#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hl2 h GLY 21 N 0.00 -1.49 -6.67 2.61 0.00 -2.10 -2.95 103.07 92.47 3hl2 h GLY 21 Ca 0.00 0.84 -0.70 0.00 0.00 0.00 0.00 47.33 47.46 3hl2 h GLY 21 CO 0.00 -0.39 0.07 0.00 0.00 0.00 0.00 176.54 176.22 3hl2 n GLU 23 N 1.27 0.00 0.31 0.00 2.13 -1.11 -4.84 120.64 118.39 3hl2 n GLU 23 Ca 0.27 0.00 -0.16 0.00 0.66 0.00 0.00 57.16 57.93 3hl2 n GLU 23 Cb 0.37 -0.16 -0.08 0.00 0.27 0.00 0.00 31.44 31.84 3hl2 n GLU 23 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 3hl2 h ALA 24 N 0.00 -0.75 -1.01 4.31 0.00 -1.79 -3.09 119.26 116.94 3hl2 h ALA 24 Ca 0.00 -0.18 0.31 0.00 0.00 0.00 0.00 54.91 55.03 3hl2 h ALA 24 Cb 0.18 0.29 -0.14 0.00 0.00 0.00 0.00 17.79 18.12 3hl2 h ALA 24 CO 0.00 -0.88 0.58 0.00 0.00 0.00 0.00 179.25 178.95 3hl2 h ARG 25 N -0.84 0.37 -1.41 0.00 3.08 -1.93 -2.61 114.38 111.05 3hl2 h ARG 25 Ca -0.08 -0.02 0.41 0.00 0.07 0.00 0.00 59.98 60.36 3hl2 h ARG 25 Cb 0.61 -0.08 -0.07 0.00 0.08 0.00 0.00 29.97 30.51 3hl2 h ARG 25 CO 0.13 0.25 1.00 0.00 -1.07 0.00 0.00 179.97 180.27 3hl2 h ARG 26 N 0.38 0.03 -0.07 0.04 3.08 -1.88 1.04 114.38 117.00 3hl2 h ARG 26 Ca 0.71 -0.00 -0.22 0.00 0.07 0.00 0.00 59.98 60.54 3hl2 h ARG 26 Cb 1.58 -0.01 0.01 0.00 0.08 0.00 0.00 29.97 31.63 3hl2 h ARG 26 CO -0.57 0.02 -0.84 0.77 -1.07 0.00 0.00 179.97 178.28 3hl2 h SER 27 N 0.03 0.70 0.00 7.04 0.02 -1.67 -2.10 113.55 117.58 3hl2 h SER 27 Ca 0.69 -0.50 -0.03 0.00 -0.84 0.00 0.00 61.79 61.11 3hl2 h SER 27 Cb 2.66 -0.21 0.00 0.00 0.14 0.00 0.00 62.40 64.99 3hl2 h SER 27 CO -0.06 1.28 -0.13 0.45 -1.14 0.00 0.00 176.83 177.23 3hl2 h HIS 28 N 0.37 0.13 -0.79 3.45 3.86 0.60 -2.98 115.15 119.78 3hl2 h HIS 28 Ca -0.06 -0.07 0.19 0.00 -1.16 0.00 0.00 60.37 59.26 3hl2 h HIS 28 Cb 1.45 -0.01 -0.13 0.00 1.06 0.00 0.00 27.41 29.78 3hl2 h HIS 28 CO 0.07 0.88 0.07 0.93 0.86 0.00 0.00 177.93 180.74 3hl2 h GLU 29 N -0.67 0.13 -0.43 2.45 4.39 0.11 -0.51 114.58 120.06 3hl2 h GLU 29 Ca -0.02 -0.01 -0.08 0.00 0.34 0.00 0.00 59.36 59.60 3hl2 h GLU 29 Cb 0.92 -0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 29.52 3hl2 h GLU 29 CO 0.03 0.09 -0.06 1.25 -1.16 0.00 0.00 179.01 179.15 3hl2 h HIS 30 N 0.14 0.80 -0.38 4.33 2.76 -1.44 0.53 115.15 121.88 3hl2 h HIS 30 Ca 0.45 -0.12 -0.08 0.00 -2.20 0.00 0.00 60.37 58.41 3hl2 h HIS 30 Cb 0.82 -0.21 -0.01 0.00 1.55 0.00 0.00 27.41 29.55 3hl2 h HIS 30 CO -0.38 0.78 -0.08 -0.07 -1.30 0.00 0.00 177.93 176.88 3hl2 h LEU 31 N 0.68 0.73 -0.15 0.26 3.38 -1.02 -1.73 115.31 117.45 3hl2 h LEU 31 Ca 0.13 -0.36 -0.04 0.00 0.09 0.00 0.00 57.88 57.70 3hl2 h LEU 31 Cb 0.51 -0.20 -0.00 0.00 0.09 0.00 0.00 40.66 41.05 3hl2 h LEU 31 CO 0.03 0.92 -0.07 0.40 0.09 0.00 0.00 178.44 179.80 3hl2 h ILE 32 N 0.53 1.31 -0.72 1.22 2.04 -0.86 -2.48 117.51 118.55 3hl2 h ILE 32 Ca 0.10 -1.10 0.12 0.00 1.00 0.00 0.00 64.86 64.98 3hl2 h ILE 32 Cb 0.59 1.71 -0.08 0.00 -0.74 0.00 0.00 36.82 38.30 3hl2 h ILE 32 CO 0.04 0.32 0.31 -0.09 0.00 0.00 0.00 178.15 178.72 3hl2 h ARG 33 N -0.01 0.47 -0.18 2.37 2.43 0.04 -1.56 114.38 117.94 3hl2 h ARG 33 Ca 0.03 -0.03 -0.05 0.00 -0.81 0.00 0.00 59.98 59.13 3hl2 h ARG 33 Cb 0.53 -0.11 -0.01 0.00 -0.42 0.00 0.00 29.97 29.96 3hl2 h ARG 33 CO 0.02 0.31 -0.09 1.25 -1.51 0.00 0.00 179.97 179.95 3hl2 h LEU 34 N 0.49 0.26 -0.42 3.80 5.85 -1.15 -1.88 115.31 122.27 3hl2 h LEU 34 Ca 0.38 -0.05 -0.18 0.00 0.84 0.00 0.00 57.88 58.87 3hl2 h LEU 34 Cb 0.51 -0.07 -0.00 0.00 0.37 0.00 0.00 40.66 41.47 3hl2 h LEU 34 CO -0.35 0.39 -0.62 0.25 -0.34 0.00 0.00 178.44 177.78 3hl2 h LEU 35 N 0.27 0.68 -0.16 2.25 5.85 -0.84 -2.86 115.31 120.51 3hl2 h LEU 35 Ca 0.06 -0.39 -0.23 0.00 0.84 0.00 0.00 57.88 58.16 3hl2 h LEU 35 Cb 0.34 -0.20 0.00 0.00 0.37 0.00 0.00 40.66 41.17 3hl2 h LEU 35 CO 0.02 1.13 -0.96 -0.07 -0.34 0.00 0.00 178.44 178.23 3hl2 h LEU 36 N 0.45 0.53 -0.37 2.25 3.38 -1.14 0.71 115.31 121.12 3hl2 h LEU 36 Ca -0.01 -0.43 -0.15 0.00 0.09 0.00 0.00 57.88 57.38 3hl2 h LEU 36 Cb 1.19 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.77 3hl2 h LEU 36 CO 0.12 1.23 -0.35 -0.08 0.09 0.00 0.00 178.44 179.46 3hl2 h GLU 37 N 0.22 0.88 0.00 1.13 4.81 -1.37 -3.36 114.58 116.89 3hl2 h GLU 37 Ca -0.08 -0.46 0.00 0.00 -0.13 0.00 0.00 59.36 58.69 3hl2 h GLU 37 Cb 1.60 0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.99 3hl2 h GLU 37 CO 0.17 1.11 -0.72 1.63 -0.73 0.00 0.00 179.01 180.46 3hl2 n LYS 38 N -4.12 2.81 -1.36 1.92 5.02 -1.08 -5.02 118.16 116.34 3hl2 n LYS 38 Ca -0.02 -0.02 -0.13 0.00 -2.02 0.00 0.00 58.31 56.12 3hl2 n LYS 38 Cb 0.52 -0.92 -0.05 0.00 -0.02 0.00 0.00 35.03 34.56 3hl2 n LYS 38 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3hl2 n GLY 39 N 1.66 1.20 3.93 0.72 0.00 0.24 -4.98 105.19 107.97 3hl2 n GLY 39 Ca 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 3hl2 n GLY 39 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hl2 s LYS 40 N -3.05 3.20 0.51 1.61 -0.14 -1.26 -3.73 119.74 116.88 3hl2 s LYS 40 Ca 0.00 -0.15 -0.22 0.00 -1.36 0.00 0.00 55.97 54.24 3hl2 s LYS 40 Cb 0.00 -2.44 -0.06 0.00 -1.68 0.00 0.00 37.83 33.65 3hl2 s LYS 40 CO 0.00 -0.33 1.31 0.00 -0.76 0.00 0.00 175.35 175.57 3hl2 s PRO 42 N -2.81 4.04 0.07 0.00 0.02 -1.26 -4.70 135.00 130.36 3hl2 s PRO 42 Ca 0.69 2.36 -0.35 0.00 0.02 0.00 0.00 61.00 63.72 3hl2 s PRO 42 Cb -0.37 -2.87 -0.19 0.00 0.02 0.00 0.00 34.50 31.08 3hl2 s PRO 42 CO 0.44 -0.51 1.60 0.93 -0.33 0.00 0.00 177.00 179.14 3hl2 h GLU 43 N 2.86 -1.04 -5.38 5.54 5.08 -1.93 0.91 114.58 120.62 3hl2 h GLU 43 Ca -0.50 0.07 -0.62 0.00 -1.00 0.00 0.00 59.36 57.31 3hl2 h GLU 43 Cb 1.24 0.24 -0.13 0.00 0.50 0.00 0.00 28.75 30.60 3hl2 h GLU 43 CO 0.63 -0.69 -0.52 -0.80 -1.00 0.00 0.00 179.01 176.63 3hl2 s ASN 44 N -4.25 6.00 0.50 1.42 0.01 -1.26 -1.48 114.94 115.88 3hl2 s ASN 44 Ca -0.18 0.22 -0.20 0.00 -0.71 0.00 0.00 52.86 51.99 3hl2 s ASN 44 Cb 0.03 -2.01 -0.11 0.00 0.41 0.00 0.00 41.25 39.57 3hl2 s ASN 44 CO 0.61 0.23 0.48 0.61 -1.51 0.00 0.00 177.10 177.53 3hl2 n GLY 45 N 3.16 -1.62 3.80 0.66 0.00 -1.23 -4.78 105.19 105.17 3hl2 n GLY 45 Ca -0.17 -0.08 -0.33 0.00 0.00 0.00 0.00 46.02 45.45 3hl2 n GLY 45 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3hl2 s TRP 46 N -1.64 2.93 0.54 1.61 0.52 -0.30 -4.94 118.94 117.67 3hl2 s TRP 46 Ca 0.65 1.51 -0.16 0.00 0.02 0.00 0.00 56.10 58.12 3hl2 s TRP 46 Cb -0.51 -3.03 -0.07 0.00 -1.15 0.00 0.00 33.47 28.71 3hl2 s TRP 46 CO 0.57 -1.22 1.01 -0.51 0.02 0.00 0.00 176.95 176.82 3hl2 s ASP 47 N -2.81 6.35 0.26 2.95 1.11 -1.26 -4.73 116.67 118.54 3hl2 s ASP 47 Ca 0.64 1.65 -0.02 0.00 0.18 0.00 0.00 52.55 55.00 3hl2 s ASP 47 Cb -0.17 -2.52 0.46 0.00 1.07 0.00 0.00 42.92 41.76 3hl2 s ASP 47 CO 0.39 -0.78 1.83 -0.33 1.18 0.00 0.00 175.17 177.46 3hl2 h GLU 48 N 0.77 0.89 -0.52 8.23 5.08 -1.99 -1.30 114.58 125.75 3hl2 h GLU 48 Ca -0.47 -0.05 0.08 0.00 -1.00 0.00 0.00 59.36 57.92 3hl2 h GLU 48 Cb 1.20 -0.20 -0.10 0.00 0.50 0.00 0.00 28.75 30.15 3hl2 h GLU 48 CO 0.60 0.59 -0.43 0.66 -1.00 0.00 0.00 179.01 179.43 3hl2 h SER 49 N 0.92 -1.46 0.02 1.42 4.64 -1.99 0.29 113.55 117.38 3hl2 h SER 49 Ca 0.44 0.23 0.01 0.00 -0.47 0.00 0.00 61.79 62.00 3hl2 h SER 49 Cb 0.39 0.66 -0.01 0.00 -0.31 0.00 0.00 62.40 63.13 3hl2 h SER 49 CO -0.25 -0.35 -0.04 0.74 -0.87 0.00 0.00 176.83 176.07 3hl2 h THR 50 N -0.26 0.90 -0.16 2.95 2.02 -1.66 -1.09 112.91 115.62 3hl2 h THR 50 Ca 0.17 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.39 3hl2 h THR 50 Cb 0.57 0.90 -0.04 0.00 -1.74 0.00 0.00 68.15 67.84 3hl2 h THR 50 CO -0.65 0.00 -0.11 0.25 0.37 0.00 0.00 175.52 175.38 3hl2 h LEU 51 N -0.08 -0.37 -0.69 2.58 5.85 -0.30 -1.06 115.31 121.25 3hl2 h LEU 51 Ca 0.01 0.08 -0.12 0.00 0.84 0.00 0.00 57.88 58.69 3hl2 h LEU 51 Cb 0.09 0.19 -0.01 0.00 0.37 0.00 0.00 40.66 41.29 3hl2 h LEU 51 CO -0.03 -0.15 -0.26 -0.33 -0.34 0.00 0.00 178.44 177.33 3hl2 h GLU 52 N -0.12 0.73 0.08 1.25 5.08 -0.38 0.00 114.58 121.22 3hl2 h GLU 52 Ca 0.10 -0.31 0.02 0.00 -1.00 0.00 0.00 59.36 58.17 3hl2 h GLU 52 Cb 0.26 -0.03 -0.04 0.00 0.50 0.00 0.00 28.75 29.45 3hl2 h GLU 52 CO -0.23 0.91 -0.25 1.25 -1.00 0.00 0.00 179.01 179.69 3hl2 h LEU 53 N 0.63 -0.73 -0.18 1.33 5.85 -0.88 -1.51 115.31 119.82 3hl2 h LEU 53 Ca 0.08 0.09 0.05 0.00 0.84 0.00 0.00 57.88 58.94 3hl2 h LEU 53 Cb 0.77 0.28 -0.05 0.00 0.37 0.00 0.00 40.66 42.03 3hl2 h LEU 53 CO 0.06 -0.34 -0.12 0.15 -0.34 0.00 0.00 178.44 177.86 3hl2 h PHE 54 N -0.44 -0.29 -1.00 1.25 3.57 -0.94 -1.50 116.94 117.59 3hl2 h PHE 54 Ca 0.04 0.02 0.09 0.00 3.53 0.00 0.00 57.97 61.65 3hl2 h PHE 54 Cb 0.48 0.16 -0.07 0.00 2.79 0.00 0.00 35.95 39.30 3hl2 h PHE 54 CO -0.25 -0.18 0.64 -0.07 -2.23 0.00 0.00 178.31 176.22 3hl2 h LEU 55 N -0.12 