#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hgq n ILE 2 N 0.00 0.00 0.00 3.17 -6.64 -1.26 -4.48 119.36 110.15 2hgq n ILE 2 Ca 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 62.75 60.98 2hgq n ILE 2 Cb 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 39.64 38.20 2hgq n ILE 2 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 2hgq n GLN 3 N 0.00 0.00 0.00 6.28 -0.00 -1.26 -4.85 117.38 117.56 2hgq n GLN 3 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.00 57.00 2hgq n GLN 3 Cb 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 30.24 30.24 2hgq n GLN 3 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.06 176.71 2hgq n PRO 4 N -0.55 0.00 -1.74 2.61 -0.04 -1.26 -1.58 135.00 132.44 2hgq n PRO 4 Ca 0.00 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 63.04 2hgq n PRO 4 Cb 0.00 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 33.43 2hgq n PRO 4 CO 0.00 0.00 0.00 -1.14 -0.04 0.00 0.00 175.50 174.32 2hgq s GLN 5 N 0.00 4.15 -0.18 0.54 0.74 -1.12 -4.10 119.66 119.69 2hgq s GLN 5 Ca 0.00 2.55 -0.16 0.00 0.05 0.00 0.00 55.36 57.79 2hgq s GLN 5 Cb 0.00 -3.86 0.05 0.00 1.10 0.00 0.00 33.01 30.30 2hgq s GLN 5 CO 0.00 -0.88 0.48 -0.08 -0.55 0.00 0.00 175.29 174.26 2hgq s THR 6 N 3.53 -0.00 -0.98 -0.34 -1.32 -0.28 -4.87 115.64 111.38 2hgq s THR 6 Ca 0.83 0.00 -0.16 0.00 -1.21 0.00 0.00 61.69 61.15 2hgq s THR 6 Cb -0.43 -0.67 0.17 0.00 -1.51 0.00 0.00 72.50 70.06 2hgq s THR 6 CO 0.38 0.00 1.11 -0.31 -2.21 0.00 0.00 174.62 173.59 2hgq s TYR 7 N 0.30 3.46 0.41 9.09 1.51 -1.25 -0.96 117.35 129.91 2hgq s TYR 7 Ca -0.00 -1.82 0.07 0.00 -1.01 0.00 0.00 57.07 54.31 2hgq s TYR 7 Cb -0.03 -4.14 -0.04 0.00 -0.11 0.00 0.00 41.96 37.63 2hgq s TYR 7 CO 0.00 -1.30 0.23 -1.17 -1.11 0.00 0.00 175.55 172.20 2hgq s LEU 8 N 1.48 3.18 0.21 -1.29 1.98 0.37 -4.94 118.68 119.67 2hgq s LEU 8 Ca 0.31 -1.00 0.07 0.00 -2.89 0.00 0.00 54.13 50.62 2hgq s LEU 8 Cb -0.06 -1.58 -0.04 0.00 0.66 0.00 0.00 46.19 45.17 2hgq s LEU 8 CO -0.07 -0.57 0.12 -1.61 -1.89 0.00 0.00 176.35 172.33 2hgq s GLU 9 N -3.96 2.77 0.00 1.98 0.41 0.29 -2.39 118.70 117.80 2hgq s GLU 9 Ca 0.43 -1.03 0.00 0.00 -0.41 0.00 0.00 54.97 53.96 2hgq s GLU 9 Cb 0.02 -2.52 0.00 0.00 -1.78 0.00 0.00 34.13 29.85 2hgq s GLU 9 CO 0.24 0.44 0.00 1.55 -0.49 0.00 0.00 175.26 177.00 2hgq n VAL 10 N -0.67 0.00 0.00 2.63 3.14 1.01 -0.76 118.33 123.68 2hgq n VAL 10 Ca -0.08 0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.30 2hgq n VAL 10 Cb 0.56 0.00 0.00 0.00 -1.06 0.00 0.00 33.84 33.34 2hgq n VAL 10 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 2hgq n ALA 11 N -3.00 0.00 -1.89 1.55 0.00 -1.26 -4.59 120.51 111.31 2hgq n ALA 11 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2hgq n ALA 11 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2hgq n ALA 11 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2hgq n ASP 12 N 0.00 0.00 -1.42 0.00 8.00 -1.26 -3.37 116.55 118.49 2hgq n ASP 12 Ca 0.00 0.00 0.06 0.00 0.71 0.00 0.00 54.79 55.56 2hgq n ASP 12 Cb 0.00 0.00 0.29 0.00 -0.02 0.00 0.00 41.12 41.39 2hgq n ASP 12 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 2hgq n ASN 13 N 0.00 4.18 -0.99 -2.24 2.85 -1.26 -4.76 115.26 113.04 2hgq n ASN 13 Ca 0.00 -2.52 -0.09 0.00 -0.11 0.00 0.00 54.58 51.86 2hgq n ASN 13 Cb 0.00 -0.57 0.01 0.00 1.24 0.00 0.00 39.78 40.45 2hgq n ASN 13 CO 0.00 0.00 0.00 0.35 -2.11 0.00 0.00 177.26 175.50 2hgq n THR 14 N 0.65 0.00 0.06 -0.44 -2.24 -1.26 -4.55 114.28 106.50 2hgq n THR 14 Ca 0.20 -0.12 -0.22 0.00 -2.27 0.00 0.00 64.05 61.64 2hgq n THR 14 Cb 0.84 0.00 -0.15 0.00 -2.10 0.00 0.00 70.33 68.92 2hgq n THR 14 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 2hgq h GLY 15 N -0.13 0.42 -5.15 3.38 0.00 -1.84 -3.46 103.07 96.29 2hgq h GLY 15 Ca -0.10 -1.06 -0.09 0.00 0.00 0.00 0.00 47.33 46.08 2hgq h GLY 15 CO 0.08 0.93 -0.09 0.00 0.00 0.00 0.00 176.54 177.46 2hgq s ALA 16 N -2.52 -1.33 -0.82 3.60 0.00 -0.70 -3.06 121.76 116.93 2hgq s ALA 16 Ca -0.15 1.54 0.00 0.00 0.00 0.00 0.00 51.96 53.34 2hgq s ALA 16 Cb 