#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hgj n ARG 7 N 0.00 0.00 0.00 1.96 3.00 -1.26 -5.00 116.66 115.36 2hgj n ARG 7 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.85 57.84 2hgj n ARG 7 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 32.46 32.45 2hgj n ARG 7 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.63 175.33 2hgj n PRO 8 N -2.31 0.00 -0.37 5.56 -0.02 -1.26 -4.93 135.00 131.67 2hgj n PRO 8 Ca 0.00 0.00 -0.12 0.00 -2.02 0.00 0.00 63.50 61.36 2hgj n PRO 8 Cb 0.00 -1.21 0.00 0.00 -0.02 0.00 0.00 33.50 32.27 2hgj n PRO 8 CO 0.00 0.00 0.00 0.27 1.98 0.00 0.00 175.50 177.75 2hgj n ASN 9 N 1.25 -0.91 -4.60 2.55 0.23 -1.26 -4.50 115.26 108.01 2hgj n ASN 9 Ca 0.00 0.21 -0.63 0.00 -0.53 0.00 0.00 54.58 53.64 2hgj n ASN 9 Cb 0.00 -0.25 -0.09 0.00 -2.08 0.00 0.00 39.78 37.36 2hgj n ASN 9 CO 0.00 0.00 0.00 -0.81 -0.93 0.00 0.00 177.26 175.52 2hgj n PRO 10 N 0.40 0.00 0.00 -0.53 -0.04 -1.26 -4.90 135.00 128.67 2hgj n PRO 10 Ca 0.03 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.49 2hgj n PRO 10 Cb 0.12 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.08 2hgj n PRO 10 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2hgj n GLY 11 N 2.57 -0.80 0.00 0.55 0.00 -1.26 -4.76 105.19 101.49 2hgj n GLY 11 Ca 0.25 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.18 2hgj n GLY 11 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hgj n ALA 12 N -3.00 0.00 -1.89 4.61 0.00 -1.26 -4.91 120.51 114.06 2hgj n ALA 12 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2hgj n ALA 12 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2hgj n ALA 12 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2hgj n ASN 13 N 0.00 0.00 0.00 0.00 2.04 -1.26 -5.08 115.26 110.96 2hgj n ASN 13 Ca 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 54.58 54.14 2hgj n ASN 13 Cb 0.00 0.00 0.00 0.00 -2.53 0.00 0.00 39.78 37.25 2hgj n ASN 13 CO 0.00 0.00 0.00 0.29 -0.44 0.00 0.00 177.26 177.11 2hgj n LYS 14 N 0.00 0.00 0.00 -3.83 5.02 -1.26 -4.96 118.16 113.13 2hgj n LYS 14 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 2hgj n LYS 14 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 2hgj n LYS 14 CO 0.00 0.00 0.00 -2.13 -0.52 0.00 0.00 177.40 174.75 2hgj n ARG 15 N 0.00 0.00 -0.93 1.97 3.00 -1.26 -3.84 116.66 115.61 2hgj n ARG 15 Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 57.85 57.84 2hgj n ARG 15 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.46 2hgj n ARG 15 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.63 175.50 2hgj n ARG 16 N 0.00 -0.03 0.04 -0.14 0.00 -1.26 -4.79 116.66 110.48 2hgj n ARG 16 Ca 0.00 0.02 -0.04 0.00 -0.00 0.00 0.00 57.85 57.84 2hgj n ARG 16 Cb 0.00 -0.03 -0.09 0.00 0.00 0.00 0.00 32.46 32.34 2hgj n ARG 16 CO 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 177.63 177.41 2hgj h LYS 17 N 0.27 0.00 0.00 -0.14 1.63 -1.97 -3.47 116.57 112.89 2hgj h LYS 17 Ca -0.01 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.79 2hgj h LYS 17 Cb 0.02 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 31.65 2hgj h LYS 17 CO 0.00 0.51 0.00 -2.13 -3.45 0.00 0.00 179.45 174.39 2hgj n ARG 18 N -3.07 0.00 -3.96 1.90 0.00 -1.26 -4.98 116.66 105.28 2hgj n ARG 18 Ca -0.08 0.00 -0.32 0.00 -0.00 0.00 0.00 57.85 57.44 2hgj n ARG 18 Cb 0.91 0.00 -0.00 0.00 0.00 0.00 0.00 32.46 33.37 2hgj n ARG 18 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.63 178.96 2hgj n VAL 19 N 0.00 -1.64 -2.94 5.15 0.24 -1.26 -4.72 118.33 113.16 2hgj n VAL 19 Ca 0.00 -0.42 -0.44 0.00 -2.04 0.00 0.00 64.34 61.44 2hgj n VAL 19 Cb 0.00 -1.42 -0.01 0.00 -1.47 0.00 0.00 33.84 30.94 2hgj n VAL 19 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2hgj s GLY 20 N -3.95 2.25 0.20 7.63 0.00 -1.26 -5.02 107.32 107.18 2hgj s GLY 20 Ca 0.29 -3.17 -0.04 0.00 0.00 0.00 0.00 44.72 41.79 2hgj s GLY 20 CO 0.72 2.04 -0.14 0.54 0.00 0.00 0.00 173.10 176.26 2hgj n ARG 21 N 5.95 0.00 0.00 2.90 1.74 -1.26 -4.66 116.66 121.33 2hgj n ARG 21 Ca 0.33 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.41 2hgj n ARG 21 Cb 0.45 -0.24 0.00 0.00 -1.02 0.00 0.00 32.46 31.65 2hgj n ARG 21 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2hgj n GLY 22 N 0.76 0.95 0.00 -0.13 0.00 -1.26 -4.43 105.19 101.08 2hgj n GLY 22 Ca 0.00 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.62 2hgj n GLY 22 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2hgj n PRO 23 N 6.51 -0.16 -1.90 1.61 -0.05 -1.26 -4.89 135.00 134.85 2hgj n PRO 23 Ca 0.00 -0.10 -0.41 0.00 -0.05 0.00 0.00 63.50 62.94 2hgj n PRO 23 Cb 0.00 -0.59 -0.02 0.00 -0.05 0.00 0.00 33.50 32.85 2hgj n PRO 23 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 175.50 175.86 2hgj n GLY 24 N 0.00 3.26 0.30 0.55 0.00 -1.25 -3.85 105.19 104.20 2hgj n GLY 24 Ca 0.00 -1.41 