0.99 -0.55 0.59 3.38 -0.77 -0.81 115.31 118.02 3hl2 h LEU 55 Ca 0.11 0.03 -0.13 0.00 0.09 0.00 0.00 57.88 57.97 3hl2 h LEU 55 Cb 0.27 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.83 3hl2 h LEU 55 CO -0.25 0.59 -0.27 0.45 0.09 0.00 0.00 178.44 179.04 3hl2 h HIS 56 N 1.09 1.01 0.00 1.13 3.86 -0.88 -0.70 115.15 120.66 3hl2 h HIS 56 Ca 0.46 -0.26 -0.00 0.00 -1.16 0.00 0.00 60.37 59.41 3hl2 h HIS 56 Cb 0.31 -0.23 -0.00 0.00 1.06 0.00 0.00 27.41 28.55 3hl2 h HIS 56 CO -0.00 1.04 -0.02 0.93 0.86 0.00 0.00 177.93 180.74 3hl2 h GLU 57 N 0.74 0.00 0.00 2.45 5.08 -0.14 -2.07 114.58 120.65 3hl2 h GLU 57 Ca 0.09 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.44 3hl2 h GLU 57 Cb 0.83 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.08 3hl2 h GLU 57 CO 0.07 0.02 -0.07 -0.07 -1.00 0.00 0.00 179.01 177.97 3hl2 h LEU 58 N 0.00 0.00 -0.71 1.33 3.38 -1.01 -3.36 115.31 114.94 3hl2 h LEU 58 Ca -0.00 -0.58 0.15 0.00 0.09 0.00 0.00 57.88 57.54 3hl2 h LEU 58 Cb 0.04 0.00 -0.13 0.00 0.09 0.00 0.00 40.66 40.66 3hl2 h LEU 58 CO 0.00 0.83 -0.08 0.00 0.09 0.00 0.00 178.44 179.28 3hl2 h ALA 59 N -0.42 0.61 0.00 1.53 0.00 -0.94 0.29 119.26 120.33 3hl2 h ALA 59 Ca -0.01 0.25 0.00 0.00 0.00 0.00 0.00 54.91 55.15 3hl2 h ALA 59 Cb 0.63 0.46 0.00 0.00 0.00 0.00 0.00 17.79 18.88 3hl2 h ALA 59 CO -0.01 -0.42 0.00 0.44 0.00 0.00 0.00 179.25 179.26 3hl2 n ILE 60 N -5.40 0.02 0.57 0.00 -5.35 -0.79 -1.18 119.36 107.22 3hl2 n ILE 60 Ca 0.11 0.01 0.12 0.00 -0.27 0.00 0.00 62.75 62.71 3hl2 n ILE 60 Cb 0.41 -0.78 0.19 0.00 -1.74 0.00 0.00 39.64 37.71 3hl2 n ILE 60 CO 0.00 0.00 0.00 0.23 -1.76 0.00 0.00 176.55 175.02 3hl2 n MET 61 N -1.01 0.30 -2.84 6.28 2.81 0.10 -4.64 117.12 118.11 3hl2 n MET 61 Ca 0.11 0.10 -0.40 0.00 -1.81 0.00 0.00 57.70 55.70 3hl2 n MET 61 Cb 0.05 -1.70 -0.06 0.00 -0.71 0.00 0.00 33.22 30.81 3hl2 n MET 61 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 3hl2 s ASP 62 N -4.27 7.52 0.19 7.83 1.11 -0.33 -3.91 116.67 124.82 3hl2 s ASP 62 Ca 0.06 1.80 -0.13 0.00 0.18 0.00 0.00 52.55 54.46 3hl2 s ASP 62 Cb 0.13 -2.56 0.20 0.00 1.07 0.00 0.00 42.92 41.76 3hl2 s ASP 62 CO 0.71 0.15 1.68 0.77 1.18 0.00 0.00 175.17 179.67 3hl2 h SER 63 N 4.40 -0.22 -0.56 0.27 4.64 -0.75 -0.32 113.55 121.01 3hl2 h SER 63 Ca -0.46 0.12 0.16 0.00 -0.47 0.00 0.00 61.79 61.15 3hl2 h SER 63 Cb 1.20 0.22 -0.02 0.00 -0.31 0.00 0.00 62.40 63.49 3hl2 h SER 63 CO 0.68 -0.08 0.51 -0.55 -0.87 0.00 0.00 176.83 176.52 3hl2 h ASN 64 N 0.12 0.00 0.09 4.97 -1.07 -1.79 0.25 115.58 118.15 3hl2 h ASN 64 Ca 0.26 0.00 0.00 0.00 0.07 0.00 0.00 56.30 56.63 3hl2 h ASN 64 Cb 0.40 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 36.65 3hl2 h ASN 64 CO -0.43 0.00 -0.22 0.59 0.07 0.00 0.00 177.43 177.44 3hl2 n ASN 65 N -3.91 1.58 -4.77 6.14 3.02 -0.14 -4.94 115.26 112.23 3hl2 n ASN 65 Ca 0.11 -1.29 -0.41 0.00 -0.03 0.00 0.00 54.58 52.96 3hl2 