0.04 -0.89 0.00 0.00 0.00 0.00 0.00 23.12 22.26 2hgq s ALA 16 CO 0.84 -0.26 0.00 -2.13 0.00 0.00 0.00 175.76 174.22 2hgq n ARG 17 N 2.88 0.00 -4.04 0.00 0.63 -1.26 -4.48 116.66 110.39 2hgq n ARG 17 Ca -0.14 0.00 -0.18 0.00 -0.92 0.00 0.00 57.85 56.61 2hgq n ARG 17 Cb 0.56 -0.87 -0.16 0.00 0.45 0.00 0.00 32.46 32.44 2hgq n ARG 17 CO 0.00 0.00 0.00 0.21 -2.51 0.00 0.00 177.63 175.33 2hgq s LYS 18 N -0.82 0.54 0.10 -0.14 2.20 -1.25 0.33 119.74 120.71 2hgq s LYS 18 Ca 0.00 -0.01 -0.02 0.00 -0.36 0.00 0.00 55.97 55.59 2hgq s LYS 18 Cb 0.00 -0.64 -0.04 0.00 -1.51 0.00 0.00 37.83 35.64 2hgq s LYS 18 CO 0.00 -0.11 0.04 0.96 -0.36 0.00 0.00 175.35 175.88 2hgq s ILE 19 N 0.96 0.15 -0.16 5.43 -5.25 -1.01 -1.15 121.20 120.18 2hgq s ILE 19 Ca -0.11 -1.83 -0.01 0.00 -0.99 0.00 0.00 60.65 57.72 2hgq s ILE 19 Cb -0.14 -1.82 -0.01 0.00 2.95 0.00 0.00 42.46 43.44 2hgq s ILE 19 CO -0.01 -0.66 -0.11 -0.32 -1.79 0.00 0.00 174.94 172.05 2hgq s MET 20 N -3.99 3.37 0.31 0.37 1.75 0.07 -0.48 119.30 120.70 2hgq s MET 20 Ca 0.17 -0.67 0.01 0.00 -1.25 0.00 0.00 55.69 53.95 2hgq s MET 20 Cb 0.07 -2.74 -0.03 0.00 2.84 0.00 0.00 34.83 34.97 2hgq s MET 20 CO -0.03 0.07 0.50 0.00 -0.65 0.00 0.00 175.02 174.92 2hgq n ILE 22 N -1.60 0.00 -3.27 0.00 5.41 0.26 -1.12 119.36 119.04 2hgq n ILE 22 Ca -0.05 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.70 2hgq n ILE 22 Cb 0.56 -0.26 0.00 0.00 -0.71 0.00 0.00 39.64 39.23 2hgq n ILE 22 CO 0.00 0.00 0.00 -2.11 0.00 0.00 0.00 176.55 174.44 2hgq n ARG 23 N -0.52 0.00 -2.75 0.38 -4.01 -1.26 -2.78 116.66 105.73 2hgq n ARG 23 Ca 0.00 0.00 -0.40 0.00 -1.04 0.00 0.00 57.85 56.41 2hgq n ARG 23 Cb 0.00 0.00 -0.06 0.00 -3.04 0.00 0.00 32.46 29.36 2hgq n ARG 23 CO 0.00 0.00 0.00 0.14 -3.04 0.00 0.00 177.63 174.73 2hgq s VAL 24 N -1.50 4.13 -0.95 8.89 -7.23 -1.26 -1.56 120.40 120.91 2hgq s VAL 24 Ca 0.00 2.09 0.28 0.00 -1.81 0.00 0.00 61.98 62.54 2hgq s VAL 24 Cb 0.00 -4.33 0.25 0.00 0.56 0.00 0.00 36.38 32.86 2hgq s VAL 24 CO 0.00 0.48 1.90 -0.11 -0.31 0.00 0.00 175.10 177.05 2hgq n LEU 25 N 1.66 0.15 0.00 1.32 0.00 -0.04 -4.62 117.00 115.46 2hgq n LEU 25 Ca -0.01 0.51 0.00 0.00 0.00 0.00 0.00 56.01 56.51 2hgq n LEU 25 Cb 0.47 -0.47 0.00 0.00 0.00 0.00 0.00 43.42 43.43 2hgq n LEU 25 CO 0.50 -0.03 0.00 2.29 0.00 0.00 0.00 177.39 180.15 2hgq n LYS 26 N -1.63 2.90 -2.28 1.96 2.85 -1.26 -4.83 118.16 115.87 2hgq n LYS 26 Ca 0.07 0.00 -0.34 0.00 -1.05 0.00 0.00 58.31 56.99 2hgq n LYS 26 Cb 0.36 0.00 -0.04 0.00 -0.65 0.00 0.00 35.03 34.70 2hgq n LYS 26 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 177.40 177.55 2hgq s GLY 27 N 0.00 0.65 0.00 2.58 0.00 -1.26 -4.77 107.32 104.52 2hgq s GLY 27 Ca 0.00 -1.74 0.00 0.00 0.00 0.00 0.00 44.72 42.98 2hgq s GLY 27 CO 0.00 3.11 0.00 1.44 0.00 0.00 0.00 173.10 177.65 2hgq n SER 28 N 11.57 0.00 0.00 1.64 7.64 -1.26 -4.28 113.62 128.93 2hgq n SER 28 Ca 0.34 0.00 0.00 0.00 1.01 0.00 0.00 58.87 60.22 2hgq n SER 28 Cb 0.49 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.69 2hgq n SER 28 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 2hgq n ASN 29 N 0.00 0.00 0.00 6.43 2.85 -1.26 -5.14 115.26 118.14 2hgq n ASN 29 Ca 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 54.58 54.47 2hgq n ASN 29 Cb 0.00 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.02 2hgq n ASN 29 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 2hgq n ALA 30 N 0.00 0.00 -0.86 5.20 0.00 -1.26 -4.85 120.51 118.74 2hgq n ALA 30 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2hgq n ALA 30 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2hgq n ALA 30 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2hgq n LYS 31 N 0.00 -0.13 -3.05 0.00 5.02 -1.26 -4.89 118.16 113.85 2hgq n LYS 31 Ca 0.00 0.03 -0.12 0.00 -2.02 0.00 0.00 58.31 56.21 2hgq n LYS 31 Cb 0.00 -3.27 -0.03 0.00 -0.02 0.00 0.00 35.03 31.70 2hgq n LYS 31 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 2hgq s TYR 32 N -2.73 -0.72 -0.85 2.13 2.02 -1.26 -4.54 117.35 111.39 2hgq s TYR 32 Ca 0.00 -1.01 -0.25 0.00 -0.37 0.00 0.00 57.07 55.44 2hgq s TYR 32 Cb 0.00 -0.11 -0.08 0.00 -0.40 0.00 0.00 41.96 41.37 2hgq s TYR 32 CO 0.00 -1.11 2.13 0.00 -1.57 0.00 0.00 175.55 175.00 2hgq s ALA 33 N 0.81 1.29 0.24 3.71 0.00 -0.61 -4.81 121.76 122.39 2hgq s ALA 33 Ca 0.28 -1.21 0.01 0.00 0.00 0.00 0.00 51.96 51.05 2hgq s ALA 33 Cb -0.01 -4.56 -0.04 0.00 0.00 0.00 0.00 23.12 18.51 2hgq s ALA 33 CO -0.09 -5.23 0.41 0.99 0.00 0.00 0.00 175.76 171.84 2hgq s THR 34 N 11.93 5.21 0.05 0.00 2.01 -1.26 -4.09 115.64 129.48 2hgq s THR 34 Ca 0.79 -0.58 -0.38 0.00 0.31 0.00 0.00 61.69 61.83 2hgq s THR 34 Cb -0.09 -3.80 -0.18 0.00 0.01 0.00 0.00 72.50 68.44 2hgq s THR 34 CO 0.03 -0.30 1.21 1.33 -0.69 0.00 0.00 174.62 176.20 2hgq n VAL 35 N -1.11 0.06 -2.10 3.82 0.24 -1.26 -0.77 118.33 117.21 2hgq n VAL 35 Ca -0.06 -0.01 -0.18 0.00 -2.04 0.00 0.00 64.34 62.05 2hgq n VAL 35 Cb 0.55 -0.46 -0.03 0.00 -1.47 0.00 0.00 33.84 32.43 2hgq n VAL 35 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2hgq n GLY 36 N 2.06 0.25 1.14 7.63 0.00 0.29 -4.98 105.19 111.58 2hgq n GLY 36 Ca 0.19 -0.14 -0.07 0.00 0.00 0.00 0.00 46.02 46.00 2hgq n GLY 36 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2hgq n ASP 37 N -1.27 1.14 -3.89 1.61 8.00 0.05 -4.78 116.55 117.43 2hgq n ASP 37 Ca -0.20 -1.52 -0.19 0.00 0.71 0.00 0.00 54.79 53.59 2hgq n ASP 37 Cb 0.64 -0.06 -0.16 0.00 -0.02 0.00 0.00 41.12 41.52 2hgq n ASP 37 CO 0.00 0.00 0.00 0.68 -0.39 0.00 0.00 177.20 177.49 2hgq s VAL 38 N -0.49 0.46 0.00 2.53 -7.23 -1.25 -0.25 120.40 114.17 2hgq s VAL 38 Ca 0.13 -0.10 0.00 0.00 -1.81 0.00 0.00 61.98 60.20 2hgq s VAL 38 Cb -0.01 -0.49 0.00 0.00 0.56 0.00 0.00 36.38 36.44 2hgq s VAL 38 CO 0.08 0.20 0.00 2.30 -0.31 0.00 0.00 175.10 177.37 2hgq n ILE 39 N 3.95 0.00 -4.67 -0.62 -0.00 -0.13 -0.86 119.36 117.02 2hgq n ILE 39 Ca -0.25 0.00 -0.33 0.00 -0.00 0.00 0.00 62.75 62.17 2hgq n ILE 39 Cb 0.51 0.00 -0.12 0.00 -0.00 0.00 0.00 39.64 40.04 2hgq n ILE 39 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 176.55 177.09 2hgq s VAL 40 N -2.09 3.46 0.12 7.28 0.11 -0.60 -1.12 120.40 127.55 2hgq s VAL 40 Ca 0.00 -0.64 -0.26 0.00 -2.93 0.00 0.00 61.98 58.15 2hgq s VAL 40 Cb 0.00 -2.42 0.08 0.00 -1.53 0.00 0.00 36.38 32.51 2hgq s VAL 40 CO 0.00 0.55 1.05 0.00 -3.33 0.00 0.00 175.10 173.37 2hgq s ALA 41 N -0.83 -1.79 0.37 1.54 0.00 0.08 -0.57 121.76 120.55 2hgq s ALA 41 Ca 0.13 0.20 0.04 0.00 0.00 0.00 0.00 51.96 52.33 2hgq s ALA 41 Cb -0.11 0.59 -0.05 0.00 0.00 0.00 0.00 23.12 23.55 2hgq s ALA 41 CO 0.02 -1.05 0.07 0.45 0.00 0.00 0.00 175.76 175.25 2hgq s SER 42 N -3.02 2.71 0.55 0.00 0.15 -0.23 -0.40 113.70 113.45 2hgq s SER 42 Ca 0.14 -1.47 -0.15 0.00 0.70 0.00 0.00 55.95 55.16 2hgq s SER 42 Cb -0.00 0.09 -0.07 0.00 -1.71 0.00 0.00 66.02 64.33 2hgq s SER 42 CO 0.01 -0.70 1.00 0.54 1.20 0.00 0.00 173.24 175.30 2hgq s VAL 43 N -3.21 4.47 0.05 4.45 0.11 -0.34 -0.75 120.40 125.18 2hgq s VAL 43 Ca 0.31 1.11 0.00 0.00 -2.93 0.00 0.00 61.98 60.47 2hgq s VAL 43 Cb 0.07 -3.70 0.00 0.00 -1.53 0.00 0.00 36.38 31.22 2hgq s VAL 43 CO 0.14 -0.75 0.00 1.17 -3.33 0.00 0.00 175.10 172.33 2hgq n LYS 44 N -1.86 0.00 -3.07 1.54 4.81 -0.30 -4.57 118.16 114.71 2hgq n LYS 44 Ca 0.07 0.00 -0.33 0.00 -0.87 0.00 0.00 58.31 57.18 2hgq n LYS 44 Cb 0.54 -0.44 -0.06 0.00 0.02 0.00 0.00 35.03 35.08 2hgq n LYS 44 CO 0.00 0.00 0.00 -1.21 1.17 0.00 0.00 177.40 177.36 2hgq s GLU 45 N -2.00 4.07 0.20 1.64 2.02 -0.34 -5.01 118.70 119.27 2hgq s GLU 45 Ca 0.00 0.78 -0.01 0.00 0.02 0.00 0.00 54.97 55.76 2hgq s GLU 45 Cb 0.00 -2.41 0.02 0.00 0.10 0.00 0.00 34.13 31.84 2hgq s GLU 45 CO 0.00 0.13 0.04 0.00 0.02 0.00 0.00 175.26 175.45 2hgq n ALA 46 N -0.35 -0.24 -2.95 5.21 0.00 -1.26 -3.78 120.51 117.15 2hgq n ALA 46 Ca 0.04 -0.07 0.02 0.00 0.00 0.00 0.00 53.44 53.43 2hgq n ALA 46 Cb 0.53 -0.01 0.00 0.00 0.00 0.00 0.00 19.45 19.98 2hgq n ALA 46 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 2hgq s ILE 47 N -0.71 -0.45 0.49 0.00 2.07 -1.17 -1.72 121.20 119.70 2hgq s ILE 47 Ca 0.03 0.00 -0.22 0.00 -1.41 0.00 0.00 60.65 