0.11 0.00 0.00 0.00 0.00 46.02 44.71 2hgj n GLY 24 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2hgj h SER 25 N 7.12 0.12 0.00 1.61 0.02 -1.96 -3.37 113.55 117.08 2hgj h SER 25 Ca 0.48 0.17 0.00 0.00 -0.84 0.00 0.00 61.79 61.59 2hgj h SER 25 Cb 0.74 0.20 0.00 0.00 0.14 0.00 0.00 62.40 63.48 2hgj h SER 25 CO 1.72 -0.07 -0.26 0.61 -1.14 0.00 0.00 176.83 177.69 2hgj n GLY 26 N -1.36 0.00 0.00 -3.77 0.00 -1.26 -5.04 105.19 93.76 2hgj n GLY 26 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 2hgj n GLY 26 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2hgj n HIS 27 N -2.20 0.00 0.00 1.61 -0.00 -1.26 -5.20 115.22 108.17 2hgj n HIS 27 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.72 2hgj n HIS 27 Cb 0.13 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.12 2hgj n HIS 27 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2hgj n GLY 28 N 4.45 3.60 0.00 -1.41 0.00 -1.26 -3.88 105.19 106.69 2hgj n GLY 28 Ca 0.00 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.31 2hgj n GLY 28 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2hgj n LYS 29 N 0.00 0.00 0.00 1.61 0.00 -1.25 -4.70 118.16 113.82 2hgj n LYS 29 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.31 2hgj n LYS 29 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 35.03 2hgj n LYS 29 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.40 177.65 2hgj n THR 30 N 0.00 0.00 0.00 0.58 -2.24 -1.26 -4.85 114.28 106.51 2hgj n THR 30 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2hgj n THR 30 Cb 0.00 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.23 2hgj n THR 30 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2hgj n ALA 31 N 0.00 0.00 -2.32 6.98 0.00 -1.26 -5.12 120.51 118.79 2hgj n ALA 31 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2hgj n ALA 31 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2hgj n ALA 31 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 2hgj n THR 32 N 0.00 0.00 -3.62 0.00 5.66 -1.26 -5.15 114.28 109.92 2hgj n THR 32 Ca 0.00 0.00 -0.22 0.00 -3.05 0.00 0.00 64.05 60.78 2hgj n THR 32 Cb 0.00 0.00 -0.01 0.00 -1.55 0.00 0.00 70.33 68.77 2hgj n THR 32 CO 0.00 0.00 0.00 -0.13 -3.05 0.00 0.00 175.07 171.89 2hgj s ARG 33 N 2.66 2.41 0.15 1.09 0.52 -1.26 -4.99 118.95 119.54 2hgj s ARG 33 Ca 0.00 -1.71 0.10 0.00 -0.52 0.00 0.00 55.73 53.60 2hgj s ARG 33 Cb 0.00 -2.31 0.54 0.00 0.52 0.00 0.00 34.95 33.70 2hgj s ARG 33 CO 0.00 -0.40 0.59 0.41 0.02 0.00 0.00 175.30 175.92 2hgj n GLY 34 N -1.69 -0.30 0.47 -3.53 0.00 -1.26 -1.16 105.19 97.72 2hgj n GLY 34 Ca 0.03 0.29 0.26 0.00 0.00 0.00 0.00 46.02 46.61 2hgj n GLY 34 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 173.32 174.44 2hgj h HIS 35 N 0.00 0.00 -1.25 1.61 2.07 -1.98 1.51 115.15 117.11 2hgj h HIS 35 Ca 0.33 0.00 -0.64 0.00 -2.85 0.00 0.00 60.37 57.20 2hgj h HIS 35 Cb 0.97 0.00 -0.35 0.00 2.57 0.00 0.00 27.41 30.59 2hgj h HIS 35 CO -0.00 0.00 0.10 1.63 -3.07 0.00 0.00 177.93 176.59 2hgj n LYS 36 N -3.55 3.12 0.00 5.12 4.76 -0.31 -4.66 118.16 122.65 2hgj n LYS 36 Ca 0.17 -3.85 0.00 0.00 -2.87 0.00 0.00 58.31 51.76 2hgj n LYS 36 Cb 1.10 -2.27 0.00 0.00 -1.84 0.00 0.00 35.03 32.01 2hgj n LYS 36 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2hgj n GLY 37 N -0.69 -1.06 0.07 0.72 0.00 0.52 -4.86 105.19 99.89 2hgj n GLY 37 Ca 0.51 -0.85 0.00 0.00 0.00 0.00 0.00 46.02 45.67 2hgj n GLY 37 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 2hgj n GLN 38 N 0.00 0.00 -0.15 1.61 7.27 -1.26 -4.18 117.38 120.67 2hgj n GLN 38 Ca 0.00 0.00 -0.01 0.00 0.07 0.00 0.00 57.00 57.06 2hgj n GLN 38 Cb 0.00 -0.34 -0.01 0.00 2.41 0.00 0.00 30.24 32.30 2hgj n GLN 38 CO 0.00 0.00 0.00 1.63 0.07 0.00 0.00 177.06 178.76 2hgj n LYS 39 N -2.23 0.29 -2.34 3.69 5.02 -1.26 -3.53 118.16 117.80 2hgj n LYS 39 Ca 0.00 -0.05 -0.25 0.00 -2.02 0.00 0.00 58.31 55.99 2hgj n LYS 39 Cb 0.00 -1.43 0.01 0.00 -0.02 0.00 0.00 35.03 33.59 2hgj n LYS 39 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 2hgj n SER 40 N 2.08 4.65 -4.49 4.39 3.41 -1.26 -4.92 113.62 117.48 2hgj n SER 40 Ca 0.02 -3.68 -0.43 0.00 -0.26 0.00 0.00 58.87 54.52 2hgj n SER 40 Cb 0.14 -0.42 -0.01 0.00 -0.26 0.00 0.00 64.21 63.66 2hgj n SER 40 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2hgj s ARG 41 N -3.55 3.83 0.00 4.33 1.81 -1.23 -4.49 118.95 119.65 2hgj s ARG 41 Ca 0.48 -1.99 0.00 0.00 -1.72 0.00 0.00 55.73 52.50 2hgj s ARG 41 Cb 0.40 -5.14 0.00 0.00 -0.45 0.00 0.00 34.95 29.77 2hgj s ARG 41 CO -0.11 -1.92 0.00 0.43 -0.68 0.00 0.00 175.30 173.03 2hgj n SER 42 N 6.89 0.00 -4.55 0.23 7.64 -1.26 -4.73 113.62 117.83 2hgj n SER 42 Ca 0.34 0.00 -0.31 0.00 1.01 0.00 0.00 58.87 59.91 2hgj n SER 42 Cb 0.47 0.00 -0.04 0.00 -1.01 0.00 0.00 64.21 63.63 2hgj n SER 42 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2hgj