n ASN 65 Cb 0.73 0.17 -0.01 0.00 -0.61 0.00 0.00 39.78 40.06 3hl2 n ASN 65 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 3hl2 s PHE 66 N -2.33 2.78 0.05 3.10 0.08 0.87 -4.92 117.98 117.61 3hl2 s PHE 66 Ca 0.27 1.29 -0.22 0.00 0.12 0.00 0.00 56.93 58.38 3hl2 s PHE 66 Cb 0.19 -3.86 -0.14 0.00 -0.57 0.00 0.00 43.02 38.65 3hl2 s PHE 66 CO 0.47 -2.47 1.48 -0.07 -0.10 0.00 0.00 175.22 174.52 3hl2 h LEU 67 N 3.11 0.19 -5.93 -0.37 3.38 -1.92 -3.27 115.31 110.50 3hl2 h LEU 67 Ca -0.50 -0.30 -0.80 0.00 0.09 0.00 0.00 57.88 56.37 3hl2 h LEU 67 Cb 1.24 -0.05 -0.26 0.00 0.09 0.00 0.00 40.66 41.67 3hl2 h LEU 67 CO 0.64 0.45 1.09 0.61 0.09 0.00 0.00 178.44 181.32 3hl2 n GLY 68 N -0.30 5.96 3.53 0.83 0.00 -1.26 -4.98 105.19 108.97 3hl2 n GLY 68 Ca -0.06 -2.53 -0.34 0.00 0.00 0.00 0.00 46.02 43.09 3hl2 n GLY 68 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3hl2 s ASN 69 N -1.20 4.69 0.00 1.61 2.47 -1.24 -5.10 114.94 116.18 3hl2 s ASN 69 Ca 0.43 -0.08 0.08 0.00 0.42 0.00 0.00 52.86 53.70 3hl2 s ASN 69 Cb 0.25 -1.50 -0.02 0.00 -1.45 0.00 0.00 41.25 38.53 3hl2 s ASN 69 CO -0.19 0.26 -0.25 0.00 -3.72 0.00 0.00 177.10 173.20 3hl2 s GLY 71 N -0.85 1.44 -0.09 0.00 0.00 -1.26 -4.97 107.32 101.59 3hl2 s GLY 71 Ca 0.11 -1.02 0.13 0.00 0.00 0.00 0.00 44.72 43.94 3hl2 s GLY 71 CO 0.00 -0.06 1.09 3.33 0.00 0.00 0.00 173.10 177.46 3hl2 n VAL 72 N 3.91 1.46 -2.71 1.40 0.24 -1.26 -5.05 118.33 116.31 3hl2 n VAL 72 Ca -0.19 -1.72 -0.22 0.00 -2.04 0.00 0.00 64.34 60.17 3hl2 n VAL 72 Cb 0.52 0.00 0.10 0.00 -1.47 0.00 0.00 33.84 33.00 3hl2 n VAL 72 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3hl2 n GLY 73 N -1.07 0.98 0.07 7.63 0.00 -1.26 -5.03 105.19 106.50 3hl2 n GLY 73 Ca 0.11 -2.08 0.02 0.00 0.00 0.00 0.00 46.02 44.07 3hl2 n GLY 73 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 3hl2 n GLU 74 N -2.67 0.65 -4.02 1.61 0.00 -1.26 -4.71 120.64 110.24 3hl2 n GLU 74 Ca 0.16 -0.00 -0.31 0.00 0.00 0.00 0.00 57.16 57.01 3hl2 n GLU 74 Cb 0.58 -1.62 -0.15 0.00 0.00 0.00 0.00 31.44 30.25 3hl2 n GLU 74 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.13 177.63 3hl2 s ARG 75 N -3.04 1.49 0.00 3.44 3.52 -1.26 -4.95 118.95 118.14 3hl2 s ARG 75 Ca -0.07 -1.86 0.00 0.00 -0.13 0.00 0.00 55.73 53.68 3hl2 s ARG 75 Cb 0.10 -3.19 0.00 0.00 -1.56 0.00 0.00 34.95 30.30 3hl2 s ARG 75 CO 0.85 -0.93 0.55 0.39 -0.81 0.00 0.00 175.30 175.34 3hl2 n GLU 76 N 4.26 0.10 -1.91 5.12 -0.58 -1.26 -4.99 120.64 121.38 3hl2 n GLU 76 Ca 0.04 -0.66 -0.11 0.00 -0.42 0.00 0.00 57.16 56.00 3hl2 n GLU 76 Cb 0.42 -0.91 -0.02 0.00 -0.57 0.00 0.00 31.44 30.36 3hl2 n GLU 76 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3hl2 n GLY 77 N -0.11 0.37 3.77 0.62 0.00 -1.26 -4.50 105.19 104.08 3hl2 n GLY 77 Ca 0.00 -0.44 -0.39 0.00 0.00 0.00 0.00 46.02 45.19 3hl2 n GLY 77 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3hl2 s ARG 78 N -4.01 4.07 -0.17 1.61 0.52 -1.26 -4.90 118.95 114.81 3hl2 s ARG 78 Ca 0.00 1.89 -0.02 0.00 -0.52 0.00 0.00 55.73 57.08 3hl2 s ARG 78 Cb 0.00 -2.71 0.05 0.00 0.52 0.00 0.00 34.95 32.81 3hl2 s ARG 78 CO 0.00 -0.32 0.00 0.08 0.02 0.00 0.00 175.30 175.08 3hl2 s VAL 79 N -1.38 0.72 0.05 3.52 1.01 -1.26 -5.03 120.40 118.03 3hl2 s VAL 79 Ca 0.56 -0.50 -0.24 0.00 0.00 0.00 0.00 61.98 61.80 3hl2 s VAL 79 Cb -0.32 -1.06 -0.17 0.00 0.00 0.00 0.00 36.38 34.83 3hl2 s VAL 79 CO 0.40 -0.03 1.54 0.00 0.00 0.00 0.00 175.10 177.01 3hl2 h ALA 80 N 8.21 -0.05 -3.06 5.51 0.00 -2.03 -3.44 119.26 124.40 3hl2 h ALA 80 Ca -0.19 -0.10 -0.59 0.00 0.00 0.00 0.00 54.91 54.03 3hl2 h ALA 80 Cb 1.12 0.02 -0.10 0.00 0.00 0.00 0.00 17.79 18.83 3hl2 h ALA 80 CO 0.35 -0.43 -0.32 0.45 0.00 0.00 0.00 179.25 179.30 3hl2 s SER 81 N -5.34 6.46 0.31 0.00 0.15 -1.26 -4.98 113.70 109.04 3hl2 s SER 81 Ca -0.14 0.54 0.12 0.00 0.70 0.00 0.00 55.95 57.16 3hl2 s SER 81 Cb 0.04 -2.19 0.49 0.00 -1.71 0.00 0.00 66.02 62.66 3hl2 s SER 81 CO 0.66 0.11 1.69 0.00 1.20 0.00 0.00 173.24 176.90 3hl2 h ALA 82 N 6.56 1.11 -0.67 5.45 0.00 -2.00 -2.23 119.26 127.49 3hl2 h ALA 82 Ca -0.42 -0.48 0.04 0.00 0.00 0.00 0.00 54.91 54.05 3hl2 h ALA 82 Cb 1.17 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.83 3hl2 h ALA 82 CO 0.75 0.66 0.40 -0.07 0.00 0.00 0.00 179.25 180.98 3hl2 h LEU 83 N 0.00 0.64 0.19 0.00 3.38 -1.99 -0.38 115.31 117.15 3hl2 h LEU 83 Ca -0.01 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 57.97 3hl2 h LEU 83 Cb 0.94 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.57 3hl2 h LEU 83 CO 0.07 0.43 -0.09 0.58 0.09 0.00 0.00 178.44 179.52 3hl2 h VAL 84 N 0.77 0.88 -0.66 1.22 2.07 -1.89 -1.70 116.25 116.94 3hl2 h VAL 84 Ca 0.28 -0.33 0.10 0.00 0.82 0.00 0.00 66.70 67.58 3hl2 h VAL 84 Cb 0.07 1.08 -0.08 0.00 -1.52 0.00 0.00 31.29 30.84 3hl2 h VAL 84 CO -0.13 0.08 0.27 0.00 0.02 0.00 0.00 177.57 177.81 3hl2 h ALA 85 N 0.37 0.89 -0.35 1.67 0.00 -1.14 -2.61 119.26 118.09 3hl2 h ALA 85 Ca -0.03 0.09 -0.14 0.00 0.00 0.00 0.00 54.91 54.83 3hl2 h ALA 85 Cb 0.32 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 3hl2 h ALA 85 CO 0.04 -0.17 -0.33 0.00 0.00 0.00 0.00 179.25 178.80 3hl2 h ARG 86 N 0.46 0.84 0.00 0.00 3.08 -1.02 0.31 114.38 118.04 3hl2 h ARG 86 Ca 0.34 -0.44 0.00 0.00 0.07 0.00 0.00 59.98 59.95 3hl2 h ARG 86 Cb 0.43 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.50 3hl2 h ARG 86 CO -0.32 1.08 0.00 2.89 -1.07 0.00 0.00 179.97 182.54 3hl2 n ARG 87 N -4.16 0.19 -0.38 0.04 1.85 -0.64 -1.24 116.66 112.32 3hl2 n ARG 87 Ca -0.03 0.45 0.08 0.00 -1.00 0.00 0.00 57.85 57.36 3hl2 n ARG 87 Cb 0.51 -1.89 0.25 0.00 -1.05 0.00 0.00 32.46 30.28 3hl2 n ARG 87 CO 0.00 0.00 0.00 0.72 -0.01 0.00 0.00 177.63 178.34 3hl2 n HIS 88 N -2.26 0.90 -3.09 2.89 8.25 -1.10 -4.95 115.22 115.87 3hl2 n HIS 88 Ca 0.02 -0.61 -0.21 0.00 -0.26 0.00 