#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2hl2 s ARG 2 N 0.00 2.96 0.03 2.12 0.52 -0.29 0.16 118.95 124.45 2hl2 s ARG 2 Ca 0.00 -0.83 0.04 0.00 -0.52 0.00 0.00 55.73 54.42 2hl2 s ARG 2 Cb 0.00 -2.46 -0.04 0.00 0.52 0.00 0.00 34.95 32.98 2hl2 s ARG 2 CO 0.00 -0.10 -0.07 0.08 0.02 0.00 0.00 175.30 175.24 2hl2 s VAL 3 N 1.02 3.63 -0.24 3.52 1.01 0.29 -0.56 120.40 129.07 2hl2 s VAL 3 Ca -0.02 -0.89 -0.01 0.00 0.00 0.00 0.00 61.98 61.06 2hl2 s VAL 3 Cb -0.14 -2.62 0.07 0.00 0.00 0.00 0.00 36.38 33.69 2hl2 s VAL 3 CO -0.06 0.31 0.02 -0.22 0.00 0.00 0.00 175.10 175.14 2hl2 s LEU 4 N -1.67 2.08 -0.30 3.92 2.96 0.06 -1.33 118.68 124.41 2hl2 s LEU 4 Ca 0.19 -1.20 -0.13 0.00 -0.22 0.00 0.00 54.13 52.76 2hl2 s LEU 4 Cb -0.11 -0.91 -0.03 0.00 0.50 0.00 0.00 46.19 45.63 2hl2 s LEU 4 CO 0.10 -0.31 0.29 -0.76 -1.32 0.00 0.00 176.35 174.34 2hl2 s LEU 5 N 1.59 4.19 -0.20 -0.68 1.43 0.16 -1.36 118.68 123.82 2hl2 s LEU 5 Ca 0.00 -0.04 0.00 0.00 -1.03 0.00 0.00 54.13 53.07 2hl2 s LEU 5 Cb -0.18 -2.25 0.05 0.00 0.03 0.00 0.00 46.19 43.83 2hl2 s LEU 5 CO -0.11 -0.18 -0.08 -0.63 0.23 0.00 0.00 176.35 175.58 2hl2 s ILE 6 N 1.90 1.48 -0.42 -0.59 1.01 0.65 -1.47 121.20 123.75 2hl2 s ILE 6 Ca 0.10 -0.97 -0.29 0.00 0.00 0.00 0.00 60.65 59.50 2hl2 s ILE 6 Cb -0.16 -1.63 0.01 0.00 0.01 0.00 0.00 42.46 40.69 2hl2 s ILE 6 CO 0.11 0.09 1.42 -2.28 0.00 0.00 0.00 174.94 174.28 2hl2 s HIS 7 N 1.46 2.37 0.22 3.97 5.65 -0.28 -0.51 115.29 128.17 2hl2 s HIS 7 Ca -0.02 0.66 0.09 0.00 0.25 0.00 0.00 55.06 56.04 2hl2 s HIS 7 Cb -0.17 -4.32 -0.04 0.00 -1.18 0.00 0.00 32.58 26.88 2hl2 s HIS 7 CO -0.08 -2.00 -0.02 -1.12 -0.65 0.00 0.00 174.74 170.87 2hl2 s SER 8 N 4.05 4.56 0.36 9.88 0.01 0.70 -1.45 113.70 131.82 2hl2 s SER 8 Ca 0.61 -0.55 0.17 0.00 1.31 0.00 0.00 55.95 57.49 2hl2 s SER 8 Cb -0.13 -0.88 0.63 0.00 0.21 0.00 0.00 66.02 65.85 2hl2 s SER 8 CO 0.32 0.05 1.72 0.44 0.41 0.00 0.00 173.24 176.18 2hl2 h ASP 9 N 2.33 0.00 -5.24 2.44 3.32 -0.35 -2.53 116.42 116.38 2hl2 h ASP 9 Ca -0.46 0.00 0.27 0.00 0.02 0.00 0.00 57.03 56.87 2hl2 h ASP 9 Cb 1.23 0.00 -0.13 0.00 0.22 0.00 0.00 39.33 40.64 2hl2 h ASP 9 CO 0.58 0.41 0.75 -0.72 -1.72 0.00 0.00 179.24 178.55 2hl2 s TYR 10 N -3.63 -0.10 -0.06 4.55 -0.85 -1.26 -1.39 117.35 114.62 2hl2 s TYR 10 Ca -0.00 -0.02 -0.05 0.00 -0.52 0.00 0.00 57.07 56.47 2hl2 s TYR 10 Cb 0.11 0.55 0.02 0.00 0.38 0.00 0.00 41.96 43.02 2hl2 s TYR 10 CO 0.70 -0.35 0.15 -1.50 -1.52 0.00 0.00 175.55 173.03 2hl2 s ILE 11 N -2.59 -0.01 -0.15 -3.49 1.10 0.04 -2.50 121.20 113.59 2hl2 s ILE 11 Ca 0.12 0.03 -0.13 0.00 -0.51 0.00 0.00 60.65 60.16 2hl2 s ILE 11 Cb 0.02 -0.22 0.04 0.00 0.15 0.00 0.00 42.46 42.45 2hl2 s ILE 11 CO -0.03 0.01 0.40 -0.70 -2.11 0.00 0.00 174.94 172.50 2hl2 s GLU 12 N 0.26 0.45 0.28 3.50 2.12 -0.57 -0.62 118.70 124.13 2hl2 s GLU 12 Ca -0.02 0.59 0.03 0.00 0.36 0.00 0.00 54.97 55.94 2hl2 s GLU 12 Cb -0.03 0.17 -0.04 0.00 0.26 0.00 0.00 34.13 34.50 2hl2 s GLU 12 CO -0.01 -0.08 0.19 1.52 -0.54 0.00 0.00 175.26 176.34 2hl2 s TYR 13 N 0.44 1.51 -0.23 5.30 -0.85 -0.84 -0.68 117.35 122.00 2hl2 s TYR 13 Ca -0.02 -1.47 -0.10 0.00 -0.52 0.00 0.00 57.07 54.95 2hl2 s TYR 13 Cb -0.04 -0.71 0.08 0.00 0.38 0.00 0.00 41.96 41.67 2hl2 s TYR 13 CO -0.02 -0.68 0.52 -2.00 -1.52 0.00 0.00 175.55 171.85 2hl2 s GLU 14 N -3.81 0.48 -0.15 -3.49 2.12 -0.35 -3.37 118.70 110.14 2hl2 s GLU 14 Ca 0.38 1.07 -0.29 0.00 0.36 0.00 0.00 54.97 56.49 2hl2 s GLU 14 Cb 0.05 0.26 -0.02 0.00 0.26 0.00 0.00 34.13 34.67 2hl2 s GLU 14 CO 0.19 -0.19 1.37 0.08 -0.54 0.00 0.00 175.26 176.17 2hl2 s VAL 15 N 2.02 4.09 0.00 3.70 1.01 0.48 -0.96 120.40 130.75 2hl2 s VAL 15 Ca -0.07 1.31 0.00 0.00 0.00 0.00 0.00 61.98 63.22 2hl2 s VAL 15 Cb -0.09 -3.88 0.00 0.00 0.00 0.00 0.00 36.38 32.41 2hl2 s VAL 15 CO -0.16 -0.15 0.00 0.29 0.00 0.00 0.00 175.10 175.09 2hl2 n LYS 16 N 6.81 0.00 -2.45 2.72 4.76 0.43 -4.98 118.16 125.46 2hl2 n LYS 16 Ca 0.15 0.00 -0.27 0.00 -2.87 0.00 0.00 58.31 55.32 2hl2 n LYS 16 Cb 0.44 0.00 0.02 0.00 -1.84 0.00 0.00 35.03 33.66 2hl2 n LYS 16 CO 0.00 0.00 0.00 -0.51 -1.37 0.00 0.00 177.40 175.52 2hl2 s ASP 17 N -0.94 5.79 0.42 4.39 1.11 -1.25 -4.84 116.67 121.34 2hl2 s ASP 17 Ca 0.00 0.79 -0.22 0.00 0.18 0.00 0.00 52.55 53.29 2hl2 s ASP 17 Cb 0.00 -1.87 -0.10 0.00 1.07 0.00 0.00 42.92 42.02 2hl2 s ASP 17 CO 0.00 -0.93 0.99 -1.59 1.18 0.00 0.00 175.17 174.82 2hl2 s LYS 18 N -4.93 4.19 0.00 8.23 0.00 -1.26 -0.66 119.74 125.31 2hl2 s LYS 18 Ca 0.52 1.30 0.09 0.00 0.00 0.00 0.00 55.97 57.88 2hl2 s LYS 18 Cb -0.10 -2.36 0.01 0.00 0.00 0.00 0.00 37.83 35.38 2hl2 s LYS 18 CO 0.45 -0.08 0.63 0.00 0.00 0.00 0.00 175.35 176.35 2hl2 n ALA 19 N -0.36 2.70 -2.32 0.59 0.00 -0.40 -4.70 120.51 116.01 2hl2 n ALA 19 Ca 0.06 -0.45 -0.17 0.00 0.00 0.00 0.00 53.44 