s GLY 43 N 0.00 -0.06 0.00 0.23 0.00 -1.26 -4.96 107.32 101.27 2hgj s GLY 43 Ca 0.00 -0.80 0.00 0.00 0.00 0.00 0.00 44.72 43.92 2hgj s GLY 43 CO 0.00 3.68 0.00 0.61 0.00 0.00 0.00 173.10 177.39 2hgj n GLY 44 N 6.24 -0.00 1.85 0.20 0.00 -1.26 -4.28 105.19 107.95 2hgj n GLY 44 Ca 0.33 0.00 0.04 0.00 0.00 0.00 0.00 46.02 46.38 2hgj n GLY 44 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2hgj n LEU 45 N 0.00 5.59 0.00 0.99 4.32 -1.26 -4.99 117.00 121.65 2hgj n LEU 45 Ca 0.00 -2.86 0.00 0.00 -0.02 0.00 0.00 56.01 53.13 2hgj n LEU 45 Cb 0.00 -0.69 0.00 0.00 -1.62 0.00 0.00 43.42 41.11 2hgj n LEU 45 CO 0.00 0.65 0.00 2.29 -1.22 0.00 0.00 177.39 179.11 2hgj n LYS 46 N 0.43 0.00 0.00 3.23 0.00 -1.26 -4.71 118.16 115.85 2hgj n LYS 46 Ca 0.29 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.60 2hgj n LYS 46 Cb 1.20 0.00 0.00 0.00 -0.00 0.00 0.00 35.03 36.23 2hgj n LYS 46 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.40 173.93 2hgj n ASP 47 N 0.00 0.00 0.21 -5.58 4.64 -1.26 -4.16 116.55 110.40 2hgj n ASP 47 Ca 0.00 0.05 0.09 0.00 -1.38 0.00 0.00 54.79 53.54 2hgj n ASP 47 Cb 0.00 -0.07 0.44 0.00 -1.04 0.00 0.00 41.12 40.45 2hgj n ASP 47 CO 0.00 0.00 0.00 -0.65 -0.82 0.00 0.00 177.20 175.73 2hgj h PRO 48 N 0.00 0.00 -0.16 -0.67 0.11 -2.00 -3.21 132.00 126.07 2hgj h PRO 48 Ca 0.00 0.00 0.03 0.00 0.11 0.00 0.00 66.00 66.14 2hgj h PRO 48 Cb 0.00 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.08 2hgj h PRO 48 CO 0.00 0.27 -0.06 0.00 -0.21 0.00 0.00 178.00 178.00 2hgj h ARG 49 N 0.00 -0.04 0.00 1.05 -0.00 -1.90 0.10 114.38 113.59 2hgj h ARG 49 Ca -0.00 0.00 -0.03 0.00 -0.50 0.00 0.00 59.98 59.45 2hgj h ARG 49 Cb 0.76 0.01 -0.00 0.00 0.00 0.00 0.00 29.97 30.74 2hgj h ARG 49 CO 0.04 -0.03 -0.15 -0.09 0.00 0.00 0.00 179.97 179.74 2hgj h ARG 50 N -0.04 0.00 0.33 0.04 9.65 -1.72 0.04 114.38 122.68 2hgj h ARG 50 Ca 0.08 0.00 -0.00 0.00 -1.10 0.00 0.00 59.98 58.96 2hgj h ARG 50 Cb 0.16 0.00 -0.02 0.00 -1.39 0.00 0.00 29.97 28.73 2hgj h ARG 50 CO -0.18 0.15 -0.29 0.74 2.80 0.00 0.00 179.97 183.18 2hgj h PHE 51 N 0.00 -0.79 -0.19 2.20 -1.00 -0.86 -0.10 116.94 116.20 2hgj h PHE 51 Ca -0.00 0.00 0.03 0.00 2.81 0.00 0.00 57.97 60.81 2hgj h PHE 51 Cb 0.32 0.30 -0.03 0.00 3.61 0.00 0.00 35.95 40.15 2hgj h PHE 51 CO 0.00 -0.43 0.01 1.05 -1.61 0.00 0.00 178.31 177.33 2hgj h GLU 52 N -0.64 0.08 -0.96 1.51 9.09 -0.00 -0.39 114.58 123.27 2hgj h GLU 52 Ca -0.02 -0.00 0.35 0.00 0.05 0.00 0.00 59.36 59.74 2hgj h GLU 52 Cb 0.57 -0.02 -0.17 0.00 -1.65 0.00 0.00 28.75 27.48 2hgj h GLU 52 CO -0.04 0.05 0.34 0.41 0.05 0.00 0.00 179.01 179.82 2hgj n GLY 53 N -1.17 -0.93 0.10 1.06 0.00 -0.11 0.28 105.19 104.42 2hgj n GLY 53 Ca -0.03 0.84 0.06 0.00 0.00 0.00 0.00 46.02 46.89 2hgj n GLY 53 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2hgj n GLY 54 N -1.33 -1.31 3.64 -0.02 0.00 -0.14 -4.82 105.19 101.20 2hgj n GLY 54 Ca 0.32 -0.21 -0.43 0.00 0.00 0.00 0.00 46.02 45.70 2hgj n GLY 54 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2hgj s ARG 55 N -3.17 4.02 0.00 1.61 0.52 0.14 -4.77 118.95 117.31 2hgj s ARG 55 Ca -0.02 1.45 0.00 0.00 -0.52 0.00 0.00 55.73 56.64 2hgj s ARG 55 Cb 0.09 -3.85 0.00 0.00 0.52 0.00 0.00 34.95 31.71 2hgj s ARG 55 CO 0.81 -0.98 0.00 0.45 0.02 0.00 0.00 175.30 175.60 2hgj n SER 56 N 7.32 0.00 0.00 0.23 2.88 -1.26 -4.83 113.62 117.96 2hgj n SER 56 Ca 0.15 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.69 2hgj n SER 56 Cb 0.46 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.92 2hgj n SER 56 CO 0.00 0.00 0.00 0.41 -1.23 0.00 0.00 175.04 174.22 2hgj n THR 57 N 0.00 0.00 0.00 2.46 -1.04 -1.26 -5.10 114.28 109.34 2hgj n THR 57 Ca 0.00 0.12 0.00 0.00 -2.04 0.00 0.00 64.05 62.13 2hgj n THR 57 Cb 0.00 -0.94 0.00 0.00 -1.82 0.00 0.00 70.33 67.57 2hgj n THR 57 CO 0.00 0.00 0.00 0.41 -0.64 0.00 0.00 175.07 174.84 2hgj n THR 58 N 0.00 0.00 -0.29 12.58 -1.04 -1.26 -5.05 114.28 119.22 2hgj n THR 58 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 2hgj n THR 58 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 2hgj n THR 58 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2hgj n LEU 59 N 0.00 1.13 -4.54 -4.42 -0.00 -1.26 -5.02 117.00 102.89 2hgj n LEU 59 Ca 0.00 -1.13 -0.34 0.00 -0.00 0.00 0.00 56.01 54.54 2hgj n LEU 59 Cb 0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 43.42 43.31 2hgj n LEU 59 CO 0.00 0.28 -0.32 -0.32 -0.00 0.00 0.00 177.39 177.03 2hgj s MET 60 N -0.41 3.77 -0.20 1.47 1.75 -1.26 -5.08 119.30 119.33 2hgj s MET 60 Ca 0.00 -0.46 0.01 0.00 -1.25 0.00 0.00 55.69 53.99 2hgj s MET 60 Cb 0.00 -3.02 0.04 0.00 2.84 0.00 0.00 34.83 34.68 2hgj s MET 60 CO 0.00 0.24 -0.14 1.03 -0.65 0.00 0.00 175.02 175.50 2hgj s ARG 61 N 0.40 2.46 -0.93 4.11 0.52 -1.26 -5.02 118.95 