 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.24 1gn2 h ALA 195 CO 0.05 0.36 -0.74 0.00 0.00 0.00 0.00 179.25 178.92 1gn2 h ALA 196 N 1.19 0.51 -0.40 0.00 0.00 -1.27 -3.00 119.26 116.29 1gn2 h ALA 196 Ca 0.24 -0.60 -0.14 0.00 0.00 0.00 0.00 54.91 54.40 1gn2 h ALA 196 Cb 0.02 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 1gn2 h ALA 196 CO -0.04 0.74 -0.31 0.00 0.00 0.00 0.00 179.25 179.64 1gn2 h ALA 197 N 0.82 0.70 -0.02 0.00 0.00 -0.45 -2.66 119.26 117.65 1gn2 h ALA 197 Ca -0.04 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1gn2 h ALA 197 Cb 1.33 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.98 1gn2 h ALA 197 CO 0.14 0.67 0.00 0.25 0.00 0.00 0.00 179.25 180.30 1gn2 n THR 198 N -4.08 0.03 1.45 0.00 -2.24 0.11 -5.08 114.28 104.47 1gn2 n THR 198 Ca -0.01 -0.03 0.14 0.00 -2.27 0.00 0.00 64.05 61.88 1gn2 n THR 198 Cb 0.50 -0.03 0.48 0.00 -2.10 0.00 0.00 70.33 69.17 1gn2 n THR 198 CO 0.00 0.00 0.00 -0.24 -0.57 0.00 0.00 175.07 174.26