52.88 2hl2 n ALA 19 Cb 0.52 -0.31 -0.10 0.00 0.00 0.00 0.00 19.45 19.56 2hl2 n ALA 19 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2hl2 s LEU 20 N -1.36 1.64 0.08 0.00 1.02 -1.18 -4.98 118.68 113.92 2hl2 s LEU 20 Ca 0.08 -1.43 -0.12 0.00 0.02 0.00 0.00 54.13 52.68 2hl2 s LEU 20 Cb 0.07 0.06 -0.21 0.00 0.02 0.00 0.00 46.19 46.13 2hl2 s LEU 20 CO 0.20 -0.77 1.21 0.11 0.02 0.00 0.00 176.35 177.11 2hl2 h LYS 21 N 2.34 0.65 -2.40 1.70 6.56 -1.95 -3.39 116.57 120.08 2hl2 h LYS 21 Ca -0.37 -0.71 -0.59 0.00 -1.06 0.00 0.00 60.65 57.92 2hl2 h LYS 21 Cb 1.25 0.20 -0.40 0.00 -0.57 0.00 0.00 32.23 32.71 2hl2 h LYS 21 CO 0.59 1.29 -0.86 0.09 -2.06 0.00 0.00 179.45 178.50 2hl2 n ASN 22 N -3.83 1.13 -4.80 0.86 3.02 -1.26 -5.12 115.26 105.26 2hl2 n ASN 22 Ca -0.10 -2.81 -0.32 0.00 -0.03 0.00 0.00 54.58 51.32 2hl2 n ASN 22 Cb 0.88 -0.64 0.05 0.00 -0.61 0.00 0.00 39.78 39.46 2hl2 n ASN 22 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 2hl2 s PRO 23 N -1.01 2.89 -0.32 3.52 0.04 -1.26 -4.90 135.00 133.96 2hl2 s PRO 23 Ca 0.33 1.11 -0.36 0.00 0.04 0.00 0.00 61.00 62.11 2hl2 s PRO 23 Cb 0.07 -1.98 -0.12 0.00 0.04 0.00 0.00 34.50 32.51 2hl2 s PRO 23 CO -0.14 -1.14 2.08 -1.91 0.04 0.00 0.00 177.00 175.93 2hl2 n GLU 24 N -2.84 1.15 -1.75 4.56 2.13 -1.00 -4.87 120.64 118.03 2hl2 n GLU 24 Ca 0.08 0.35 -0.42 0.00 0.66 0.00 0.00 57.16 57.84 2hl2 n GLU 24 Cb 0.53 -2.37 -0.01 0.00 0.27 0.00 0.00 31.44 29.86 2hl2 n GLU 24 CO 0.00 0.00 0.00 -0.35 -0.41 0.00 0.00 177.13 176.37 2hl2 n PRO 25 N 7.52 2.65 -4.22 5.31 -0.04 -1.26 -4.78 135.00 140.18 2hl2 n PRO 25 Ca 0.37 0.94 -0.20 0.00 -0.04 0.00 0.00 63.50 64.58 2hl2 n PRO 25 Cb 0.20 -2.69 -0.12 0.00 -0.04 0.00 0.00 33.50 30.85 2hl2 n PRO 25 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 2hl2 s ILE 26 N -0.43 1.22 0.65 0.52 -4.36 -1.26 -5.09 121.20 112.45 2hl2 s ILE 26 Ca 0.60 -1.30 -0.06 0.00 -0.26 0.00 0.00 60.65 59.63 2hl2 s ILE 26 Cb -0.50 -1.15 0.04 0.00 1.25 0.00 0.00 42.46 42.10 2hl2 s ILE 26 CO 0.54 -0.16 0.96 -0.94 0.24 0.00 0.00 174.94 175.59 2hl2 s SER 27 N -1.67 5.17 0.23 4.36 1.04 -1.26 -4.96 113.70 116.61 2hl2 s SER 27 Ca 0.00 0.57 -0.08 0.00 0.48 0.00 0.00 55.95 56.92 2hl2 s SER 27 Cb -0.10 -1.37 0.38 0.00 0.10 0.00 0.00 66.02 65.03 2hl2 s SER 27 CO 0.02 -1.35 1.67 -0.08 0.98 0.00 0.00 173.24 174.48 2hl2 h GLU 28 N -0.40 0.18 -0.80 4.02 4.57 -2.02 -1.61 114.58 118.52 2hl2 h GLU 28 Ca -0.45 -0.01 0.15 0.00 -1.18 0.00 0.00 59.36 57.87 2hl2 h GLU 28 Cb 1.29 -0.04 -0.06 0.00 -0.16 0.00 0.00 28.75 29.78 2hl2 h GLU 28 CO 0.60 0.12 0.53 -0.44 -1.18 0.00 0.00 179.01 178.64 2hl2 h ASP 29 N 0.18 0.47 1.09 1.04 3.32 -1.94 -1.67 116.42 118.91 2hl2 h ASP 29 Ca 0.37 0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.45 2hl2 h ASP 29 Cb 0.62 -0.06 0.00 0.00 0.22 0.00 0.00 39.33 40.11 2hl2 h ASP 29 CO -0.53 0.24 0.00 0.23 -1.72 0.00 0.00 179.24 177.45 2hl2 n MET 30 N -4.50 0.15 0.31 3.56 2.81 -0.61 -3.64 117.12 115.20 2hl2 n MET 30 Ca 0.15 0.20 0.16 0.00 -1.81 0.00 0.00 57.70 56.41 2hl2 n MET 30 Cb 0.52 -1.70 0.87 0.00 -0.71 0.00 0.00 33.22 32.20 2hl2 n MET 30 CO 0.00 0.00 0.00 0.87 1.51 0.00 0.00 175.97 178.35 2hl2 h LYS 31 N 0.00 0.00 -2.27 0.03 1.57 -1.31 -3.43 116.57 111.15 2hl2 h LYS 31 Ca 0.00 0.00 0.10 0.00 -1.87 0.00 0.00 60.65 58.88 2hl2 h LYS 31 Cb 0.54 0.00 -0.16 0.00 0.08 0.00 0.00 32.23 32.70 2hl2 h LYS 31 CO 0.00 0.00 0.48 -0.98 -0.57 0.00 0.00 179.45 178.38 2hl2 s ARG 32 N -4.02 0.84 0.19 3.15 1.70 -1.24 -0.39 118.95 119.19 2hl2 s ARG 32 Ca -0.04 -0.27 -0.23 0.00 -0.47 0.00 0.00 55.73 54.72 2hl2 s ARG 32 Cb 0.09 0.39 0.06 0.00 -0.57 0.00 0.00 34.95 34.92 2hl2 s ARG 32 CO 0.29 -0.36 0.94 0.20 -1.08 0.00 0.00 175.30 175.29 2hl2 s GLY 33 N -2.39 -0.10 -0.13 3.88 0.00 -1.22 -4.94 107.32 102.42 2hl2 s GLY 33 Ca 0.04 -0.09 -0.15 0.00 0.00 0.00 0.00 44.72 44.53 2hl2 s GLY 33 CO -0.08 0.42 0.40 -1.60 0.00 0.00 0.00 173.10 172.23 2hl2 s ARG 34 N -3.06 0.52 0.01 2.90 3.52 -1.26 -1.99 118.95 119.59 2hl2 s ARG 34 Ca 0.14 0.44 0.01 0.00 -0.13 0.00 0.00 55.73 56.20 2hl2 s ARG 34 Cb -0.02 0.25 -0.01 0.00 -1.56 0.00 0.00 34.95 33.60 2hl2 s ARG 34 CO 0.04 -0.08 -0.05 1.41 -0.81 0.00 0.00 175.30 175.81 2hl2 s MET 35 N -0.06 0.37 0.44 5.12 1.75 0.21 -5.00 119.30 122.14 2hl2 s MET 35 Ca -0.02 -0.37 0.06 0.00 -1.25 0.00 0.00 55.69 54.10 2hl2 s MET 35 Cb -0.03 -0.25 -0.05 0.00 2.84 0.00 0.00 34.83 37.34 2hl2 s MET 35 CO 0.01 0.06 0.07 -1.21 -0.65 0.00 0.00 175.02 173.30 2hl2 s GLU 36 N -0.68 2.09 -0.70 4.11 2.02 -1.26 -0.78 118.70 123.49 2hl2 s GLU 36 Ca -0.04 -2.12 -0.13 0.00 0.02 0.00 0.00 54.97 52.70 2hl2 s GLU 36 Cb -0.05 -1.72 0.02 0.00 0.10 0.00 0.00 34.13 32.48 2hl2 s GLU 36 CO -0.00 -0.17 0.25 0.39 0.02 0.00 0.00 175.26 175.74 2hl2 n GLU 37 N -1.15 -0.71 -4.38 1.61 -0.58 -0.49 -4.83 