119.23 2hgj s ARG 61 Ca -0.02 -0.95 -0.00 0.00 -0.52 0.00 0.00 55.73 54.24 2hgj s ARG 61 Cb -0.14 -2.57 0.30 0.00 0.52 0.00 0.00 34.95 33.06 2hgj s ARG 61 CO 0.02 -0.37 1.31 1.28 0.02 0.00 0.00 175.30 177.56 2hgj n LEU 62 N 4.60 5.76 0.00 2.53 4.32 -1.26 -5.06 117.00 127.89 2hgj n LEU 62 Ca -0.17 -5.33 -0.04 0.00 -0.02 0.00 0.00 56.01 50.44 2hgj n LEU 62 Cb 0.47 -1.06 0.04 0.00 -1.62 0.00 0.00 43.42 41.25 2hgj n LEU 62 CO 0.23 1.88 0.05 -0.81 -1.22 0.00 0.00 177.39 177.52 2hgj n PRO 63 N 0.90 -0.36 -1.55 3.23 -0.04 -1.26 -4.93 135.00 131.00 2hgj n PRO 63 Ca 0.30 -0.21 -0.13 0.00 -0.04 0.00 0.00 63.50 63.42 2hgj n PRO 63 Cb 0.34 -0.43 -0.09 0.00 -0.04 0.00 0.00 33.50 33.28 2hgj n PRO 63 CO 0.00 0.00 0.00 0.36 -0.04 0.00 0.00 175.50 175.82 2hgj n LYS 64 N -1.07 0.35 0.00 0.54 -0.00 -1.26 -4.80 118.16 111.92 2hgj n LYS 64 Ca 0.02 -1.09 0.00 0.00 -0.00 0.00 0.00 58.31 57.24 2hgj n LYS 64 Cb 0.09 -3.58 0.00 0.00 -0.00 0.00 0.00 35.03 31.53 2hgj n LYS 64 CO 0.00 0.00 0.00 2.89 0.00 0.00 0.00 177.40 180.29 2hgj n ARG 65 N 8.28 0.00 0.00 -1.58 -4.01 -1.26 -5.05 116.66 113.04 2hgj n ARG 65 Ca 0.44 0.00 0.00 0.00 -1.04 0.00 0.00 57.85 57.25 2hgj n ARG 65 Cb 0.43 0.00 0.00 0.00 -3.04 0.00 0.00 32.46 29.85 2hgj n ARG 65 CO 0.00 0.00 0.00 0.41 -3.04 0.00 0.00 177.63 175.00 2hgj n GLY 66 N 0.00 0.00 3.64 2.89 0.00 -1.26 -5.18 105.19 105.28 2hgj n GLY 66 Ca 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.97 2hgj n GLY 66 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2hgj s MET 67 N 0.00 0.28 0.20 1.61 -2.45 -1.26 -5.19 119.30 112.50 2hgj s MET 67 Ca 0.00 0.37 -0.02 0.00 -1.25 0.00 0.00 55.69 54.79 2hgj s MET 67 Cb 0.00 0.12 -0.04 0.00 1.25 0.00 0.00 34.83 36.16 2hgj s MET 67 CO 0.00 -0.04 0.16 -0.65 1.05 0.00 0.00 175.02 175.54 2hgj s GLN 68 N 0.43 1.23 0.00 4.11 1.11 -1.26 -5.18 119.66 120.10 2hgj s GLN 68 Ca 0.01 -1.59 0.00 0.00 0.01 0.00 0.00 55.36 53.79 2hgj s GLN 68 Cb -0.04 0.29 0.00 0.00 -1.01 0.00 0.00 33.01 32.24 2hgj s GLN 68 CO -0.11 -0.41 0.00 0.41 0.01 0.00 0.00 175.29 175.19 2hgj n GLY 69 N -0.28 -1.79 0.00 3.09 0.00 -1.26 -5.12 105.19 99.84 2hgj n GLY 69 Ca 0.02 -0.78 0.00 0.00 0.00 0.00 0.00 46.02 45.26 2hgj n GLY 69 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2hgj n GLN 70 N 0.00 0.00 -3.09 1.61 10.64 -1.26 -5.08 117.38 120.20 2hgj n GLN 70 Ca 0.00 0.00 -0.15 0.00 -1.83 0.00 0.00 57.00 55.02 2hgj n GLN 70 Cb 0.00 0.00 -0.04 0.00 -0.86 0.00 0.00 30.24 29.34 2hgj n GLN 70 CO 0.00 0.00 0.00 0.08 -1.83 0.00 0.00 177.06 175.31 2hgj s VAL 71 N -1.81 -0.37 0.01 -0.39 1.01 -1.26 -5.15 120.40 112.43 2hgj s VAL 71 Ca 0.00 -1.69 -0.01 0.00 0.00 0.00 0.00 61.98 60.28 2hgj s VAL 71 Cb 0.00 -0.59 -0.00 0.00 0.00 0.00 0.00 36.38 35.79 2hgj s VAL 71 CO 0.00 -0.58 0.00 -2.65 0.00 0.00 0.00 175.10 171.87 2hgj n PRO 72 N 3.03 0.00 -2.70 2.72 -0.02 -1.26 -4.98 135.00 131.79 2hgj n PRO 72 Ca 0.22 0.00 -0.06 0.00 -2.02 0.00 0.00 63.50 61.65 2hgj n PRO 72 Cb 0.52 -0.02 0.08 0.00 -0.02 0.00 0.00 33.50 34.05 2hgj n PRO 72 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2hgj n GLY 73 N 0.06 -0.81 3.68 -1.23 0.00 -1.26 -4.56 105.19 101.06 2hgj n GLY 73 Ca 0.00 0.57 -0.36 0.00 0.00 0.00 0.00 46.02 46.24 2hgj n GLY 73 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2hgj s GLU 74 N 0.27 4.11 -0.19 1.61 2.12 -0.10 -4.91 118.70 121.61 2hgj s GLU 74 Ca 0.26 -0.23 -0.29 0.00 0.36 0.00 0.00 54.97 55.07 2hgj s GLU 74 Cb 0.25 -3.51 -0.05 0.00 0.26 0.00 0.00 34.13 31.08 2hgj s GLU 74 CO -0.15 0.12 1.99 0.42 -0.54 0.00 0.00 175.26 177.10 2hgj s ILE 75 N 0.88 3.22 -0.18 -3.70 -1.09 -1.26 -1.22 121.20 117.85 2hgj s ILE 75 Ca 0.08 0.24 0.01 0.00 -2.23 0.00 0.00 60.65 58.75 2hgj s ILE 75 Cb -0.13 -3.25 0.04 0.00 -1.58 0.00 0.00 42.46 37.53 2hgj s ILE 75 CO 0.03 -0.13 -0.11 -0.75 -1.23 0.00 0.00 174.94 172.74 2hgj s LYS 76 N 5.59 2.10 -0.37 2.79 2.20 -0.28 -4.77 119.74 127.01 2hgj s LYS 76 Ca 0.89 -0.73 -0.16 0.00 -0.36 0.00 0.00 55.97 55.61 2hgj s LYS 76 Cb -0.31 -2.29 -0.00 0.00 -1.51 0.00 0.00 37.83 33.71 2hgj s LYS 76 CO 0.35 -0.36 0.42 0.50 -0.36 0.00 0.00 175.35 175.90 2hgj s ARG 77 N 1.44 3.45 0.63 4.03 3.52 -1.26 -0.84 118.95 129.92 2hgj s ARG 77 Ca 0.01 -0.44 0.24 0.00 -0.13 0.00 0.00 55.73 55.40 2hgj s ARG 77 Cb -0.15 -3.85 1.29 0.00 -1.56 0.00 0.00 34.95 30.68 2hgj s ARG 77 CO -0.09 -0.64 1.71 -1.00 -0.81 0.00 0.00 175.30 174.47 2hgj h PRO 78 N 8.54 0.00 0.20 5.12 0.13 -1.89 0.43 132.00 144.54 2hgj h PRO 78 Ca -0.28 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.84 2hgj h PRO 78 Cb 1.13 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.26 2hgj h PRO 78 CO 0.74 0.00 -0.10 -0.09 -0.23 0.00 0.00 178.00 178.32 2hgj h ARG 79 N 0.00 -0.27 -0.59 0.86 9.65 -1.91 -0.69 114.38 121.43 2hgj h ARG 79 Ca 0.00 0.02 -0.02 0.00 -1.10 