0.00 57.72 56.66 3hl2 n HIS 88 Cb 0.20 -0.15 0.00 0.00 1.12 0.00 0.00 29.99 31.17 3hl2 n HIS 88 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 3hl2 n TYR 89 N 0.59 -1.74 -1.15 4.41 4.02 -0.38 -1.44 117.16 121.48 3hl2 n TYR 89 Ca 0.19 0.38 -0.05 0.00 -0.01 0.00 0.00 57.90 58.41 3hl2 n TYR 89 Cb 0.67 -3.25 -0.02 0.00 -0.02 0.00 0.00 39.34 36.72 3hl2 n TYR 89 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 176.86 176.39 3hl2 n ARG 90 N -3.59 -0.88 -2.86 -0.72 1.74 0.09 -4.74 116.66 105.70 3hl2 n ARG 90 Ca -0.07 0.55 -0.43 0.00 -0.77 0.00 0.00 57.85 57.13 3hl2 n ARG 90 Cb 0.57 -4.39 -0.04 0.00 -1.02 0.00 0.00 32.46 27.58 3hl2 n ARG 90 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 3hl2 s PHE 91 N -1.92 2.69 -0.11 -1.55 0.08 -0.52 -4.86 117.98 111.80 3hl2 s PHE 91 Ca 0.00 -0.60 0.11 0.00 0.12 0.00 0.00 56.93 56.56 3hl2 s PHE 91 Cb 0.00 -4.30 -0.15 0.00 -0.57 0.00 0.00 43.02 38.00 3hl2 s PHE 91 CO 0.00 -1.65 0.07 -0.89 -0.10 0.00 0.00 175.22 172.65 3hl2 n ILE 92 N 5.91 0.75 0.66 0.64 2.08 -1.26 -4.73 119.36 123.41 3hl2 n ILE 92 Ca -0.02 -0.49 0.10 0.00 0.56 0.00 0.00 62.75 62.90 3hl2 n ILE 92 Cb 0.46 -0.59 0.43 0.00 -0.75 0.00 0.00 39.64 39.18 3hl2 n ILE 92 CO 0.00 0.00 0.00 1.41 0.56 0.00 0.00 176.55 178.52 3hl2 n HIS 93 N -2.40 0.08 -3.89 1.39 8.25 -1.26 -4.89 115.22 112.51 3hl2 n HIS 93 Ca -0.18 0.03 0.00 0.00 -0.26 0.00 0.00 57.72 57.31 3hl2 n HIS 93 Cb 0.84 -0.55 -0.00 0.00 1.12 0.00 0.00 29.99 31.40 3hl2 n HIS 93 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3hl2 n GLY 94 N 0.54 -1.95 3.47 -1.41 0.00 -1.26 -4.89 105.19 99.69 3hl2 n GLY 94 Ca 0.05 -1.37 -0.30 0.00 0.00 0.00 0.00 46.02 44.40 3hl2 n GLY 94 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3hl2 s ILE 95 N -0.08 2.76 0.09 -0.61 -4.36 0.35 -4.72 121.20 114.62 3hl2 s ILE 95 Ca 0.00 -1.41 0.00 0.00 -0.26 0.00 0.00 60.65 58.98 3hl2 s ILE 95 Cb 0.00 -2.22 0.00 0.00 1.25 0.00 0.00 42.46 41.49 3hl2 s ILE 95 CO 0.00 0.19 0.00 0.61 0.24 0.00 0.00 174.94 175.98 3hl2 n GLY 96 N 1.09 -1.71 0.14 6.27 0.00 -1.26 -2.44 105.19 107.29 3hl2 n GLY 96 Ca -0.16 -1.44 -0.01 0.00 0.00 0.00 0.00 46.02 44.41 3hl2 n GLY 96 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hl2 n ARG 97 N -2.22 1.12 0.06 1.61 1.74 0.99 -4.78 116.66 115.18 3hl2 n ARG 97 Ca -0.00 -0.12 0.11 0.00 -0.77 0.00 0.00 57.85 57.07 3hl2 n ARG 97 Cb 0.14 -0.00 0.46 0.00 -1.02 0.00 0.00 32.46 32.04 3hl2 n ARG 97 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 3hl2 n SER 98 N -2.70 0.35 -0.15 0.55 3.41 -1.26 -3.00 113.62 110.82 3hl2 n SER 98 Ca 0.00 0.56 0.05 0.00 -0.26 0.00 0.00 58.87 59.22 3hl2 n SER 98 Cb 0.02 -0.64 -0.02 0.00 -0.26 0.00 0.00 64.21 63.31 3hl2 n SER 98 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3hl2 n GLY 99 N 0.68 -0.07 3.47 5.00 0.00 -1.26 -2.37 105.19 110.65 3hl2 n GLY 99 Ca 0.05 -0.29 0.01 0.00 0.00 0.00 0.00 46.02 