120.64 110.12 2hl2 n GLU 37 Ca -0.07 -0.14 -0.23 0.00 -0.42 0.00 0.00 57.16 56.30 2hl2 n GLU 37 Cb 0.66 -1.18 -0.11 0.00 -0.57 0.00 0.00 31.44 30.24 2hl2 n GLU 37 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 2hl2 s VAL 38 N -4.07 2.06 -0.38 2.62 0.11 -0.95 -3.99 120.40 115.79 2hl2 s VAL 38 Ca 0.18 -2.05 -0.12 0.00 -2.93 0.00 0.00 61.98 57.06 2hl2 s VAL 38 Cb -0.10 -2.01 0.03 0.00 -1.53 0.00 0.00 36.38 32.77 2hl2 s VAL 38 CO 0.52 -0.30 0.23 -0.22 -3.33 0.00 0.00 175.10 172.00 2hl2 s LEU 39 N -2.86 4.82 0.08 2.54 2.96 -0.42 -0.22 118.68 125.59 2hl2 s LEU 39 Ca 0.20 -1.02 -0.22 0.00 -0.22 0.00 0.00 54.13 52.87 2hl2 s LEU 39 Cb -0.06 -2.05 -0.07 0.00 0.50 0.00 0.00 46.19 44.52 2hl2 s LEU 39 CO 0.09 -0.41 0.67 -0.69 -1.32 0.00 0.00 176.35 174.69 2hl2 s VAL 40 N 1.57 4.67 -0.33 1.68 1.01 0.33 -1.88 120.40 127.46 2hl2 s VAL 40 Ca 0.02 1.44 0.02 0.00 0.00 0.00 0.00 61.98 63.47 2hl2 s VAL 40 Cb -0.19 -4.02 0.10 0.00 0.00 0.00 0.00 36.38 32.27 2hl2 s VAL 40 CO 0.07 0.48 0.07 0.00 0.00 0.00 0.00 175.10 175.72 2hl2 s ALA 41 N -0.71 2.30 -0.18 5.51 0.00 -0.05 -0.26 121.76 128.38 2hl2 s ALA 41 Ca 0.33 -2.15 -0.26 0.00 0.00 0.00 0.00 51.96 49.89 2hl2 s ALA 41 Cb -0.20 -1.81 -0.01 0.00 0.00 0.00 0.00 23.12 21.09 2hl2 s ALA 41 CO 0.21 -1.67 0.86 -0.06 0.00 0.00 0.00 175.76 175.11 2hl2 s PHE 42 N 1.21 3.40 -0.08 0.00 0.08 -0.47 0.19 117.98 122.32 2hl2 s PHE 42 Ca 0.10 1.28 0.03 0.00 0.12 0.00 0.00 56.93 58.46 2hl2 s PHE 42 Cb -0.18 -3.05 0.01 0.00 -0.57 0.00 0.00 43.02 39.22 2hl2 s PHE 42 CO -0.15 -0.28 -0.17 0.42 -0.10 0.00 0.00 175.22 174.93 2hl2 s ILE 43 N 2.33 1.51 -0.40 0.64 1.01 -0.62 -0.76 121.20 124.93 2hl2 s ILE 43 Ca 0.39 -0.70 -0.04 0.00 0.00 0.00 0.00 60.65 60.30 2hl2 s ILE 43 Cb -0.16 -1.34 0.09 0.00 0.01 0.00 0.00 42.46 41.06 2hl2 s ILE 43 CO 0.11 0.44 0.19 -0.44 0.00 0.00 0.00 174.94 175.24 2hl2 s SER 44 N 0.55 5.29 0.01 3.58 0.01 0.27 -1.42 113.70 122.00 2hl2 s SER 44 Ca -0.16 -1.79 -0.30 0.00 1.31 0.00 0.00 55.95 55.01 2hl2 s SER 44 Cb -0.17 -1.85 -0.05 0.00 0.21 0.00 0.00 66.02 64.16 2hl2 s SER 44 CO 0.06 -0.50 1.35 -0.69 0.41 0.00 0.00 173.24 173.86 2hl2 s VAL 45 N 1.23 3.77 0.17 3.43 1.01 -1.26 -1.14 120.40 127.61 2hl2 s VAL 45 Ca 0.05 1.18 0.04 0.00 0.00 0.00 0.00 61.98 63.25 2hl2 s VAL 45 Cb -0.22 -3.76 -0.04 0.00 0.00 0.00 0.00 36.38 32.36 2hl2 s VAL 45 CO -0.02 0.02 0.24 -1.61 0.00 0.00 0.00 175.10 173.72 2hl2 s GLU 46 N 2.05 3.22 0.30 2.72 2.02 -1.26 -0.93 118.70 126.82 2hl2 s GLU 46 Ca 0.62 -0.74 0.05 0.00 0.02 0.00 0.00 54.97 54.93 2hl2 s GLU 46 Cb -0.31 -2.82 0.77 0.00 0.10 0.00 0.00 34.13 31.87 2hl2 s GLU 46 CO 0.27 0.49 1.70 -0.22 0.02 0.00 0.00 175.26 177.52 2hl2 h LYS 47 N 2.09 0.41 0.00 1.61 1.63 -1.25 0.12 116.57 121.18 2hl2 h LYS 47 Ca -0.49 -0.02 -0.00 0.00 -0.85 0.00 0.00 60.65 59.29 2hl2 h LYS 47 Cb 1.20 -0.09 -0.00 0.00 -0.60 0.00 0.00 32.23 32.74 2hl2 h LYS 47 CO 0.65 0.27 -0.01 -0.39 -3.45 0.00 0.00 179.45 176.53 2hl2 h VAL 48 N 0.42 0.12 0.00 2.00 -1.51 -1.92 -1.69 116.25 113.68 2hl2 h VAL 48 Ca 0.58 -0.06 0.00 0.00 -1.23 0.00 0.00 66.70 65.99 2hl2 h VAL 48 Cb 1.11 1.05 0.00 0.00 -2.13 0.00 0.00 31.29 31.33 2hl2 h VAL 48 CO -0.52 0.01 0.00 0.47 -1.23 0.00 0.00 177.57 176.29 2hl2 n ASP 49 N -3.24 0.36 0.10 4.19 8.00 0.42 -2.83 116.55 123.55 2hl2 n ASP 49 Ca -0.03 0.57 0.11 0.00 0.71 0.00 0.00 54.79 56.15 2hl2 n ASP 49 Cb 0.10 -0.65 0.45 0.00 -0.02 0.00 0.00 41.12 41.00 2hl2 n ASP 49 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2hl2 n GLU 50 N -1.87 0.15 -0.03 -1.24 1.02 -0.63 -2.80 120.64 115.24 2hl2 n GLU 50 Ca 0.04 0.38 -0.15 0.00 -0.02 0.00 0.00 57.16 57.41 2hl2 n GLU 50 Cb 0.27 -1.79 -0.10 0.00 -0.02 0.00 0.00 31.44 29.80 2hl2 n GLU 50 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 2hl2 h LYS 51 N 0.00 0.21 -2.20 3.49 1.79 -1.74 -3.41 116.57 114.71 2hl2 h LYS 51 Ca 0.00 -0.19 -0.56 0.00 -2.18 0.00 0.00 60.65 57.72 2hl2 h LYS 51 Cb 0.35 0.04 -0.37 0.00 -1.58 0.00 0.00 32.23 30.67 2hl2 h LYS 51 CO 0.00 0.86 -0.98 -1.71 -1.08 0.00 0.00 179.45 176.54 2hl2 n ASN 52 N -4.52 -0.52 -0.24 0.86 5.15 -1.16 -5.01 115.26 109.82 2hl2 n ASN 52 Ca -0.09 -2.47 0.03 0.00 -0.60 0.00 0.00 54.58 51.45 2hl2 n ASN 52 Cb 0.47 -0.44 0.16 0.00 -0.53 0.00 0.00 39.78 39.43 2hl2 n ASN 52 CO 0.00 0.00 0.00 -0.65 1.40 0.00 0.00 177.26 178.01 2hl2 h PRO 53 N 5.26 0.42 0.08 1.20 0.11 -1.77 -2.42 132.00 134.88 2hl2 h PRO 53 Ca 0.22 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 66.30 2hl2 h PRO 53 Cb 0.91 -0.10 0.00 0.00 0.11 0.00 0.00 31.00 31.93 2hl2 h PRO 53 CO 0.37 0.28 -0.04 1.49 -0.21 0.00 0.00 178.00 179.89 2hl2 h GLU 54 N 0.43 -0.11 -0.80 1.05 4.81 -1.95 0.99 114.58 119.02 2hl2 h GLU 54 Ca 0.38 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.62 2hl2 h GLU 54 Cb 0.53 