59.05 2hgq s ILE 47 Cb -0.01 -0.09 -0.08 0.00 0.13 0.00 0.00 42.46 42.41 2hgq s ILE 47 CO 0.03 0.00 1.05 -0.81 -1.91 0.00 0.00 174.94 173.29 2hgq n PRO 48 N 4.17 1.32 0.00 3.50 -0.04 -1.26 -4.62 135.00 138.06 2hgq n PRO 48 Ca 0.07 0.48 0.00 0.00 -0.04 0.00 0.00 63.50 64.02 2hgq n PRO 48 Cb 0.60 -2.16 0.00 0.00 -0.04 0.00 0.00 33.50 31.90 2hgq n PRO 48 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2hgq n ARG 49 N -0.29 0.00 -1.87 0.54 5.12 -1.26 -4.90 116.66 114.00 2hgq n ARG 49 Ca 0.10 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 56.02 2hgq n ARG 49 Cb 0.42 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.72 2hgq n ARG 49 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2hgq n GLY 50 N 0.00 -4.58 0.00 -0.13 0.00 -1.26 -4.61 105.19 94.61 2hgq n GLY 50 Ca 0.00 -0.40 0.07 0.00 0.00 0.00 0.00 46.02 45.69 2hgq n GLY 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2hgq n ALA 51 N 0.33 2.09 -1.00 4.61 0.00 -1.26 -4.11 120.51 121.17 2hgq n ALA 51 Ca 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 53.44 53.35 2hgq n ALA 51 Cb 0.00 -1.22 0.00 0.00 0.00 0.00 0.00 19.45 18.23 2hgq n ALA 51 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 2hgq n VAL 52 N -0.93 0.00 0.00 0.00 0.24 -1.26 -5.04 118.33 111.34 2hgq n VAL 52 Ca 0.10 0.89 0.00 0.00 -2.04 0.00 0.00 64.34 63.30 2hgq n VAL 52 Cb 0.05 -1.80 0.00 0.00 -1.47 0.00 0.00 33.84 30.62 2hgq n VAL 52 CO 0.00 0.00 0.00 2.29 -2.14 0.00 0.00 176.83 176.98 2hgq n LYS 53 N -0.47 0.00 -2.00 7.34 2.85 -1.26 -4.75 118.16 119.87 2hgq n LYS 53 Ca 0.00 0.00 -0.32 0.00 -1.05 0.00 0.00 58.31 56.94 2hgq n LYS 53 Cb 0.00 0.00 0.03 0.00 -0.65 0.00 0.00 35.03 34.41 2hgq n LYS 53 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 2hgq n GLU 54 N -0.00 3.11 0.00 -1.58 -0.58 -1.26 -4.69 120.64 115.64 2hgq n GLU 54 Ca 0.00 -3.91 0.00 0.00 -0.42 0.00 0.00 57.16 52.83 2hgq n GLU 54 Cb 0.00 -2.27 0.00 0.00 -0.57 0.00 0.00 31.44 28.60 2hgq n GLU 54 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2hgq n GLY 55 N -0.62 0.55 3.62 0.62 0.00 -1.26 -4.56 105.19 103.54 2hgq n GLY 55 Ca 0.49 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.50 2hgq n GLY 55 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2hgq s ASP 56 N -1.00 -0.48 0.00 1.61 1.47 -1.25 -1.19 116.67 115.83 2hgq s ASP 56 Ca 0.00 0.75 0.00 0.00 1.18 0.00 0.00 52.55 54.48 2hgq s ASP 56 Cb 0.00 1.24 0.00 0.00 -0.34 0.00 0.00 42.92 43.82 2hgq s ASP 56 CO 0.00 -0.12 0.00 1.33 0.68 0.00 0.00 175.17 177.06 2hgq n VAL 57 N 3.80 0.00 -4.16 2.11 0.24 0.46 -4.91 118.33 115.87 2hgq n VAL 57 Ca -0.17 0.00 -0.12 0.00 -2.04 0.00 0.00 64.34 62.00 2hgq n VAL 57 Cb 0.57 0.00 -0.08 0.00 -1.47 0.00 0.00 33.84 32.86 2hgq n VAL 57 CO 0.00 0.00 0.00 0.68 -2.14 0.00 0.00 176.83 175.37 2hgq s VAL 58 N 0.65 0.00 -0.34 3.34 -7.23 -1.26 -0.74 120.40 114.82 2hgq s VAL 58 Ca 0.00 -1.85 0.00 0.00 -1.81 0.00 0.00 61.98 58.32 2hgq s VAL 58 Cb 0.00 -2.45 0.00 0.00 0.56 0.00 0.00 36.38 34.49 2hgq s VAL 58 CO 0.00 0.00 0.00 2.29 -0.31 0.00 0.00 175.10 177.08 2hgq n LYS 59 N -0.36 0.00 -4.76 4.82 0.00 -0.28 -0.63 118.16 116.95 2hgq n LYS 59 Ca 0.02 0.00 -0.25 0.00 -0.00 0.00 0.00 58.31 58.08 2hgq n LYS 59 Cb 0.64 0.00 -0.16 0.00 -0.00 0.00 0.00 35.03 35.51 2hgq n LYS 59 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 2hgq s ALA 60 N -1.00 1.41 -0.33 0.58 0.00 -0.34 -0.96 121.76 121.13 2hgq s ALA 60 Ca 0.00 -0.63 -0.32 0.00 0.00 0.00 0.00 51.96 51.01 2hgq s ALA 60 Cb 0.00 -0.47 -0.09 0.00 0.00 0.00 0.00 23.12 22.56 2hgq s ALA 60 CO 0.00 0.26 2.24 0.28 0.00 0.00 0.00 175.76 178.54 2hgq n VAL 61 N 3.15 0.21 -5.16 0.00 0.31 0.66 -0.45 118.33 117.05 2hgq n VAL 61 Ca -0.18 -0.38 -0.29 0.00 -0.01 0.00 0.00 64.34 63.48 2hgq n VAL 61 Cb 0.53 -2.07 -0.16 0.00 -0.91 0.00 0.00 33.84 31.23 2hgq n VAL 61 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 2hgq s VAL 62 N 8.23 1.85 0.00 2.52 1.01 0.58 -0.54 120.40 134.04 2hgq s VAL 62 Ca 1.06 -0.99 0.00 0.00 0.00 0.00 0.00 61.98 62.05 2hgq s VAL 62 Cb -0.61 -1.54 0.00 0.00 0.00 0.00 