0.00 0.00 59.98 58.88 2hgj h ARG 79 Cb 0.86 0.06 -0.03 0.00 -1.39 0.00 0.00 29.97 29.48 2hgj h ARG 79 CO 0.00 -0.15 0.28 -0.92 2.80 0.00 0.00 179.97 181.98 2hgj h TYR 80 N -0.31 0.86 0.00 2.20 3.20 -0.61 -0.52 116.97 121.79 2hgj h TYR 80 Ca -0.03 -0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.80 2hgj h TYR 80 Cb 0.23 -0.26 0.00 0.00 1.54 0.00 0.00 36.73 38.24 2hgj h TYR 80 CO -0.05 0.66 0.00 1.04 -1.64 0.00 0.00 178.16 178.16 2hgj n GLN 81 N -4.53 0.00 0.07 1.82 1.13 -0.39 -1.18 117.38 114.31 2hgj n GLN 81 Ca 0.04 0.25 -0.03 0.00 -1.94 0.00 0.00 57.00 55.31 2hgj n GLN 81 Cb 0.13 -0.55 -0.07 0.00 0.11 0.00 0.00 30.24 29.85 2hgj n GLN 81 CO 0.00 0.00 0.00 0.78 -1.44 0.00 0.00 177.06 176.40 2hgj h GLY 82 N 0.00 0.00 2.00 1.08 0.00 -1.22 0.20 103.07 105.13 2hgj h GLY 82 Ca 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 47.33 47.26 2hgj h GLY 82 CO 0.00 0.00 -0.33 -0.39 0.00 0.00 0.00 176.54 175.82 2hgj h VAL 83 N 0.00 0.92 0.00 4.60 -1.51 -0.99 -3.38 116.25 115.89 2hgj h VAL 83 Ca -0.06 -1.28 0.00 0.00 -1.23 0.00 0.00 66.70 64.14 2hgj h VAL 83 Cb 1.65 1.76 0.00 0.00 -2.13 0.00 0.00 31.29 32.57 2hgj h VAL 83 CO 0.09 0.32 -0.00 0.59 -1.23 0.00 0.00 177.57 177.34 2hgj n ASN 84 N -3.69 0.00 -0.52 4.19 5.03 -0.32 -5.03 115.26 114.92 2hgj n ASN 84 Ca -0.01 -0.26 -0.02 0.00 0.87 0.00 0.00 54.58 55.16 2hgj n ASN 84 Cb 0.43 0.52 -0.02 0.00 -1.02 0.00 0.00 39.78 39.70 2hgj n ASN 84 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 2hgj n LEU 85 N -0.52 -0.23 -4.56 3.41 4.32 -0.12 -5.04 117.00 114.25 2hgj n LEU 85 Ca 0.00 -0.96 -0.27 0.00 -0.02 0.00 0.00 56.01 54.77 2hgj n LEU 85 Cb 0.00 0.00 -0.08 0.00 -1.62 0.00 0.00 43.42 41.72 2hgj n LEU 85 CO 0.00 0.98 -0.22 -0.54 -1.22 0.00 0.00 177.39 176.39 2hgj s LYS 86 N 0.00 1.95 -0.52 3.23 -0.14 0.52 -4.93 119.74 119.84 2hgj s LYS 86 Ca 0.00 -2.18 0.04 0.00 -1.36 0.00 0.00 55.97 52.46 2hgj s LYS 86 Cb 0.00 -0.86 0.16 0.00 -1.68 0.00 0.00 37.83 35.45 2hgj s LYS 86 CO 0.00 -0.40 0.37 0.16 -0.76 0.00 0.00 175.35 174.72 2hgj s ASP 87 N -3.65 3.18 0.00 2.83 1.47 -1.26 -4.87 116.67 114.37 2hgj s ASP 87 Ca 0.22 -3.24 0.00 0.00 1.18 0.00 0.00 52.55 50.72 2hgj s ASP 87 Cb 0.03 -1.00 0.00 0.00 -0.34 0.00 0.00 42.92 41.61 2hgj s ASP 87 CO 0.12 -0.16 0.00 -0.11 0.68 0.00 0.00 175.17 175.70 2hgj n LEU 88 N 2.71 0.00 0.00 2.11 7.94 -1.26 -3.50 117.00 125.00 2hgj n LEU 88 Ca 0.21 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.11 2hgj n LEU 88 Cb 0.40 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.35 2hgj n LEU 88 CO 0.19 0.00 0.00 0.00 -1.11 0.00 0.00 177.39 176.47 2hgj n ALA 89 N 0.00 0.00 -3.57 1.96 0.00 -1.25 -4.80 120.51 112.84 2hgj n ALA 89 Ca 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.23 2hgj n ALA 89 Cb 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 19.45 19.29 2hgj n ALA 89 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 2hgj s ARG 90 N -1.17 1.11 0.26 0.00 3.52 -1.23 -3.53 118.95 117.91 2hgj s ARG 90 Ca 0.00 -0.20 0.00 0.00 -0.13 0.00 0.00 55.73 55.40 2hgj s ARG 90 Cb 0.00 -1.02 0.00 0.00 -1.56 0.00 0.00 34.95 32.37 2hgj s ARG 90 CO 0.00 -0.05 0.00 0.34 -0.81 0.00 0.00 175.30 174.78 2hgj n PHE 91 N 3.97 -3.73 -1.39 5.12 7.35 -1.25 -4.87 117.46 122.66 2hgj n PHE 91 Ca -0.24 0.90 0.00 0.00 -0.76 0.00 0.00 57.45 57.35 2hgj n PHE 91 Cb 0.51 2.46 0.00 0.00 0.35 0.00 0.00 39.48 42.80 2hgj n PHE 91 CO 0.00 0.00 0.00 0.39 -0.76 0.00 0.00 176.76 176.39 2hgj n GLU 92 N -3.02 -3.99 -0.36 -4.13 -0.58 -1.26 -1.35 120.64 105.95 2hgj n GLU 92 Ca 0.00 2.98 0.30 0.00 -0.42 0.00 0.00 57.16 60.02 2hgj n GLU 92 Cb 0.00 -3.35 0.61 0.00 -0.57 0.00 0.00 31.44 28.14 2hgj n GLU 92 CO 0.00 0.00 0.00 0.78 -0.48 0.00 0.00 177.13 177.43 2hgj h GLY 93 N 1.44 0.87 -0.83 0.62 0.00 -1.96 1.04 103.07 104.26 2hgj h GLY 93 Ca 0.00 -0.12 0.08 0.00 0.00 0.00 0.00 47.33 47.28 2hgj h GLY 93 CO 0.00 -0.15 -0.50 -2.09 0.00 0.00 0.00 176.54 173.79 2hgj h GLU 94 N 0.21 -0.02 0.00 4.80 4.22 -2.00 0.71 114.58 122.50 2hgj h GLU 94 Ca 0.65 0.00 0.00 0.00 0.08 0.00 0.00 59.36 60.09 2hgj h GLU 94 Cb 2.