0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.90 2hl2 h GLU 54 CO -0.37 0.06 0.51 1.49 -0.73 0.00 0.00 179.01 179.96 2hl2 h GLU 55 N -0.25 1.06 -0.23 1.92 4.81 -1.94 0.06 114.58 120.01 2hl2 h GLU 55 Ca -0.01 -0.07 -0.19 0.00 -0.13 0.00 0.00 59.36 58.95 2hl2 h GLU 55 Cb 0.21 -0.23 0.00 0.00 0.63 0.00 0.00 28.75 29.36 2hl2 h GLU 55 CO 0.02 0.72 -0.61 0.28 -0.73 0.00 0.00 179.01 178.68 2hl2 h VAL 56 N 1.08 1.29 0.11 0.32 2.07 -1.28 -1.12 116.25 118.72 2hl2 h VAL 56 Ca 0.29 -1.82 -0.01 0.00 0.82 0.00 0.00 66.70 65.98 2hl2 h VAL 56 Cb -0.10 1.76 0.00 0.00 -1.52 0.00 0.00 31.29 31.44 2hl2 h VAL 56 CO -0.06 0.58 -0.05 0.28 0.02 0.00 0.00 177.57 178.34 2hl2 h SER 57 N 0.57 -0.12 -0.93 0.57 0.02 -0.48 -1.49 113.55 111.69 2hl2 h SER 57 Ca -0.00 -0.34 0.04 0.00 -0.84 0.00 0.00 61.79 60.64 2hl2 h SER 57 Cb 1.21 0.03 -0.06 0.00 0.14 0.00 0.00 62.40 63.73 2hl2 h SER 57 CO 0.13 0.30 0.61 -0.07 -1.14 0.00 0.00 176.83 176.66 2hl2 h LEU 58 N -0.57 1.00 -0.27 5.07 3.38 -1.05 0.89 115.31 123.77 2hl2 h LEU 58 Ca -0.01 -0.01 -0.03 0.00 0.09 0.00 0.00 57.88 57.92 2hl2 h LEU 58 Cb 0.46 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 2hl2 h LEU 58 CO 0.02 0.67 0.05 0.50 0.09 0.00 0.00 178.44 179.77 2hl2 h LYS 59 N 1.15 0.44 -0.24 1.13 3.64 -1.17 -2.21 116.57 119.31 2hl2 h LYS 59 Ca 0.38 -0.12 -0.07 0.00 -1.27 0.00 0.00 60.65 59.57 2hl2 h LYS 59 Cb 0.06 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 31.81 2hl2 h LYS 59 CO -0.12 0.55 -0.18 0.00 -2.27 0.00 0.00 179.45 177.44 2hl2 h ALA 60 N 0.87 1.26 -0.39 5.00 0.00 -0.70 -2.29 119.26 123.01 2hl2 h ALA 60 Ca 0.08 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.69 2hl2 h ALA 60 Cb 0.33 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 2hl2 h ALA 60 CO 0.00 0.48 0.18 0.82 0.00 0.00 0.00 179.25 180.73 2hl2 h ILE 61 N 0.38 1.18 -0.14 0.00 2.04 -0.60 -0.72 117.51 119.66 2hl2 h ILE 61 Ca 0.07 -0.54 -0.08 0.00 1.00 0.00 0.00 64.86 65.30 2hl2 h ILE 61 Cb 0.53 0.81 -0.01 0.00 -0.74 0.00 0.00 36.82 37.40 2hl2 h ILE 61 CO 0.03 0.20 -0.29 -0.08 0.00 0.00 0.00 178.15 178.02 2hl2 h GLU 62 N 0.49 0.26 0.00 2.37 4.57 -1.11 -1.93 114.58 119.23 2hl2 h GLU 62 Ca 0.13 -0.09 -0.12 0.00 -1.18 0.00 0.00 59.36 58.10 2hl2 h GLU 62 Cb 0.15 -0.02 -0.02 0.00 -0.16 0.00 0.00 28.75 28.71 2hl2 h GLU 62 CO -0.01 0.53 -0.57 0.93 -1.18 0.00 0.00 179.01 178.71 2hl2 h GLU 63 N 0.23 0.00 0.10 1.92 4.39 -1.14 -2.21 114.58 117.87 2hl2 h GLU 63 Ca 0.03 0.00 -0.21 0.00 0.34 0.00 0.00 59.36 59.52 2hl2 h GLU 63 Cb 0.63 0.00 0.02 0.00 -0.10 0.00 0.00 28.75 29.30 2hl2 h GLU 63 CO 0.05 0.57 -0.90 0.82 -1.16 0.00 0.00 179.01 178.38 2hl2 h ILE 64 N 0.00 1.42 -0.36 3.13 1.08 -0.93 -3.20 117.51 118.65 2hl2 h ILE 64 Ca -0.01 -2.38 -0.02 0.00 -0.39 0.00 0.00 64.86 62.06 2hl2 h ILE 64 Cb 1.38 2.88 -0.02 0.00 -3.07 0.00 0.00 36.82 38.00 2hl2 h ILE 64 CO 0.07 0.70 0.16 0.28 -0.69 0.00 0.00 178.15 178.67 2hl2 h SER 65 N -0.10 0.48 -0.57 1.72 0.02 -1.42 -1.18 113.55 112.50 2hl2 h SER 65 Ca -0.14 -0.15 0.12 0.00 -0.84 0.00 0.00 61.79 60.78 2hl2 h SER 65 Cb 1.64 -0.12 -0.09 0.00 0.14 0.00 0.00 62.40 63.96 2hl2 h SER 65 CO 0.17 0.49 0.02 0.50 -1.14 0.00 0.00 176.83 176.88 2hl2 h LYS 66 N 0.44 0.13 0.00 3.45 3.64 -1.49 0.19 116.57 122.93 2hl2 h LYS 66 Ca 0.12 -0.01 -0.08 0.00 -1.27 0.00 0.00 60.65 59.41 2hl2 h LYS 66 Cb 0.15 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 31.93 2hl2 h LYS 66 CO -0.01 0.09 -0.39 0.28 -2.27 0.00 0.00 179.45 177.15 2hl2 h VAL 67 N 0.14 1.02 0.00 2.00 2.07 -1.50 -1.79 116.25 118.19 2hl2 h VAL 67 Ca 0.30 -1.46 -0.04 0.00 0.82 0.00 0.00 66.70 66.32 2hl2 h VAL 67 Cb 0.47 1.85 -0.01 0.00 -1.52 0.00 0.00 31.29 32.08 2hl2 h VAL 67 CO -0.47 0.38 -0.17 0.00 0.02 0.00 0.00 177.57 177.33 2hl2 h ALA 68 N 1.61 1.05 0.19 1.67 0.00 0.55 -2.53 119.26 121.81 2hl2 h ALA 68 Ca -0.00 -0.16 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 2hl2 h ALA 68 Cb 0.82 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.58 2hl2 h ALA 68 CO 0.05 0.22 -0.09 0.93 0.00 0.00 0.00 179.25 180.35 2hl2 h GLU 69 N 0.00 -0.25 -0.93 0.00 4.39 -0.24 -0.13 114.58 117.43 2hl2 h GLU 69 Ca -0.00 0.02 0.22 0.00 0.34 0.00 0.00 59.36 59.94 2hl2 h GLU 69 Cb 0.65 0.06 -0.17 0.00 -0.10 0.00 0.00 28.75 29.18 2hl2 h GLU 69 CO 0.02 -0.17 -0.06 1.96 -1.16 0.00 0.00 179.01 179.60 2hl2 h GLN 70 N -1.02 0.03 -0.47 2.33 4.20 -1.29 0.47 115.11 119.36 2hl2 h GLN 70 Ca -0.03 -0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.68 2hl2 h GLN 70 Cb 0.20 -0.01 0.00 0.00 0.30 0.00 0.00 27.48 27.97 2hl2 h GLN 70 CO 0.04 0.02 0.00 1.33 -0.67 0.00 0.00 178.83 179.55 2hl2 n VAL 71 N -5.49 0.65 -3.95 -0.54 0.24 -0.96 -4.93 118.33 103.34 2hl2 n VAL 71 Ca 0.18 -0.63 -0.31 0.00 -2.04 0.00 0.00 64.34 61.54 2hl2 n VAL 71 Cb 0.61 0.29 0.01 0.00 -1.47 0.00 0.00 33.84 