0.00 36.38 34.23 2hgq s VAL 62 CO 0.42 0.52 0.00 1.33 0.00 0.00 0.00 175.10 177.37 2hgq n VAL 63 N 2.61 0.00 0.00 2.92 0.24 -1.25 -1.19 118.33 121.66 2hgq n VAL 63 Ca -0.16 0.00 0.00 0.00 -2.04 0.00 0.00 64.34 62.14 2hgq n VAL 63 Cb 0.52 0.00 0.00 0.00 -1.47 0.00 0.00 33.84 32.89 2hgq n VAL 63 CO 0.00 0.00 0.00 -2.11 -2.14 0.00 0.00 176.83 172.58 2hgq n ARG 64 N 0.00 0.00 -1.83 7.34 1.85 -0.35 -4.63 116.66 119.04 2hgq n ARG 64 Ca 0.00 0.00 -0.02 0.00 -1.00 0.00 0.00 57.85 56.83 2hgq n ARG 64 Cb 0.00 0.00 0.00 0.00 -1.05 0.00 0.00 32.46 31.41 2hgq n ARG 64 CO 0.00 0.00 0.00 2.41 -0.01 0.00 0.00 177.63 180.03 2hgq n THR 65 N 0.00 -4.07 0.00 8.89 -1.04 -1.25 -3.18 114.28 113.64 2hgq n THR 65 Ca 0.00 0.18 0.00 0.00 -2.04 0.00 0.00 64.05 62.19 2hgq n THR 65 Cb 0.00 -4.74 0.00 0.00 -1.82 0.00 0.00 70.33 63.77 2hgq n THR 65 CO 0.00 0.00 0.00 1.17 -0.64 0.00 0.00 175.07 175.60 2hgq n LYS 66 N -0.55 0.00 -1.20 -2.82 3.00 -1.26 -3.34 118.16 111.98 2hgq n LYS 66 Ca 0.02 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.33 2hgq n LYS 66 Cb 0.17 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.20 2hgq n LYS 66 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.40 179.03 2hgq n LYS 67 N 0.00 0.00 -3.14 1.64 4.76 -1.26 -4.85 118.16 115.30 2hgq n LYS 67 Ca 0.00 0.40 -0.45 0.00 -2.87 0.00 0.00 58.31 55.39 2hgq n LYS 67 Cb 0.00 -0.80 -0.04 0.00 -1.84 0.00 0.00 35.03 32.35 2hgq n LYS 67 CO 0.00 0.00 0.00 -1.83 -1.37 0.00 0.00 177.40 174.20 2hgq s GLU 68 N -0.52 3.21 -0.42 1.97 -1.05 -0.36 -5.00 118.70 116.52 2hgq s GLU 68 Ca 0.00 -1.61 -0.14 0.00 -0.15 0.00 0.00 54.97 53.06 2hgq s GLU 68 Cb 0.00 -4.38 0.04 0.00 -0.44 0.00 0.00 34.13 29.34 2hgq s GLU 68 CO 0.00 -1.51 0.31 0.08 0.95 0.00 0.00 175.26 175.09 2hgq s VAL 69 N 2.14 5.12 0.41 1.83 1.01 -1.26 -1.52 120.40 128.13 2hgq s VAL 69 Ca 0.14 -0.82 0.03 0.00 0.00 0.00 0.00 61.98 61.33 2hgq s VAL 69 Cb -0.20 -3.92 -0.00 0.00 0.00 0.00 0.00 36.38 32.26 2hgq s VAL 69 CO 0.01 -0.38 0.59 -0.54 0.00 0.00 0.00 175.10 174.79 2hgq s LYS 70 N 1.64 3.02 0.22 2.72 1.02 -0.32 -4.97 119.74 123.08 2hgq s LYS 70 Ca 0.04 -0.78 -0.12 0.00 0.02 0.00 0.00 55.97 55.14 2hgq s LYS 70 Cb -0.21 -2.67 0.28 0.00 -0.52 0.00 0.00 37.83 34.72 2hgq s LYS 70 CO 0.08 -0.17 1.63 0.00 -0.92 0.00 0.00 175.35 175.97 2hgq h ARG 71 N 0.59 0.02 -0.39 1.68 3.08 -1.99 0.68 114.38 118.04 2hgq h ARG 71 Ca -0.45 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.60 2hgq h ARG 71 Cb 1.26 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.30 2hgq h ARG 71 CO 0.54 0.01 0.00 -0.35 -1.07 0.00 0.00 179.97 179.11 2hgq n PRO 72 N -5.42 0.98 -3.50 0.04 -0.04 -1.26 -4.78 135.00 121.03 2hgq n PRO 72 Ca 0.09 0.00 -0.20 0.00 -0.04 0.00 0.00 63.50 63.35 2hgq n PRO 72 Cb 0.36 -1.20 0.08 0.00 -0.04 0.00 0.00 33.50 32.71 2hgq n PRO 72 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2hgq n ASP 73 N -0.30 -4.47 -4.88 3.54 8.00 0.23 -4.93 116.55 113.75 2hgq n ASP 73 Ca 0.00 -0.56 -0.33 0.00 0.71 0.00 0.00 54.79 54.61 2hgq n ASP 73 Cb 0.10 -4.97 -0.05 0.00 -0.02 0.00 0.00 41.12 36.18 2hgq n ASP 73 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 2hgq s GLY 74 N -3.75 2.30 -0.01 0.44 0.00 -1.24 -4.92 107.32 100.15 2hgq s GLY 74 Ca 0.33 -0.39 0.00 0.00 0.00 0.00 0.00 44.72 44.65 2hgq s GLY 74 CO 0.71 -0.24 0.00 -1.35 0.00 0.00 0.00 173.10 172.23 2hgq s SER 75 N -2.13 0.05 0.24 1.64 1.04 -1.26 -1.17 113.70 112.11 2hgq s SER 75 Ca 0.40 0.00 -0.22 0.00 0.48 0.00 0.00 55.95 56.61 2hgq s SER 75 Cb -0.13 -0.03 0.04 0.00 0.10 0.00 0.00 66.02 66.01 2hgq s SER 75 CO 0.21 -0.03 0.81 0.00 0.98 0.00 0.00 173.24 175.21 2hgq s ALA 76 N 0.27 -1.35 -0.28 5.32 0.00 -0.58 -5.03 121.76 120.11 2hgq s ALA 76 Ca -0.02 -0.19 -0.16 0.00 0.00 0.00 0.00 51.96 51.59 2hgq s ALA 76 Cb -0.03 0.77 0.09 0.00 0.00 0.00 0.00 23.12 23.94 2hgq s ALA 76 CO -0.01 -1.04 0.70 -1.50 0.00 0.00 0.00 175.76 173.92 2hgq s ILE 77 N -3.60 -0.04 -0.06 0.00 2.07 -1.26 -1.22 121.20 117.09 2hgq s ILE 77 Ca 0.12 0.00 0.03 0.00 -1.41 0.00 0.00 60.65 59.39 2hgq s ILE 77 Cb -0.04 -1.00 -0.02 0.00 0.13 0.00 0.00 42.46 41.52 2hgq s ILE 77 CO 0.06 0.00 -0.14 0.00 -1.91 0.00 0.00 174.94 172.95 2hgq s ARG 78 N 1.68 2.64 -1.50 3.50 3.03 -1.26 -4.98 118.95 122.06 2hgq s ARG 78 Ca -0.10 -0.68 -0.12 0.00 2.03 0.00 0.00 55.73 56.86 2hgq s ARG 78 Cb -0.05 -2.43 0.01 0.00 -1.03 0.00 0.00 34.95 31.45 2hgq s ARG 78 CO -0.20 0.57 2.47 1.19 -1.13 0.00 0.00 175.30 178.21 2hgq n PHE 79 N 2.47 3.02 -3.57 5.89 3.01 -1.26 -3.76 117.46 123.26 2hgq n PHE 79 Ca -0.17 -2.99 -0.15 0.00 1.01 0.00 0.00 57.45 55.15 2hgq n PHE 79 Cb 0.52 -2.43 -0.06 0.00 -0.01 0.00 0.00 39.48 37.50 2hgq n PHE 79 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 2hgq s ASP 80 N 2.43 -0.59 -0.19 4.37 2.15 -1.26 -5.11 116.67 118.47 2hgq s ASP 80 Ca 0.55 0.81 -0.02 0.00 0.43 0.00 0.00 52.55 54.32 2hgq s ASP 80 Cb 0.15 0.71 0.06 0.00 -0.30 0.00 0.00 42.92 43.54 2hgq s ASP 80 CO -0.07 -0.42 0.02 -1.81 -0.17 0.00 0.00 175.17 172.72 2hgq s ASP 81 N -0.69 2.93 -0.11 -0.34 -0.00 -1.26 -1.21 116.67 115.99 2hgq s ASP 81 Ca -0.05 -0.81 -0.30 0.00 -0.00 0.00 0.00 52.55 51.38 2hgq s ASP 81 Cb -0.02 -0.65 0.12 0.00 -0.00 0.00 0.00 42.92 42.37 2hgq s ASP 81 CO 0.04 -0.29 0.98 0.54 -0.00 0.00 0.00 175.17 176.45 2hgq s ASN 82 N 1.81 -0.34 0.26 0.27 4.22 -0.34 -0.55 114.94 120.29 2hgq s ASN 82 Ca -0.01 0.21 0.04 0.00 -2.14 0.00 0.00 52.86 50.95 2hgq s ASN 82 Cb -0.17 0.31 -0.01 0.00 1.28 0.00 0.00 41.25 42.66 2hgq s ASN 82 CO -0.08 -0.43 0.27 0.00 -2.04 0.00 0.00 177.10 174.82 2hgq n ALA 83 N 0.28 0.33 -2.73 3.54 0.00 0.06 -0.31 120.51 121.68 2hgq n ALA 83 Ca -0.08 -1.46 -0.34 0.00 0.00 0.00 0.00 53.44 51.56 2hgq n ALA 83 Cb 0.59 1.18 -0.10 0.00 0.00 0.00 0.00 19.45 21.12 2hgq n ALA 83 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2hgq s ALA 84 N -2.91 3.17 0.38 0.00 0.00 0.41 -4.17 121.76 118.63 2hgq s ALA 84 Ca 0.29 -0.82 -0.26 0.00 0.00 0.00 0.00 51.96 51.17 2hgq s ALA 84 Cb 0.01 -1.47 -0.09 0.00 0.00 0.00 0.00 23.12 21.57 2hgq s ALA 84 CO 0.20 0.48 1.14 0.08 0.00 0.00 0.00 175.76 177.67 2hgq s VAL 85 N -0.53 3.28 0.20 0.00 1.01 -1.26 -1.19 120.40 121.90 2hgq s VAL 85 Ca 0.09 1.10 0.09 0.00 0.00 0.00 0.00 61.98 63.26 2hgq s VAL 85 Cb -0.12 -3.63 -0.04 0.00 0.00 0.00 0.00 36.38 32.59 2hgq s VAL 85 CO 0.02 0.12 -0.08 -0.63 0.00 0.00 0.00 175.10 174.54 2hgq s ILE 86 N -1.40 3.25 -0.15 2.22 1.01 0.19 -0.89 121.20 125.43 2hgq s ILE 86 Ca 0.55 -1.70 -0.01 0.00 0.00 0.00 0.00 60.65 59.49 2hgq s ILE 86 Cb -0.30 -2.63 -0.01 0.00 0.01 0.00 0.00 42.46 39.53 2hgq s ILE 86 CO 0.38 -0.16 -0.12 -0.63 0.00 0.00 0.00 174.94 174.41 2hgq s ILE 87 N -1.82 2.98 0.00 2.92 1.01 -0.16 -4.28 121.20 121.85 2hgq s ILE 87 Ca 0.26 -0.67 0.00 0.00 0.00 0.00 0.00 60.65 60.24 2hgq s ILE 87 Cb -0.08 -2.27 0.00 0.00 0.01 0.00 0.00 42.46 40.11 2hgq s ILE 87 CO 0.16 0.50 0.00 0.59 0.00 0.00 0.00 174.94 176.20 2hgq n ASN 88 N 3.92 0.00 0.00 3.58 3.02 -1.26 -0.86 115.26 123.65 2hgq n ASN 88 Ca -0.18 0.00 0.00 0.00 -0.03 0.00 0.00 54.58 54.37 2hgq n ASN 88 Cb 0.52 0.00 0.00 0.00 -0.61 0.00 0.00 39.78 39.69 2hgq n ASN 88 CO 0.00 0.00 0.00 -0.46 -2.62 0.00 0.00 177.26 174.18 2hgq n ASN 89 N 0.04 0.00 0.00 6.41 6.94 -1.26 -4.36 115.26 123.03 2hgq n ASN 89 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.56 2hgq n ASN 89 Cb 0.00 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.42 2hgq n ASN 89 CO 0.00 0.00 0.00 1.67 -1.03 0.00 0.00 177.26 177.90 2hgq n GLN 90 N -1.41 0.00 0.00 -3.83 7.27 -0.04 -5.05 117.38 114.32 2hgq n GLN 90 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 57.00 57.07 2hgq n GLN 90 Cb 0.00 0.00 0.00 0.00 2.41 0.00 0.00 30.24 32.65 2hgq n GLN 90 CO 0.00 0.00 0.00 1.28 0.07 0.00 0.00 177.06 178.41 2hgq n LEU 91 N 0.00 0.00 -3.44 1.69 4.77 -1.15 -2.87 117.00 115.99 2hgq n LEU 91 Ca 0.00 0.00 -0.33 0.00 -0.03 0.00 0.00 56.01 55.65 2hgq n LEU 91 Cb 0.00 0.00 0.03 0.00 -2.33 0.00 0.00 43.42 41.12 2hgq n LEU 91 CO 0.00 0.00 -1.83 -1.84 -1.33 0.00 0.00 177.39 172.39 2hgq n GLU 92 N 0.00 0.00 0.00 3.23 0.00 -1.26 -0.98 120.64 121.62 2hgq n GLU 92 