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.27 2hgj h GLU 94 CO -0.24 -0.01 0.00 0.28 -2.18 0.00 0.00 179.01 176.86 2hgj n VAL 95 N -4.93 0.35 -0.46 0.32 0.31 0.35 -4.43 118.33 109.85 2hgj n VAL 95 Ca 0.01 0.07 -0.01 0.00 -0.01 0.00 0.00 64.34 64.41 2hgj n VAL 95 Cb 0.23 -0.67 -0.01 0.00 -0.91 0.00 0.00 33.84 32.48 2hgj n VAL 95 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 2hgj n THR 96 N -1.54 1.77 0.00 2.52 -2.24 0.25 -4.86 114.28 110.18 2hgj n THR 96 Ca 0.06 -0.48 0.00 0.00 -2.27 0.00 0.00 64.05 61.35 2hgj n THR 96 Cb 0.29 -1.46 0.00 0.00 -2.10 0.00 0.00 70.33 67.06 2hgj n THR 96 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 2hgj n PRO 97 N 1.63 0.00 0.00 -0.78 -0.04 -1.26 -2.92 135.00 131.63 2hgj n PRO 97 Ca 0.02 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.49 2hgj n PRO 97 Cb 0.45 -0.51 0.00 0.00 -0.04 0.00 0.00 33.50 33.41 2hgj n PRO 97 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2hgj n GLU 98 N -0.01 0.00 0.00 0.54 2.13 -1.26 -4.25 120.64 117.78 2hgj n GLU 98 Ca 0.00 0.71 0.00 0.00 0.66 0.00 0.00 57.16 58.53 2hgj n GLU 98 Cb 0.00 -1.09 0.00 0.00 0.27 0.00 0.00 31.44 30.62 2hgj n GLU 98 CO 0.00 0.00 0.00 -0.11 -0.41 0.00 0.00 177.13 176.61 2hgj n LEU 99 N -2.60 0.00 -3.22 4.31 0.00 -1.15 -4.16 117.00 110.18 2hgj n LEU 99 Ca 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 56.01 55.82 2hgj n LEU 99 Cb 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 43.42 43.37 2hgj n LEU 99 CO 0.00 0.00 1.23 0.18 0.00 0.00 0.00 177.39 178.80 2hgj n LEU 100 N 0.00 0.52 -2.50 -1.96 4.77 -1.26 -3.24 117.00 113.33 2hgj n LEU 100 Ca 0.00 -1.25 -0.03 0.00 -0.03 0.00 0.00 56.01 54.70 2hgj n LEU 100 Cb 0.00 -0.51 0.10 0.00 -2.33 0.00 0.00 43.42 40.67 2hgj n LEU 100 CO 0.00 -1.53 0.55 1.33 -1.33 0.00 0.00 177.39 176.41 2hgj n VAL 101 N 5.83 0.00 0.00 4.08 0.24 -1.26 -4.85 118.33 122.36 2hgj n VAL 101 Ca 0.21 -0.94 0.00 0.00 -2.04 0.00 0.00 64.34 61.56 2hgj n VAL 101 Cb 0.18 0.89 0.00 0.00 -1.47 0.00 0.00 33.84 33.44 2hgj n VAL 101 CO 0.00 0.00 0.00 -2.11 -2.14 0.00 0.00 176.83 172.58 2hgj n ARG 102 N -1.01 0.00 -0.92 7.34 1.85 -1.20 -4.97 116.66 117.76 2hgj n ARG 102 Ca -0.13 0.00 -0.09 0.00 -1.00 0.00 0.00 57.85 56.63 2hgj n ARG 102 Cb 0.80 0.00 0.20 0.00 -1.05 0.00 0.00 32.46 32.40 2hgj n ARG 102 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 2hgj n ALA 103 N 0.00 4.64 -3.00 2.89 0.00 -1.25 -4.55 120.51 119.25 2hgj n ALA 103 Ca 0.00 -3.09 0.00 0.00 0.00 0.00 0.00 53.44 50.35 2hgj n ALA 103 Cb 0.00 -0.91 0.00 0.00 0.00 0.00 0.00 19.45 18.54 2hgj n ALA 103 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2hgj n GLY 104 N -1.13 4.15 3.15 0.00 0.00 -1.26 -4.97 105.19 105.14 2hgj n GLY 104 Ca 0.40 -1.07 0.04 0.00 0.00 0.00 0.00 46.02 45.39 2hgj n GLY 104 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2hgj s LEU 105 N 0.00 -1.26 0.00 0.99 2.96 -1.26 -4.82 118.68 115.28 2hgj s LEU 105 Ca 0.00 0.14 0.00 0.00 -0.22 0.00 0.00 54.13 54.05 2hgj s LEU 105 Cb 0.00 1.80 0.00 0.00 0.50 0.00 0.00 46.19 48.49 2hgj s LEU 105 CO 0.00 -0.23 0.00 0.18 -1.32 0.00 0.00 176.35 174.98 2hgj n LEU 106 N 5.31 0.00 0.00 -0.68 4.77 -1.26 -5.03 117.00 120.10 2hgj n LEU 106 Ca 0.06 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.04 2hgj n LEU 106 Cb 0.55 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.64 2hgj n LEU 106 CO -0.09 0.00 0.00 2.29 -1.33 0.00 0.00 177.39 178.26 2hgj n LYS 107 N 0.00 0.00 -0.19 3.23 2.85 -1.26 -5.08 118.16 117.70 2hgj n LYS 107 Ca 0.00 0.00 0.02 0.00 -1.05 0.00 0.00 58.31 57.28 2hgj n LYS 107 Cb 0.00 0.00 0.06 0.00 -0.65 0.00 0.00 35.03 34.44 2hgj n LYS 107 CO 0.00 0.00 0.00 0.36 -0.05 0.00 0.00 177.40 177.71 2hgj n LYS 108 N 0.00 -0.07 -3.96 -1.58 0.00 -1.26 -3.65 118.16 107.64 2hgj n LYS 108 Ca 0.00 0.82 -0.35 0.00 -0.00 0.00 0.00 58.31 58.77 2hgj n LYS 108 Cb 0.00 -1.22 -0.13 0.00 -0.00 0.00 0.00 35.03 33.68 2hgj n LYS 108 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.40 177.60 2hgj s GLY 109 N -4.00 1.72 0.00 2.58 0.00 -1.26 -4.43 107.32 101.93 2hgj s GLY 109 Ca -0.08 -1.04 0.00 0.00 0.00 0.00 0.00 44.72 43.60 2hgj s GLY 109 CO 0.40 0.34 0.00 2.98 0.00 0.00 0.00 173.10 176.82 2hgj n TYR 110 N 4.49 0.00 -3.79 1.90 -0.00 -1.24 -5.01 117.16 113.50 2hgj n TYR 110 Ca -0.17 0.00 -0.13 0.00 -0.00 0.00 0.00 57.90 57.60 2hgj n TYR 110 Cb 0.52 0.00 -0.12 0.00 -0.00 0.00 0.00 39.34 39.73 2hgj n TYR 110 CO 0.00 0.00 0.00 -0.98 -0.00 0.00 0.00 176.86 175.88 2hgj s ARG 111 N 0.00 0.21 -1.15 2.98 1.70 -1.26 -4.62 118.95 116.81 2hgj s ARG 111 Ca 0.00 0.31 -0.17 0.00 -0.47 0.00 0.00 55.73 55.40 2hgj s ARG 111 Cb 0.00 0.06 0.13 0.00 -0.57 0.00 0.00 34.95 34.56 2hgj s ARG 111 CO 0.00 -0.06 1.44 -0.51 -1.08 0.00 0.00 175.30 175.09 2hgj s LEU 112 N 0.34 4.61 -0.09 -1.89 1.43 -1.26 -0.92 118.68 120.89 2hgj s LEU 112 Ca -0.02 -2.51 -0.30 0.00 -1.03 0.00 0.00 54.13 50.28 2hgj s LEU 112 Cb -0.03 -2.46 -0.03 0.00 0.03 0.00 0.00 46.19 43.69 2hgj s LEU 112 CO -0.01 -0.99 1.40 -0.75 0.23 0.00 0.00 176.35 176.23 2hgj s LYS 113 N 2.77 4.23 -1.21 1.70 2.36 -0.36 -2.71 119.74 126.53 2hgj s LYS 113 Ca 0.43 1.88 -0.20 0.00 -2.55 0.00 0.00 55.97 55.53 2hgj s LYS 113 Cb -0.01 -3.78 0.04 0.00 -1.05 0.00 0.00 37.83 33.03 2hgj s LYS 113 CO -0.01 -0.71 1.71 0.42 1.55 0.00 0.00 175.35 178.31 2hgj s ILE 114 N 3.37 3.98 -0.10 5.43 1.09 1.43 -1.13 121.20 135.27 2hgj s ILE 114 Ca 0.62 -1.47 -0.02 0.00 -1.10 0.00 0.00 60.65 58.68 2hgj s ILE 114 Cb -0.27 -5.04 -0.06 0.00 -1.06 0.00 0.00 42.46 36.03 