33.28 2hl2 n VAL 71 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 2hl2 n LYS 72 N 0.84 -4.80 -3.12 7.34 5.02 0.17 -4.94 118.16 118.67 2hl2 n LYS 72 Ca 0.16 0.54 -0.39 0.00 -2.02 0.00 0.00 58.31 56.59 2hl2 n LYS 72 Cb 0.40 -5.38 -0.05 0.00 -0.02 0.00 0.00 35.03 29.98 2hl2 n LYS 72 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2hl2 s ALA 73 N -3.27 3.40 -0.08 7.82 0.00 -0.07 -4.95 121.76 124.61 2hl2 s ALA 73 Ca 0.67 0.07 0.12 0.00 0.00 0.00 0.00 51.96 52.82 2hl2 s ALA 73 Cb -0.35 -2.86 -0.24 0.00 0.00 0.00 0.00 23.12 19.68 2hl2 s ALA 73 CO 0.83 -0.00 0.50 -1.91 0.00 0.00 0.00 175.76 175.18 2hl2 n GLU 74 N 3.39 0.65 -4.34 0.00 4.07 -1.26 -4.70 120.64 118.46 2hl2 n GLU 74 Ca -0.04 0.23 -0.34 0.00 -0.06 0.00 0.00 57.16 56.95 2hl2 n GLU 74 Cb 0.51 -1.73 -0.09 0.00 -0.06 0.00 0.00 31.44 30.07 2hl2 n GLU 74 CO 0.00 0.00 0.00 -0.80 -0.06 0.00 0.00 177.13 176.27 2hl2 s ASN 75 N -6.06 5.23 -0.03 4.31 0.01 -1.26 -2.44 114.94 114.70 2hl2 s ASN 75 Ca -0.08 0.10 0.04 0.00 -0.71 0.00 0.00 52.86 52.21 2hl2 s ASN 75 Cb 0.07 -1.44 -0.00 0.00 0.41 0.00 0.00 41.25 40.29 2hl2 s ASN 75 CO 0.82 0.35 -0.14 -0.69 -1.51 0.00 0.00 177.10 175.92 2hl2 s VAL 76 N -0.96 1.18 -0.12 1.60 1.01 -0.55 -1.30 120.40 121.27 2hl2 s VAL 76 Ca 0.16 -0.59 0.03 0.00 0.00 0.00 0.00 61.98 61.58 2hl2 s VAL 76 Cb -0.11 -1.02 0.01 0.00 0.00 0.00 0.00 36.38 35.25 2hl2 s VAL 76 CO 0.05 0.35 -0.21 0.12 0.00 0.00 0.00 175.10 175.41 2hl2 s PHE 77 N 0.06 2.44 -0.40 5.22 5.36 -0.79 -1.37 117.98 128.51 2hl2 s PHE 77 Ca -0.03 -1.13 -0.19 0.00 -0.96 0.00 0.00 56.93 54.62 2hl2 s PHE 77 Cb -0.10 -1.67 0.01 0.00 -0.34 0.00 0.00 43.02 40.92 2hl2 s PHE 77 CO 0.01 -0.51 0.58 0.08 -1.46 0.00 0.00 175.22 173.92 2hl2 s VAL 78 N 0.68 4.92 -0.45 3.12 1.01 -0.21 -0.87 120.40 128.60 2hl2 s VAL 78 Ca -0.11 0.20 -0.10 0.00 0.00 0.00 0.00 61.98 61.97 2hl2 s VAL 78 Cb -0.16 -4.09 0.10 0.00 0.00 0.00 0.00 36.38 32.23 2hl2 s VAL 78 CO 0.02 -0.42 0.32 -0.47 0.00 0.00 0.00 175.10 174.55 2hl2 s TYR 79 N 2.59 3.39 -0.26 5.22 6.14 0.13 -2.84 117.35 131.71 2hl2 s TYR 79 Ca 0.20 -1.71 -0.32 0.00 0.64 0.00 0.00 57.07 55.89 2hl2 s TYR 79 Cb -0.15 -3.31 -0.08 0.00 0.42 0.00 0.00 41.96 38.84 2hl2 s TYR 79 CO 0.16 -0.94 2.18 -2.30 0.64 0.00 0.00 175.55 175.29 2hl2 n PRO 80 N 4.93 1.62 -4.58 4.97 -0.02 -1.26 -1.58 135.00 139.07 2hl2 n PRO 80 Ca -0.09 0.46 -0.28 0.00 -2.02 0.00 0.00 63.50 61.57 2hl2 n PRO 80 Cb 0.42 -2.86 -0.17 0.00 -0.02 0.00 0.00 33.50 30.86 2hl2 n PRO 80 CO 0.00 0.00 0.00 0.12 1.98 0.00 0.00 175.50 177.60 2hl2 s PHE 81 N 7.52 1.87 -2.43 6.00 5.36 -0.51 -4.86 117.98 130.93 2hl2 s PHE 81 Ca 1.04 -0.81 0.22 0.00 -0.96 0.00 0.00 56.93 56.42 2hl2 s PHE 81 Cb -0.58 -1.34 0.60 0.00 -0.34 0.00 0.00 43.02 41.35 2hl2 s PHE 81 CO 0.42 -0.41 1.48 0.00 -1.46 0.00 0.00 175.22 175.26 2hl2 n ALA 82 N 4.01 2.48 -1.50 11.12 0.00 -1.26 -3.28 120.51 132.09 2hl2 n ALA 82 Ca -0.20 -0.70 -0.05 0.00 0.00 0.00 0.00 53.44 52.48 2hl2 n ALA 82 Cb 0.52 -0.99 0.19 0.00 0.00 0.00 0.00 19.45 19.17 2hl2 n ALA 82 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2hl2 n HIS 83 N 0.83 1.11 0.46 0.00 8.25 -1.26 -4.41 115.22 120.21 2hl2 n HIS 83 Ca 0.17 -1.66 0.05 0.00 -0.26 0.00 0.00 57.72 56.02 2hl2 n HIS 83 Cb 0.46 -0.49 -0.00 0.00 1.12 0.00 0.00 29.99 31.07 2hl2 n HIS 83 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2hl2 n LEU 84 N -1.11 1.20 -4.00 2.41 4.77 -1.26 -5.01 117.00 114.00 2hl2 n LEU 84 Ca 0.33 -0.75 -0.08 0.00 -0.03 0.00 0.00 56.01 55.48 2hl2 n LEU 84 Cb 1.01 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 42.00 2hl2 n LEU 84 CO 0.19 0.24 -0.30 -0.55 -1.33 0.00 0.00 177.39 175.65 2hl2 s SER 85 N -1.41 0.30 -0.19 -1.43 0.15 -1.26 -4.90 113.70 104.96 2hl2 s SER 85 Ca 0.08 -0.70 -0.04 0.00 0.70 0.00 0.00 55.95 56.00 2hl2 s SER 85 Cb 0.08 0.19 -0.22 0.00 -1.71 0.00 0.00 66.02 64.37 2hl2 s SER 85 CO 0.27 -0.50 0.09 -1.20 1.20 0.00 0.00 173.24 173.10 2hl2 n SER 86 N 0.71 2.05 -4.05 5.45 7.64 -1.26 -4.62 113.62 119.55 2hl2 n SER 86 Ca -0.18 0.08 -0.43 0.00 1.01 0.00 0.00 58.87 59.34 2hl2 n SER 86 Cb 0.59 -0.68 0.01 0.00 -1.01 0.00 0.00 64.21 63.11 2hl2 n SER 86 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2hl2 n GLU 87 N -3.45 3.85 -1.30 1.43 4.71 -1.26 -5.03 120.64 119.59 2hl2 n GLU 87 Ca -0.39 -4.00 -0.30 0.00 -0.01 0.00 0.00 57.16 52.46 2hl2 n GLU 87 Cb 1.01 -2.77 0.10 0.00 -1.01 0.00 0.00 31.44 28.77 2hl2 n GLU 87 CO 0.00 0.00 0.00 -0.51 0.09 0.00 0.00 177.13 176.71 2hl2 s LEU 88 N -0.84 2.75 0.27 -4.62 1.43 -1.26 -1.43 118.68 114.98 2hl2 s LEU 88 Ca 0.36 1.64 -0.02 0.00 -1.03 0.00 0.00 54.13 55.09 2hl2 s LEU 88 Cb 0.04 -4.26 -0.04 0.00 0.03 0.00 0.00 46.19 41.96 2hl2 s LEU 88 CO 0.03 -2.16 0.49 0.00 0.23 0.00 0.00 176.35 174.94 2hl2 s ALA 89 N -2.95 3.72 0.23 4.21 0.00 -0.11 -3.37 