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.16 2hgq n GLU 92 Cb 0.00 -0.86 0.00 0.00 0.00 0.00 0.00 31.44 30.58 2hgq n GLU 92 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.13 176.78 2hgq n PRO 93 N 2.15 0.00 -0.92 3.44 -0.04 -0.07 -4.19 135.00 135.37 2hgq n PRO 93 Ca -0.02 0.04 -0.30 0.00 -0.04 0.00 0.00 63.50 63.18 2hgq n PRO 93 Cb 0.65 -0.37 0.25 0.00 -0.04 0.00 0.00 33.50 33.99 2hgq n PRO 93 CO 0.00 0.00 0.00 0.50 -0.04 0.00 0.00 175.50 175.96 2hgq s ARG 94 N -0.12 -1.50 0.08 0.54 3.52 -1.26 -4.87 118.95 115.34 2hgq s ARG 94 Ca 0.00 0.03 -0.13 0.00 -0.13 0.00 0.00 55.73 55.50 2hgq s ARG 94 Cb 0.00 -1.55 -0.21 0.00 -1.56 0.00 0.00 34.95 31.62 2hgq s ARG 94 CO 0.00 -3.92 1.21 0.78 -0.81 0.00 0.00 175.30 172.56 2hgq h GLY 95 N -2.73 0.76 0.00 8.12 0.00 -1.97 -3.47 103.07 103.78 2hgq h GLY 95 Ca -0.46 -1.32 0.00 0.00 0.00 0.00 0.00 47.33 45.55 2hgq h GLY 95 CO 0.35 1.17 0.00 2.41 0.00 0.00 0.00 176.54 180.46 2hgq n THR 96 N -3.85 0.00 0.00 4.70 -1.04 -1.26 -5.09 114.28 107.74 2hgq n THR 96 Ca -0.10 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.91 2hgq n THR 96 Cb 0.87 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.38 2hgq n THR 96 CO 0.00 0.00 0.00 -2.11 -0.64 0.00 0.00 175.07 172.32 2hgq n ARG 97 N 0.00 0.00 -2.77 -2.82 -4.01 -1.26 -4.65 116.66 101.14 2hgq n ARG 97 Ca 0.00 0.00 -0.43 0.00 -1.04 0.00 0.00 57.85 56.38 2hgq n ARG 97 Cb 0.00 0.00 -0.01 0.00 -3.04 0.00 0.00 32.46 29.41 2hgq n ARG 97 CO 0.00 0.00 0.00 0.14 -3.04 0.00 0.00 177.63 174.73 2hgq s VAL 98 N -1.71 4.51 -0.54 8.89 -7.23 -1.22 -4.75 120.40 118.36 2hgq s VAL 98 Ca 0.00 -1.83 0.00 0.00 -1.81 0.00 0.00 61.98 58.34 2hgq s VAL 98 Cb 0.00 -4.98 0.00 0.00 0.56 0.00 0.00 36.38 31.96 2hgq s VAL 98 CO 0.00 -1.76 0.00 0.33 -0.31 0.00 0.00 175.10 173.36 2hgq n PHE 99 N 7.19 0.00 -3.82 2.82 7.35 0.14 -5.00 117.46 126.13 2hgq n PHE 99 Ca 0.36 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 57.05 2hgq n PHE 99 Cb 0.47 0.00 0.00 0.00 0.35 0.00 0.00 39.48 40.30 2hgq n PHE 99 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 2hgq n GLY 100 N -0.10 3.92 0.00 7.13 0.00 -1.22 -3.68 105.19 111.23 2hgq n GLY 100 Ca 0.00 -1.58 0.00 0.00 0.00 0.00 0.00 46.02 44.44 2hgq n GLY 100 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2hgq n PRO 101 N 0.00 1.50 -0.22 1.61 -0.02 -1.16 -4.93 135.00 131.78 2hgq n PRO 101 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 2hgq n PRO 101 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.48 2hgq n PRO 101 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2hgq n VAL 102 N -1.40 -0.44 0.00 -1.45 0.31 -1.26 -4.93 118.33 109.16 2hgq n VAL 102 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 2hgq n VAL 102 Cb 0.00 -0.59 0.00 0.00 -0.91 0.00 0.00 33.84 32.34 2hgq n VAL 102 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2hgq n ALA 103 N 1.92 0.00 0.00 3.52 0.00 -1.26 -1.36 120.51 123.33 2hgq n ALA 103 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2hgq n ALA 103 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2hgq n ALA 103 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2hgq n ARG 104 N 0.00 0.00 0.00 0.00 1.74 -1.26 -0.68 116.66 116.46 2hgq n ARG 104 Ca 0.00 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.08 2hgq n ARG 104 Cb 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.44 2hgq n ARG 104 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2hgq n GLU 105 N -3.76 0.00 -0.19 5.56 1.02 -0.46 -1.07 120.64 121.74 2hgq n GLU 105 Ca 0.00 0.00 0.19 0.00 -0.02 0.00 0.00 57.16 57.33 2hgq n GLU 105 Cb 0.00 -0.50 0.34 0.00 -0.02 0.00 0.00 31.44 31.26 2hgq n GLU 105 CO 0.00 0.00 0.00 1.47 1.18 0.00 0.00 177.13 179.78 2hgq n LEU 106 N 0.00 0.20 0.09 -4.62 -0.00 -0.58 0.27 117.00 112.36 2hgq n LEU 106 Ca 0.00 0.96 -0.12 0.00 -0.00 0.00 0.00 56.01 56.85 2hgq n LEU 106 Cb 0.00 -0.47 -0.05 0.00 -0.00 0.00 0.00 43.42 42.90 2hgq n LEU 106 CO 0.00 -1.07 0.76 0.03 -0.00 0.00 0.00 177.39 177.10 2hgq h ARG 107 N 0.00 -0.29 -0.91 1.47 3.08 -0.77 1.92 114.38 118.88 2hgq