2hgj s ILE 114 CO 0.22 -1.84 1.33 0.18 -0.10 0.00 0.00 174.94 174.73 2hgj n LEU 115 N 9.48 1.51 -4.53 2.97 4.32 -0.02 -3.70 117.00 127.03 2hgj n LEU 115 Ca 0.45 -1.33 -0.34 0.00 -0.02 0.00 0.00 56.01 54.77 2hgj n LEU 115 Cb 0.47 -0.45 -0.09 0.00 -1.62 0.00 0.00 43.42 41.73 2hgj n LEU 115 CO 0.73 -0.07 2.01 0.61 -1.22 0.00 0.00 177.39 179.45 2hgj n GLY 116 N 3.13 -0.13 0.00 -0.72 0.00 -1.26 -4.00 105.19 102.21 2hgj n GLY 116 Ca 0.13 0.74 0.00 0.00 0.00 0.00 0.00 46.02 46.88 2hgj n GLY 116 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2hgj n GLU 117 N 8.56 1.65 -0.55 1.61 0.00 -1.26 -4.65 120.64 126.00 2hgj n GLU 117 Ca 0.50 0.00 -0.29 0.00 0.00 0.00 0.00 57.16 57.37 2hgj n GLU 117 Cb 0.33 0.00 0.20 0.00 0.00 0.00 0.00 31.44 31.98 2hgj n GLU 117 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2hgj n GLY 118 N 5.00 -2.61 5.49 -1.84 0.00 -1.26 -4.60 105.19 105.37 2hgj n GLY 118 Ca 0.00 -0.99 0.04 0.00 0.00 0.00 0.00 46.02 45.07 2hgj n GLY 118 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2hgj n GLU 119 N -3.06 -0.58 -1.40 1.61 -0.58 -1.26 -4.65 120.64 110.72 2hgj n GLU 119 Ca 0.03 0.38 -0.44 0.00 -0.42 0.00 0.00 57.16 56.72 2hgj n GLU 119 Cb 0.56 -0.71 -0.01 0.00 -0.57 0.00 0.00 31.44 30.71 2hgj n GLU 119 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 2hgj n ALA 120 N -0.48 -2.20 -1.61 0.62 0.00 -1.26 -4.89 120.51 110.68 2hgj n ALA 120 Ca 0.00 0.24 -0.28 0.00 0.00 0.00 0.00 53.44 53.41 2hgj n ALA 120 Cb 0.13 -1.66 0.07 0.00 0.00 0.00 0.00 19.45 17.99 2hgj n ALA 120 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2hgj n LYS 121 N 0.94 2.97 0.00 0.00 5.02 -1.26 -4.73 118.16 121.09 2hgj n LYS 121 Ca 0.13 -3.62 0.00 0.00 -2.02 0.00 0.00 58.31 52.80 2hgj n LYS 121 Cb 0.35 -2.24 0.00 0.00 -0.02 0.00 0.00 35.03 33.12 2hgj n LYS 121 CO 0.00 0.00 0.00 -2.30 -0.52 0.00 0.00 177.40 174.58 2hgj n PRO 122 N -0.86 1.46 0.00 1.97 -0.01 -0.75 -2.41 135.00 134.40 2hgj n PRO 122 Ca 0.53 0.00 0.00 0.00 -0.01 0.00 0.00 63.50 64.02 2hgj n PRO 122 Cb 0.85 0.00 0.00 0.00 -0.01 0.00 0.00 33.50 34.34 2hgj n PRO 122 CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 175.50 176.77 2hgj n LEU 123 N 0.00 0.00 -2.61 2.45 7.99 -1.25 0.31 117.00 123.90 2hgj n LEU 123 Ca 0.00 0.00 -0.14 0.00 -0.01 0.00 0.00 56.01 55.86 2hgj n LEU 123 Cb 0.00 0.00 0.02 0.00 -0.11 0.00 0.00 43.42 43.33 2hgj n LEU 123 CO 0.00 0.00 -0.03 2.29 -1.51 0.00 0.00 177.39 178.14 2hgj n LYS 124 N 0.00 1.80 -1.86 3.23 0.00 -1.26 -4.26 118.16 115.81 2hgj n LYS 124 Ca 0.00 -3.61 -0.04 0.00 -0.00 0.00 0.00 58.31 54.66 2hgj n LYS 124 Cb 0.00 -1.53 0.03 0.00 -0.00 0.00 0.00 35.03 33.53 2hgj n LYS 124 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 177.40 177.68 2hgj n VAL 125 N -0.18 0.08 -0.93 0.58 0.31 0.68 -2.58 118.33 116.29 2hgj n VAL 125 Ca 0.18 -0.69 0.00 0.00 -0.01 0.00 0.00 64.34 63.82 2hgj n VAL 125 Cb 0.77 0.80 0.00 0.00 -0.91 0.00 0.00 33.84 34.50 2hgj n VAL 125 CO 0.00 0.00 0.00 0.55 -1.32 0.00 0.00 176.83 176.06 2hgj n VAL 126 N -0.66 0.00 0.00 2.52 3.14 -0.68 -3.94 118.33 118.70 2hgj n VAL 126 Ca -0.19 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.19 2hgj n VAL 126 Cb 0.81 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.59 2hgj n VAL 126 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2hgj n ALA 127 N -1.13 0.00 0.00 1.55 0.00 -0.32 -4.07 120.51 116.54 2hgj n ALA 127 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2hgj n ALA 127 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2hgj n ALA 127 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.50 175.11 2hgj n HIS 128 N 0.00 0.00 -1.48 0.00 1.44 -1.26 -4.72 115.22 109.20 2hgj n HIS 128 Ca 0.00 0.00 -0.41 0.00 -2.01 0.00 0.00 57.72 55.30 2hgj n HIS 128 Cb 0.00 0.00 -0.04 0.00 0.12 0.00 0.00 29.99 30.07 2hgj n HIS 128 CO 0.00 0.00 0.00 0.00 -2.81 0.00 0.00 176.34 173.53 2hgj n ALA 129 N 0.00 3.53 -3.06 1.59 0.00 -1.10 -4.90 120.51 116.57 2hgj n ALA 129 Ca 0.00 -3.41 -0.39 0.00 0.00 0.00 0.00 53.44 49.64 2hgj n ALA 129 Cb 0.00 -3.59 -0.12 0.00 0.00 0.00 0.00 19.45 15.74 2hgj n ALA 129 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 2hgj s PHE 130 N 5.52 3.25 1.11 0.00 2.99 -1.26 0.42 117.98 130.00 2hgj s PHE 130 Ca 0.57 -1.21 -0.20 0.00 0.00 0.00 0.00 56.93 56.08 2hgj s PHE 130 Cb 0.11 -2.34 0.07 0.00 0.00 0.00 0.00 43.02 40.86 2hgj s PHE 130 CO 0.08 -0.69 -0.21 -1.13 -0.00 0.00 0.00 175.22 173.27 2hgj n SER 131 N 4.89 -2.47 -0.09 1.36 3.41 -1.24 -4.40 113.62 115.08 2hgj n SER 131 Ca -0.12 -0.12 -0.11 0.00 -0.26 0.00 0.00 58.87 58.25 2hgj n SER 131 Cb 0.45 -0.88 -0.04 0.00 -0.26 0.00 0.00 64.21 63.48 2hgj n SER 131 CO 0.00 0.00 0.00 0.50 -0.16 0.00 0.00 175.04 175.38 2hgj h LYS 132 N -1.95 0.53 -0.98 4.33 1.63 -1.97 0.11 116.57 118.27 2hgj h LYS 132 Ca -0.52 -0.19 0.16 0.00 -0.85 0.00 0.00 60.65 59.25 2hgj h LYS 132 Cb 1.36 -0.03 -0.09 0.00 -0.60 0.00 0.00 32.23 32.87 2hgj h LYS 132 CO 0.36 0.72 0.61 1.03 -3.45 0.00 0.00 179.45 178.72 2hgj h SER 133 N 0.29 0.78 0.00 4.20 0.87 -1.91 -0.90 113.55 116.88 2hgj h SER 133 Ca 0.07 0.07 0.00 0.00 -1.23 0.00 0.00 61.79 60.70 2hgj h SER 133 Cb 0.52 -0.08 0.00 0.00 -0.44 0.00 0.00 62.40 62.40 2hgj h SER 133 CO 0.02 0.34 0.00 0.00 -0.53 0.00 0.00 176.83 176.67 2hgj n ALA 134 N -2.37 0.00 -0.22 6.23 0.00 0.20 -1.26 120.51 123.08 2hgj n ALA 134 Ca 0.21 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.69 2hgj n ALA 134 Cb 0.50 0.05 0.09 0.00 0.00 0.00 0.00 19.45 20.09 2hgj n ALA 134 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2hgj n LEU 135 N -0.43 -0.21 0.03 0.00 4.32 -0.14 -0.66 117.00 119.91 2hgj n LEU 135 Ca 0.00 1.07 -0.06 0.00 -0.02 0.00 0.00 56.01 57.00 2hgj n LEU 135 Cb 0.00 -0.33 -0.04 0.00 -1.62 0.00 0.00 43.42 41.43 2hgj n LEU 135 CO 0.00 -1.03 0.50 -0.33 -1.22 0.00 0.00 177.39 175.31 2hgj h GLU 136 N 0.00 -0.27 0.00 3.23 5.08 -1.05 0.98 114.58 122.55 2hgj h GLU 136 Ca 0.31 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.68 2hgj h GLU 136 Cb 0.48 0.06 0.00 0.00 0.50 0.00 0.00 28.75 29.79 2hgj h GLU 136 CO -0.64 -0.18 0.00 1.63 -1.00 0.00 0.00 179.01 178.82 2hgj n LYS 137 N -3.63 0.83 0.00 2.33 4.76 -0.07 -1.63 118.16 120.75 2hgj n LYS 137 Ca -0.03 0.00 -0.09 0.00 -2.87 0.00 0.00 58.31 55.32 2hgj n LYS 137 Cb 0.16 -1.50 -0.06 0.00 -1.84 0.00 0.00 35.03 31.79 2hgj n LYS 137 CO 0.00 0.00 0.00 1.25 -1.37 0.00 0.00 177.40 177.28 2hgj h LEU 138 N 0.00 -1.03 -0.22 -0.35 6.46 0.74 0.96 115.31 121.87 2hgj h LEU 138 Ca 0.00 0.12 0.03 0.00 -0.12 0.00 0.00 57.88 57.91 2hgj h LEU 138 Cb 0.02 0.40 -0.03 0.00 -0.73 0.00 0.00 40.66 40.32 2hgj h LEU 138 CO 0.00 -0.29 0.05 0.11 -0.62 0.00 0.00 178.44 177.68 2hgj h LYS 139 N -0.36 0.13 -0.40 1.25 1.57 -0.77 -1.04 116.57 116.95 2hgj h LYS 139 Ca 0.02 -0.01 0.06 0.00 -1.87 0.00 0.00 60.65 58.85 2hgj h LYS 139 Cb 0.41 -0.03 -0.09 0.00 0.08 0.00 0.00 32.23 32.61 2hgj h LYS 139 CO -0.25 0.09 -0.46 0.00 -0.57 0.00 0.00 179.45 178.25 2hgj h ALA 140 N 1.16 -0.52 0.00 3.86 0.00 -0.04 -2.67 119.26 121.05 2hgj h ALA 140 Ca 0.10 0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.96 2hgj h ALA 140 Cb 0.09 0.95 -0.01 0.00 0.00 0.00 0.00 17.79 18.82 2hgj h ALA 140 CO -0.13 -0.92 -0.68 0.00 0.00 0.00 0.00 179.25 177.52 2hgj h ALA 141 N 0.30 0.70 0.00 0.00 0.00 -0.97 -3.49 119.26 115.80 2hgj h ALA 141 Ca 0.12 -0.42 0.00 0.00 0.00 0.00 0.00 54.91 54.61 2hgj h ALA 141 Cb 0.59 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.40 2hgj h ALA 141 CO -0.57 0.52 0.00 0.41 0.00 0.00 0.00 179.25 179.61 2hgj n GLY 142 N 1.24 -2.30 0.00 0.00 0.00 -0.39 -5.03 105.19 98.70 2hgj n GLY 142 Ca -0.01 -1.10 0.00 0.00 0.00 0.00 0.00 46.02 44.92 2hgj n GLY 142 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2hgj n GLY 143 N -0.01 -0.71 3.28 -0.02 0.00 -1.26 -4.74 105.19 101.73 2hgj n GLY 143 Ca 0.00 -1.48 -0.33 0.00 0.00 0.00 0.00 46.02 44.21 2hgj n GLY 143 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2hgj s GLU 144 N -1.94 3.20 0.19 1.61 2.02 -1.07 -4.51 118.70 118.20 2hgj s GLU 144 Ca 0.00 -0.78 0.06 0.00 0.02 0.00 0.00 54.97 54.27 2hgj s GLU 144 Cb 0.00 -2.48 -0.04 0.00 0.10 0.00 0.00 34.13 31.71 2hgj s GLU 144 CO 0.00 0.17 0.11 -1.25 0.02 0.00 0.00 175.26 174.31 2hgj s PRO 145 N 0.42 2.77 0.13 0.39 0.04 -1.26 -0.23 135.00 137.26 2hgj s PRO 145 Ca -0.14 -0.98 -0.22 0.00 0.04 0.00 0.00 61.00 59.70 2hgj s PRO 145 Cb -0.17 -2.55 0.06 0.00 0.04 0.00 0.00 34.50 31.89 2hgj s PRO 145 CO 0.06 0.46 0.56 0.08 0.04 0.00 0.00 177.00 178.20 2hgj s VAL 146 N -1.85 0.02 -0.29 -0.36 1.01 -1.26 -4.54 120.40 113.13 2hgj s VAL 146 Ca 0.31 -0.14 -0.14 0.00 0.00 0.00 0.00 61.98 62.01 2hgj s VAL 146 Cb -0.09 -1.03 0.10 0.00 0.00 0.00 0.00 36.38 35.36 2hgj s VAL 146 CO 0.22 -0.08 0.67 -0.76 0.00 0.00 0.00 175.10 175.16 2hgj s LEU 147 N -2.58 -1.01 0.25 3.92 2.01 -1.26 -1.18 118.68 118.83 2hgj s LEU 147 Ca -0.00 1.53 0.10 0.00 0.01 0.00 0.00 54.13 55.77 2hgj s LEU 147 Cb -0.00 2.34 -0.05 0.00 0.01 0.00 0.00 46.19 48.49 2hgj s LEU 147 CO -0.10 -0.23 -0.18 -0.22 1.01 0.00 0.00 176.35 176.63 2hgj s LEU 148 N 2.11 2.58 0.00 1.79 0.20 -1.26 -5.14 118.68 118.96 2hgj s LEU 148 Ca -0.08 -1.03 0.00 0.00 0.69 0.00 0.00 54.13 53.71 2hgj s LEU 148 Cb -0.08 -0.93 0.00 0.00 -0.43 0.00 0.00 46.19 44.75 2hgj s LEU 148 CO -0.19 -0.04 0.00 1.21 -0.29 0.00 0.00 176.35 177.03 2hgj n GLU 149 N -0.52 3.20 0.00 1.98 0.00 -1.26 -5.21 120.64 118.82 2hgj n GLU 149 Ca -0.06 0.00 0.09 0.00 0.00 0.00 0.00 57.16 57.19 2hgj n GLU 149 Cb 0.60 0.00 0.52 0.00 0.00 0.00 0.00 31.44 32.56 2hgj n GLU 149 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13