121.76 123.49 2hl2 s ALA 89 Ca 0.61 -0.75 -0.31 0.00 0.00 0.00 0.00 51.96 51.51 2hl2 s ALA 89 Cb -0.17 -2.14 -0.14 0.00 0.00 0.00 0.00 23.12 20.67 2hl2 s ALA 89 CO 0.56 0.24 1.39 1.17 0.00 0.00 0.00 175.76 179.12 2hl2 n LYS 90 N -1.06 1.95 -0.33 0.00 4.81 -1.26 -4.66 118.16 117.62 2hl2 n LYS 90 Ca -0.04 0.70 0.21 0.00 -0.87 0.00 0.00 58.31 58.31 2hl2 n LYS 90 Cb 0.54 -2.34 0.40 0.00 0.02 0.00 0.00 35.03 33.66 2hl2 n LYS 90 CO 0.00 0.00 0.00 -1.35 1.17 0.00 0.00 177.40 177.22 2hl2 h PRO 91 N 4.15 0.04 -0.36 1.64 0.11 -1.99 0.11 132.00 135.71 2hl2 h PRO 91 Ca -0.45 -0.00 -0.03 0.00 0.11 0.00 0.00 66.00 65.62 2hl2 h PRO 91 Cb 1.28 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.37 2hl2 h PRO 91 CO 0.75 0.03 0.09 0.66 -0.21 0.00 0.00 178.00 179.32 2hl2 h SER 92 N 0.04 0.54 0.20 -2.05 4.64 -2.00 -2.37 113.55 112.56 2hl2 h SER 92 Ca 0.69 -0.23 -0.14 0.00 -0.47 0.00 0.00 61.79 61.64 2hl2 h SER 92 Cb 1.60 -0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 63.54 2hl2 h SER 92 CO -0.83 0.63 -0.51 0.58 -0.87 0.00 0.00 176.83 175.84 2hl2 h VAL 93 N 0.43 1.34 0.53 0.95 2.07 -1.21 -2.85 116.25 117.51 2hl2 h VAL 93 Ca 0.11 -1.76 -0.03 0.00 0.82 0.00 0.00 66.70 65.85 2hl2 h VAL 93 Cb 0.30 1.80 0.00 0.00 -1.52 0.00 0.00 31.29 31.88 2hl2 h VAL 93 CO 0.00 0.53 -0.26 0.00 0.02 0.00 0.00 177.57 177.86 2hl2 h ALA 94 N 1.19 -0.72 -0.96 1.67 0.00 -0.88 -1.21 119.26 118.35 2hl2 h ALA 94 Ca 0.01 -0.16 0.13 0.00 0.00 0.00 0.00 54.91 54.89 2hl2 h ALA 94 Cb 0.99 0.29 -0.08 0.00 0.00 0.00 0.00 17.79 18.99 2hl2 h ALA 94 CO 0.08 -0.91 0.61 0.52 0.00 0.00 0.00 179.25 179.56 2hl2 h MET 95 N -0.72 0.87 0.02 0.00 2.86 -1.45 -0.19 114.93 116.31 2hl2 h MET 95 Ca -0.07 -0.05 -0.00 0.00 -2.06 0.00 0.00 59.70 57.51 2hl2 h MET 95 Cb 0.56 -0.20 0.00 0.00 0.06 0.00 0.00 31.60 32.02 2hl2 h MET 95 CO 0.12 0.57 -0.01 0.22 1.06 0.00 0.00 176.91 178.87 2hl2 h ASP 96 N 0.89 -0.02 -0.60 1.22 3.58 -1.28 -1.74 116.42 118.47 2hl2 h ASP 96 Ca 0.48 -0.32 -0.01 0.00 0.42 0.00 0.00 57.03 57.59 2hl2 h ASP 96 Cb 0.55 0.00 -0.03 0.00 1.72 0.00 0.00 39.33 41.58 2hl2 h ASP 96 CO -0.24 0.32 0.35 0.40 -2.88 0.00 0.00 179.24 177.18 2hl2 h ILE 97 N -0.35 1.19 -0.25 2.25 1.08 -0.69 -1.45 117.51 119.27 2hl2 h ILE 97 Ca -0.00 -0.44 -0.01 0.00 -0.39 0.00 0.00 64.86 64.01 2hl2 h ILE 97 Cb 0.34 0.39 -0.01 0.00 -3.07 0.00 0.00 36.82 34.46 2hl2 h ILE 97 CO 0.00 0.20 0.10 -0.07 -0.69 0.00 0.00 178.15 177.69 2hl2 h LEU 98 N 0.82 0.31 -0.09 1.44 3.38 -1.00 -1.18 115.31 118.99 2hl2 h LEU 98 Ca 0.21 -0.02 -0.17 0.00 0.09 0.00 0.00 57.88 57.99 2hl2 h LEU 98 Cb 0.01 -0.08 0.01 0.00 0.09 0.00 0.00 40.66 40.69 2hl2 h LEU 98 CO -0.04 0.29 -0.60 -1.13 0.09 0.00 0.00 178.44 177.05 2hl2 h ASN 99 N 0.35 0.68 -0.20 -0.43 -0.00 -0.87 -0.58 115.58 114.54 2hl2 h ASN 99 Ca 0.09 -0.66 0.05 0.00 -0.00 0.00 0.00 56.30 55.77 2hl2 h ASN 99 Cb 0.08 -0.20 -0.05 0.00 -0.00 0.00 0.00 38.32 38.15 2hl2 h ASN 99 CO -0.01 1.24 -0.14 0.03 -0.00 0.00 0.00 177.43 178.56 2hl2 h ARG 100 N 0.18 -0.13 0.10 6.67 3.08 -0.67 0.12 114.38 123.73 2hl2 h ARG 100 Ca -0.05 0.01 -0.00 0.00 0.07 0.00 0.00 59.98 60.00 2hl2 h ARG 100 Cb 1.26 0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.34 2hl2 h ARG 100 CO 0.12 -0.09 -0.05 0.28 -1.07 0.00 0.00 179.97 179.17 2hl2 h VAL 101 N -0.13 0.98 -0.01 2.04 2.07 -1.24 0.16 116.25 120.11 2hl2 h VAL 101 Ca 0.12 -0.27 0.01 0.00 0.82 0.00 0.00 66.70 67.37 2hl2 h VAL 101 Cb 0.31 1.15 -0.04 0.00 -1.52 0.00 0.00 31.29 31.19 2hl2 h VAL 101 CO -0.28 0.07 -0.34 0.22 0.02 0.00 0.00 177.57 177.26 2hl2 h TYR 102 N -0.26 -1.00 -0.28 1.57 3.20 -0.81 -0.14 116.97 119.25 2hl2 h TYR 102 Ca -0.01 0.03 0.06 0.00 3.14 0.00 0.00 58.73 61.95 2hl2 h TYR 102 Cb 0.21 0.44 -0.06 0.00 1.54 0.00 0.00 36.73 38.85 2hl2 h TYR 102 CO -0.03 -0.36 -0.14 1.96 -1.64 0.00 0.00 178.16 177.94 2hl2 h GLN 103 N -0.42 -0.10 -0.04 1.82 1.08 -0.73 -1.14 115.11 115.57 2hl2 h GLN 103 Ca 0.01 0.01 0.01 0.00 -1.45 0.00 0.00 58.65 57.23 2hl2 h GLN 103 Cb 0.45 0.02 -0.00 0.00 -0.05 0.00 0.00 27.48 27.91 2hl2 h GLN 103 CO -0.23 -0.07 0.06 0.78 -0.95 0.00 0.00 178.83 178.43 2hl2 h GLY 104 N -0.11 0.00 1.45 3.46 0.00 -0.40 -0.03 103.07 107.44 2hl2 h GLY 104 Ca 0.15 0.00 -0.31 0.00 0.00 0.00 0.00 47.33 47.17 2hl2 h GLY 104 CO -0.35 0.00 -1.36 1.41 0.00 0.00 0.00 176.54 176.24 2hl2 h LEU 105 N 0.00 0.64 -0.84 3.11 4.07 0.15 -3.17 115.31 119.28 2hl2 h LEU 105 Ca 0.02 -0.69 -0.04 0.00 0.08 0.00 0.00 57.88 57.25 2hl2 h LEU 105 Cb 0.15 -0.21 -0.04 0.00 1.08 0.00 0.00 40.66 41.65 2hl2 h LEU 105 CO -0.00 1.54 0.33 0.11 -1.08 0.00 0.00 178.44 179.33 2hl2 h LYS 106 N 0.11 1.17 0.00 1.13 1.57 -0.06 -2.12 116.57 118.38 2hl2 h LYS 106 Ca -0.20 -0.20 0.00 0.00 -1.87 0.00 0.00 60.65 58.38 2hl2 h LYS 106 Cb 2.07 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 