h ARG 107 Ca 0.49 0.02 0.22 0.00 0.07 0.00 0.00 59.98 60.78 2hgq h ARG 107 Cb 1.31 0.07 -0.06 0.00 0.08 0.00 0.00 29.97 31.36 2hgq h ARG 107 CO -0.44 -0.19 0.61 1.49 -1.07 0.00 0.00 179.97 180.36 2hgq h GLU 108 N -0.30 0.31 0.00 0.04 4.57 0.55 -3.44 114.58 116.31 2hgq h GLU 108 Ca 0.03 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.19 2hgq h GLU 108 Cb 0.33 -0.07 0.00 0.00 -0.16 0.00 0.00 28.75 28.85 2hgq h GLU 108 CO -0.10 0.21 0.00 1.63 -1.18 0.00 0.00 179.01 179.56 2hgq n LYS 109 N -4.47 0.00 -0.30 1.92 5.02 0.65 -4.91 118.16 116.07 2hgq n LYS 109 Ca 0.20 0.00 -0.00 0.00 -2.02 0.00 0.00 58.31 56.48 2hgq n LYS 109 Cb 0.76 0.00 -0.00 0.00 -0.02 0.00 0.00 35.03 35.77 2hgq n LYS 109 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2hgq n GLY 110 N 0.00 -0.01 0.00 0.72 0.00 -1.26 -2.88 105.19 101.76 2hgq n GLY 110 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 2hgq n GLY 110 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 173.32 175.29 2hgq n PHE 111 N 1.34 0.00 -0.33 1.61 1.16 -1.26 -5.00 117.46 114.98 2hgq n PHE 111 Ca 0.01 0.00 0.19 0.00 -1.87 0.00 0.00 57.45 55.78 2hgq n PHE 111 Cb 0.14 0.00 0.36 0.00 -1.61 0.00 0.00 39.48 38.38 2hgq n PHE 111 CO 0.00 0.00 0.00 1.98 -1.87 0.00 0.00 176.76 176.87 2hgq h MET 112 N 0.00 0.04 -0.67 3.97 4.05 -1.90 2.01 114.93 122.43 2hgq h MET 112 Ca 0.00 -0.00 0.14 0.00 -0.28 0.00 0.00 59.70 59.55 2hgq h MET 112 Cb 0.00 -0.01 -0.13 0.00 -0.80 0.00 0.00 31.60 30.66 2hgq h MET 112 CO 0.00 0.02 -0.16 -0.22 0.23 0.00 0.00 176.91 176.79 2hgq h LYS 113 N 0.04 0.01 -0.61 0.39 1.63 -1.96 3.30 116.57 119.36 2hgq h LYS 113 Ca 0.65 -0.00 0.10 0.00 -0.85 0.00 0.00 60.65 60.56 2hgq h LYS 113 Cb 1.46 -0.00 -0.08 0.00 -0.60 0.00 0.00 32.23 33.01 2hgq h LYS 113 CO -0.85 0.00 0.20 0.82 -3.45 0.00 0.00 179.45 176.18 2hgq h ILE 114 N 0.01 0.73 0.00 2.00 2.04 0.28 -0.06 117.51 122.50 2hgq h ILE 114 Ca 0.33 -0.13 0.00 0.00 1.00 0.00 0.00 64.86 66.06 2hgq h ILE 114 Cb 0.50 0.33 0.00 0.00 -0.74 0.00 0.00 36.82 36.91 2hgq h ILE 114 CO -0.69 0.07 0.00 0.52 0.00 0.00 0.00 178.15 178.05 2hgq n VAL 115 N -5.03 0.00 0.07 1.67 0.31 1.08 -1.24 118.33 115.19 2hgq n VAL 115 Ca 0.09 1.46 -0.00 0.00 -0.01 0.00 0.00 64.34 65.88 2hgq n VAL 115 Cb 0.30 -2.00 0.29 0.00 -0.91 0.00 0.00 33.84 31.52 2hgq n VAL 115 CO 0.00 0.00 0.00 0.77 -1.32 0.00 0.00 176.83 176.28 2hgq h SER 116 N 0.00 0.33 0.30 4.52 4.64 -0.89 -3.30 113.55 119.15 2hgq h SER 116 Ca 0.00 -0.09 0.00 0.00 -0.47 0.00 0.00 61.79 61.23 2hgq h SER 116 Cb 0.00 -0.09 -0.03 0.00 -0.31 0.00 0.00 62.40 61.98 2hgq h SER 116 CO 0.00 0.55 -0.35 0.25 -0.87 0.00 0.00 176.83 176.41 2hgq h LEU 117 N 0.31 -0.95 -8.00 5.97 6.46 0.17 -3.33 115.31 115.94 2hgq h LEU 117 Ca 0.05 0.09 -0.69 0.00 -0.12 0.00 0.00 57.88 57.21 2hgq h LEU 117 Cb 0.53 0.33 -0.18 0.00 -0.73 0.00 0.00 40.66 40.61 2hgq h LEU 117 CO 0.04 -0.47 0.72 0.00 -0.62 0.00 0.00 178.44 178.10 2hgq s ALA 118 N -6.00 3.40 0.00 1.25 0.00 -0.37 -4.86 121.76 115.17 2hgq s ALA 118 Ca -0.17 -2.70 0.00 0.00 0.00 0.00 0.00 51.96 49.09 2hgq s ALA 118 Cb 0.06 -3.97 0.00 0.00 0.00 0.00 0.00 23.12 19.21 2hgq s ALA 118 CO 0.63 -2.88 0.00 -0.35 0.00 0.00 0.00 175.76 173.16 2hgq n PRO 119 N 6.44 0.00 -1.00 0.00 -0.05 -1.24 -2.99 135.00 136.15 2hgq n PRO 119 Ca 0.19 0.00 -0.35 0.00 -0.05 0.00 0.00 63.50 63.29 2hgq n PRO 119 Cb 0.48 0.00 0.07 0.00 -0.05 0.00 0.00 33.50 34.00 2hgq n PRO 119 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 175.50 175.84 2hgq n GLU 120 N -0.61 -0.04 -0.24 0.54 1.02 -1.26 -3.63 120.64 116.42 2hgq n GLU 120 Ca 0.00 0.01 -0.11 0.00 -0.02 0.00 0.00 57.16 57.04 2hgq n GLU 120 Cb 0.00 -1.41 -0.02 0.00 -0.02 0.00 0.00 31.44 29.98 2hgq n GLU 120 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 2hgq n VAL 121 N -2.73 0.00 0.00 2.62 0.31 -1.26 -4.61 118.33 112.66 2hgq n VAL 121 Ca 0.04 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.37 2hgq n VAL 121 Cb 0.53 -0.10 0.00 0.00 -0.91 0.00 0.00 33.84 33.37 2hgq n VAL 121 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40