34.19 2hl2 h LYS 106 CO 0.24 0.94 0.00 -0.85 -0.57 0.00 0.00 179.45 179.21 2hl2 n GLU 107 N -4.28 0.08 0.00 3.15 0.28 -0.76 -2.17 120.64 116.94 2hl2 n GLU 107 Ca 0.07 0.20 0.14 0.00 -0.16 0.00 0.00 57.16 57.41 2hl2 n GLU 107 Cb 0.18 -1.62 0.60 0.00 1.43 0.00 0.00 31.44 32.02 2hl2 n GLU 107 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 2hl2 n ARG 108 N -1.77 0.01 0.00 3.44 5.12 -0.80 -4.89 116.66 117.76 2hl2 n ARG 108 Ca 0.05 0.02 0.00 0.00 -1.93 0.00 0.00 57.85 55.99 2hl2 n ARG 108 Cb 0.28 -1.51 0.00 0.00 -1.16 0.00 0.00 32.46 30.07 2hl2 n ARG 108 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2hl2 n GLY 109 N 1.40 1.01 3.87 -0.13 0.00 -0.92 -5.09 105.19 105.33 2hl2 n GLY 109 Ca 0.07 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.75 2hl2 n GLY 109 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2hl2 s PHE 110 N -2.00 3.56 -0.34 1.61 0.08 -1.20 -5.03 117.98 114.67 2hl2 s PHE 110 Ca 0.00 0.76 -0.29 0.00 0.12 0.00 0.00 56.93 57.52 2hl2 s PHE 110 Cb 0.00 -2.14 0.02 0.00 -0.57 0.00 0.00 43.02 40.33 2hl2 s PHE 110 CO 0.00 0.50 1.10 1.21 -0.10 0.00 0.00 175.22 177.93 2hl2 s ASN 111 N -1.86 6.88 -0.07 1.36 3.04 -1.02 -4.49 114.94 118.78 2hl2 s ASN 111 Ca 0.34 0.99 0.03 0.00 0.04 0.00 0.00 52.86 54.26 2hl2 s ASN 111 Cb -0.14 -2.54 -0.02 0.00 -1.54 0.00 0.00 41.25 37.01 2hl2 s ASN 111 CO 0.19 -0.94 -0.15 -0.69 -3.04 0.00 0.00 177.10 172.47 2hl2 s VAL 112 N 3.81 3.01 0.40 -5.21 1.01 -1.26 -1.49 120.40 120.66 2hl2 s VAL 112 Ca 0.47 -0.73 0.07 0.00 0.00 0.00 0.00 61.98 61.79 2hl2 s VAL 112 Cb -0.12 -2.19 -0.08 0.00 0.00 0.00 0.00 36.38 33.99 2hl2 s VAL 112 CO 0.18 0.58 -0.00 -0.83 0.00 0.00 0.00 175.10 175.02 2hl2 s GLY 113 N -0.46 2.44 -0.19 4.51 0.00 -0.47 -5.00 107.32 108.15 2hl2 s GLY 113 Ca 0.06 -2.27 -0.27 0.00 0.00 0.00 0.00 44.72 42.24 2hl2 s GLY 113 CO 0.02 -2.08 0.71 -1.59 0.00 0.00 0.00 173.10 170.16 2hl2 s LYS 114 N -3.70 0.91 0.01 2.90 -2.85 -1.26 -1.04 119.74 114.71 2hl2 s LYS 114 Ca 0.35 0.74 -0.15 0.00 -1.00 0.00 0.00 55.97 55.90 2hl2 s LYS 114 Cb 0.09 0.44 -0.06 0.00 -2.06 0.00 0.00 37.83 36.24 2hl2 s LYS 114 CO 0.18 -0.18 0.43 0.00 0.10 0.00 0.00 175.35 175.88 2hl2 s ALA 115 N -0.17 3.68 0.19 0.59 0.00 -1.13 -4.99 121.76 119.93 2hl2 s ALA 115 Ca -0.04 -0.19 -0.32 0.00 0.00 0.00 0.00 51.96 51.41 2hl2 s ALA 115 Cb -0.03 -2.41 -0.11 0.00 0.00 0.00 0.00 23.12 20.56 2hl2 s ALA 115 CO 0.04 0.47 1.67 -1.25 0.00 0.00 0.00 175.76 176.69 2hl2 s PRO 116 N -1.12 4.16 0.31 0.00 0.04 -1.26 -4.57 135.00 132.56 2hl2 s PRO 116 Ca 0.25 2.52 -0.29 0.00 0.04 0.00 0.00 61.00 63.51 2hl2 s PRO 116 Cb -0.17 -3.11 -0.10 0.00 0.04 0.00 0.00 34.50 31.16 2hl2 s PRO 116 CO 0.14 -0.70 1.29 0.12 0.04 0.00 0.00 177.00 177.89 2hl2 s PHE 117 N 1.18 3.13 0.00 0.56 5.36 -1.26 -3.89 117.98 123.06 2hl2 s PHE 117 Ca 0.73 1.40 0.00 0.00 -0.96 0.00 0.00 56.93 58.10 2hl2 s PHE 117 Cb -0.47 -3.64 0.00 0.00 -0.34 0.00 0.00 43.02 38.57 2hl2 s PHE 117 CO 0.32 -1.76 0.00 0.41 -1.46 0.00 0.00 175.22 172.72 2hl2 n GLY 118 N 1.09 0.57 3.39 13.12 0.00 -1.26 -2.36 105.19 119.75 2hl2 n GLY 118 Ca 0.01 -0.43 -0.20 0.00 0.00 0.00 0.00 46.02 45.41 2hl2 n GLY 118 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2hl2 s TYR 119 N -2.00 1.82 -0.16 1.61 1.51 -1.25 -1.28 117.35 117.60 2hl2 s TYR 119 Ca 0.00 -0.74 -0.18 0.00 -1.01 0.00 0.00 57.07 55.14 2hl2 s TYR 119 Cb 0.00 -1.02 -0.04 0.00 -0.11 0.00 0.00 41.96 40.79 2hl2 s TYR 119 CO 0.00 0.21 0.51 0.71 -1.11 0.00 0.00 175.55 175.87 2hl2 s TYR 120 N -3.11 3.43 0.05 2.71 2.02 0.16 -4.73 117.35 117.90 2hl2 s TYR 120 Ca 0.28 0.83 0.08 0.00 -0.37 0.00 0.00 57.07 57.90 2hl2 s TYR 120 Cb 0.04 -2.63 -0.03 0.00 -0.40 0.00 0.00 41.96 38.94 2hl2 s TYR 120 CO 0.10 0.01 -0.22 0.15 -1.57 0.00 0.00 175.55 174.02 2hl2 s LYS 121 N 1.20 1.47 0.23 -0.62 3.01 -1.26 -0.43 119.74 123.34 2hl2 s LYS 121 Ca 0.25 -1.03 -0.06 0.00 -1.01 0.00 0.00 55.97 54.13 2hl2 s LYS 121 Cb -0.15 -1.63 -0.06 0.00 -1.01 0.00 0.00 37.83 34.97 2hl2 s LYS 121 CO 0.10 0.41 0.50 0.00 0.51 0.00 0.00 175.35 176.87 2hl2 s ALA 122 N -0.85 3.66 0.06 5.17 0.00 -0.13 -4.87 121.76 124.80 2hl2 s ALA 122 Ca 0.09 -0.50 -0.27 0.00 0.00 0.00 0.00 51.96 51.29 2hl2 s ALA 122 Cb -0.09 -2.27 0.08 0.00 0.00 0.00 0.00 23.12 20.83 2hl2 s ALA 122 CO 0.02 0.44 0.67 -0.59 0.00 0.00 0.00 175.76 176.30 2hl2 s PHE 123 N -1.88 -0.56 -0.06 0.00 -0.71 -1.26 -1.21 117.98 112.30 2hl2 s PHE 123 Ca 0.44 0.61 0.04 0.00 -1.04 0.00 0.00 56.93 56.98 2hl2 s PHE 123 Cb -0.11 0.50 0.00 0.00 -1.21 0.00 0.00 43.02 42.20 2hl2 s PHE 123 CO 0.26 -0.72 -0.19 0.15 -1.34 0.00 0.00 175.22 173.38 2hl2 s LYS 124 N -2.69 2.20 0.01 1.99 1.02 0.15 -4.98 119.74 117.44 2hl2 s LYS 124 Ca -0.03 -0.68 0.01 0.00 0.02 0.00 0.00 55.97 55.30 2hl2 s LYS 124 Cb -0.01 -1.80 -0.01 0.00 -0.52 0.00 0.00 37.83 35.50 2hl2 s LYS 124 CO -0.04 0.20 -0.04 -1.50 -0.92 0.00 0.00 175.35 173.05 2hl2 s ILE 125 N 0.23 0.29 -0.32 2.17 2.07 -1.26 -1.51 121.20 122.87 2hl2 s ILE 125 Ca -0.10 -0.47 0.01 0.00 -1.41 0.00 0.00 60.65 58.68 2hl2 s ILE 125 Cb -0.14 -0.31 0.10 0.00 0.13 0.00 0.00 42.46 42.23 2hl2 s ILE 125 CO 0.04 -0.12 0.08 -0.55 -1.91 0.00 0.00 174.94 172.48 2hl2 s SER 126 N -0.63 4.35 0.05 4.50 0.15 -1.04 -5.02 113.70 116.06 2hl2 s SER 126 Ca -0.04 -1.87 -0.31 0.00 0.70 0.00 0.00 55.95 54.44 2hl2 s SER 126 Cb -0.05 -1.20 -0.05 0.00 -1.71 0.00 0.00 66.02 63.01 2hl2 s SER 126 CO -0.00 -0.40 1.20 0.00 1.20 0.00 0.00 173.24 175.24 2hl2 h LYS 128 N 6.84 0.00 -0.56 0.00 1.57 -1.57 -3.46 116.57 119.39 2hl2 h LYS 128 Ca -0.41 0.00 -0.19 0.00 -1.87 0.00 0.00 60.65 58.18 2hl2 h LYS 128 Cb 1.21 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 33.45 2hl2 h LYS 128 CO 0.81 0.06 -0.18 0.41 -0.57 0.00 0.00 179.45 179.98 2hl2 n GLY 129 N -0.72 0.97 3.95 3.86 0.00 -1.26 -5.04 105.19 106.96 2hl2 n GLY 129 Ca -0.02 -0.59 -0.23 0.00 0.00 0.00 0.00 46.02 45.18 2hl2 n GLY 129 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2hl2 s HIS 130 N -2.37 3.00 0.36 1.61 3.76 -1.26 -4.94 115.29 115.45 2hl2 s HIS 130 Ca 0.00 0.20 0.17 0.00 -0.15 0.00 0.00 55.06 55.28 2hl2 s HIS 130 Cb 0.00 -2.73 1.22 0.00 1.11 0.00 0.00 32.58 32.18 2hl2 s HIS 130 CO 0.00 -0.84 1.58 -1.35 -0.85 0.00 0.00 174.74 173.28 2hl2 h PRO 131 N -0.00 0.01 -0.14 8.40 0.11 -1.98 0.26 132.00 138.67 2hl2 h PRO 131 Ca -0.44 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.67 2hl2 h PRO 131 Cb 1.29 -0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.39 2hl2 h PRO 131 CO 0.56 0.01 0.00 1.28 -0.21 0.00 0.00 178.00 179.64 2hl2 n LEU 132 N -5.30 2.44 0.00 2.35 4.77 -1.26 -4.63 117.00 115.37 2hl2 n LEU 132 Ca 0.35 -2.10 0.11 0.00 -0.03 0.00 0.00 56.01 54.34 2hl2 n LEU 132 Cb 1.17 -0.13 0.63 0.00 -2.33 0.00 0.00 43.42 42.76 2hl2 n LEU 132 CO -0.00 0.61 0.88 0.00 -1.33 0.00 0.00 177.39 177.54 2hl2 n ALA 133 N -0.17 2.26 -3.51 -1.18 0.00 0.08 -4.52 120.51 113.47 2hl2 n ALA 133 Ca 0.06 -0.13 -0.19 0.00 0.00 0.00 0.00 53.44 53.19 2hl2 n ALA 133 Cb 0.36 -1.38 -0.13 0.00 0.00 0.00 0.00 19.45 18.30 2hl2 n ALA 133 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 2hl2 s GLU 134 N -2.31 0.17 0.13 0.00 2.02 -1.26 -1.13 118.70 116.33 2hl2 s GLU 134 Ca 0.28 0.18 0.00 0.00 0.02 0.00 0.00 54.97 55.46 2hl2 s GLU 134 Cb 0.16 -1.25 -0.04 0.00 0.10 0.00 0.00 34.13 33.10 2hl2 s GLU 134 CO 0.31 -0.65 0.01 -0.51 0.02 0.00 0.00 175.26 174.45 2hl2 s LEU 135 N 2.31 2.08 0.01 1.80 1.43 -0.54 -5.02 118.68 120.74 2hl2 s LEU 135 Ca 0.06 -1.14 0.00 0.00 -1.03 0.00 0.00 54.13 52.03 2hl2 s LEU 135 Cb -0.16 0.13 -0.01 0.00 0.03 0.00 0.00 46.19 46.19 2hl2 s LEU 135 CO -0.12 -0.63 -0.02 -0.94 0.23 0.00 0.00 176.35 174.87 2hl2 s SER 136 N -3.07 0.22 0.08 2.29 1.04 -1.26 -0.66 113.70 112.34 2hl2 s SER 136 Ca 0.20 -0.17 0.02 0.00 0.48 0.00 0.00 55.95 56.48 2hl2 s SER 136 Cb 0.07 0.01 -0.04 0.00 0.10 0.00 0.00 66.02 66.17 2hl2 s SER 136 CO -0.00 -0.07 -0.08 -0.13 0.98 0.00 0.00 173.24 173.94 2hl2 s ARG 137 N -0.47 0.76 -0.12 4.02 1.81 -0.44 -4.99 118.95 119.51 2hl2 s ARG 137 Ca -0.04 -1.15 0.01 0.00 -1.72 0.00 0.00 55.73 52.84 2hl2 s ARG 137 Cb -0.03 -0.30 0.02 0.00 -0.45 0.00 0.00 34.95 34.18 2hl2 s ARG 137 CO -0.00 0.02 -0.15 0.99 -0.68 0.00 0.00 175.30 175.48 2hl2 s THR 138 N -2.78 1.54 -0.28 0.02 2.01 -1.26 -0.54 115.64 114.34 2hl2 s THR 138 Ca 0.05 -0.66 0.02 0.00 0.31 0.00 0.00 61.69 61.41 2hl2 s THR 138 Cb -0.00 -1.41 0.08 0.00 0.01 0.00 0.00 72.50 71.17 2hl2 s THR 138 CO -0.02 0.45 0.00 -0.63 -0.69 0.00 0.00 174.62 173.73 2hl2 s ILE 139 N 1.09 1.69 0.12 1.82 -1.09 0.12 -4.96 121.20 120.00 2hl2 s ILE 139 Ca -0.04 -1.63 0.10 0.00 -2.23 0.00 0.00 60.65 56.84 2hl2 s ILE 139 Cb -0.14 -2.09 -0.04 0.00 -1.58 0.00 0.00 42.46 38.61 2hl2 s ILE 139 CO -0.04 -0.35 -0.24 0.68 -1.23 0.00 0.00 174.94 173.76 2hl2 s VAL 140 N 1.26 2.02 0.73 2.92 -7.23 -1.26 0.64 120.40 119.48 2hl2 s VAL 140 Ca 0.02 -1.70 -0.11 0.00 -1.81 0.00 0.00 61.98 58.38 2hl2 s VAL 140 Cb -0.19 -1.82 0.03 0.00 0.56 0.00 0.00 36.38 34.97 2hl2 s VAL 140 CO -0.10 -0.01 1.08 -2.16 -0.31 0.00 0.00 175.10 173.60 2hl2 s PRO 141 N -2.07 2.56 0.10 4.82 0.04 -1.26 -4.95 135.00 134.24 2hl2 s PRO 141 Ca 0.11 1.11 -0.09 0.00 0.04 0.00 0.00 61.00 62.17 2hl2 s PRO 141 Cb -0.10 -1.94 -0.06 0.00 0.04 0.00 0.00 34.50 32.45 2hl2 s PRO 141 CO 0.06 -1.40 0.41 -1.21 0.04 0.00 0.00 177.00 174.90 2hl2 s GLU 142 N -4.87 3.76 0.00 4.56 2.02 -1.26 -5.08 118.70 117.83 2hl2 s GLU 142 Ca 0.61 0.17 0.29 0.00 0.02 0.00 0.00 54.97 56.05 2hl2 s GLU 142 Cb -0.16 -2.95 1.19 0.00 0.10 0.00 0.00 34.13 32.30 2hl2 s GLU 142 CO 0.54 0.53 1.82 0.39 0.02 0.00 0.00 175.26 178.56