45.78 3hl2 n GLY 99 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3hl2 s ASP 100 N -1.60 -1.17 0.00 1.61 -1.08 -1.16 -4.91 116.67 108.36 3hl2 s ASP 100 Ca 0.07 1.29 0.00 0.00 -0.52 0.00 0.00 52.55 53.38 3hl2 s ASP 100 Cb 0.08 2.20 0.00 0.00 -1.46 0.00 0.00 42.92 43.74 3hl2 s ASP 100 CO 0.32 -0.22 0.37 0.00 0.52 0.00 0.00 175.17 176.16 3hl2 n ILE 101 N 5.41 0.00 -1.42 4.11 0.13 -1.26 -0.01 119.36 126.33 3hl2 n ILE 101 Ca -0.08 0.00 0.00 0.00 -1.10 0.00 0.00 62.75 61.57 3hl2 n ILE 101 Cb 0.50 -0.26 0.00 0.00 -0.84 0.00 0.00 39.64 39.04 3hl2 n ILE 101 CO 0.00 0.00 0.00 -0.24 2.80 0.00 0.00 176.55 179.11 3hl2 n SER 102 N -0.04 0.00 -4.79 9.51 2.88 -1.26 -4.44 113.62 115.49 3hl2 n SER 102 Ca 0.00 -1.00 -0.37 0.00 -1.33 0.00 0.00 58.87 56.17 3hl2 n SER 102 Cb 0.09 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.49 3hl2 n SER 102 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3hl2 s ALA 103 N 0.00 3.30 0.21 -1.46 0.00 -0.98 -4.96 121.76 117.87 3hl2 s ALA 103 Ca 0.00 0.40 -0.30 0.00 0.00 0.00 0.00 51.96 52.06 3hl2 s ALA 103 Cb 0.00 -3.05 -0.08 0.00 0.00 0.00 0.00 23.12 19.99 3hl2 s ALA 103 CO 0.00 0.24 1.05 0.08 0.00 0.00 0.00 175.76 177.12 3hl2 s VAL 104 N -1.53 3.91 -0.18 0.00 1.01 -1.26 -3.84 120.40 118.50 3hl2 s VAL 104 Ca 0.46 1.75 -0.04 0.00 0.00 0.00 0.00 61.98 64.15 3hl2 s VAL 104 Cb -0.19 -4.12 -0.02 0.00 0.00 0.00 0.00 36.38 32.05 3hl2 s VAL 104 CO 0.23 0.35 -0.02 -1.58 0.00 0.00 0.00 175.10 174.09 3hl2 s GLN 105 N -0.75 3.63 0.51 2.72 2.00 -1.26 -4.87 119.66 121.64 3hl2 s GLN 105 Ca 0.46 -0.52 0.18 0.00 -2.00 0.00 0.00 55.36 53.47 3hl2 s GLN 105 Cb -0.28 -3.01 1.28 0.00 0.80 0.00 0.00 33.01 31.79 3hl2 s GLN 105 CO 0.35 0.10 2.12 -1.35 -0.50 0.00 0.00 175.29 176.01 3hl2 h PRO 106 N 7.20 0.00 -0.48 1.67 0.11 -1.99 -1.70 132.00 136.81 3hl2 h PRO 106 Ca -0.34 0.00 -0.09 0.00 0.11 0.00 0.00 66.00 65.68 3hl2 h PRO 106 Cb 1.18 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 32.28 3hl2 h PRO 106 CO 0.62 0.05 -0.05 0.87 -0.21 0.00 0.00 178.00 179.28 3hl2 h LYS 107 N 0.00 0.88 -2.17 1.05 1.57 -1.96 -3.37 116.57 112.57 3hl2 h LYS 107 Ca -0.00 -0.30 -0.59 0.00 -1.87 0.00 0.00 60.65 57.89 3hl2 h LYS 107 Cb 0.10 -0.07 -0.41 0.00 0.08 0.00 0.00 32.23 31.93 3hl2 h LYS 107 CO 0.01 0.94 -0.71 0.00 -0.57 0.00 0.00 179.45 179.12 3hl2 n ALA 108 N -2.45 3.86 -0.28 3.86 0.00 -0.67 -0.03 120.51 124.80 3hl2 n ALA 108 Ca 0.00 -4.49 -0.04 0.00 0.00 0.00 0.00 53.44 48.91 3hl2 n ALA 108 Cb 0.34 -0.85 0.07 0.00 0.00 0.00 0.00 19.45 19.02 3hl2 n ALA 108 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hl2 h ALA 109 N 3.84 0.98 0.22 0.00 0.00 -1.60 -0.49 119.26 122.22 3hl2 h ALA 109 Ca 0.16 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.01 3hl2 h ALA 109 Cb 0.68 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.17 3hl2 h ALA 109 CO 0.76 0.36 -0.11 0.78 0.00 0.00 0.00 179.25 181.05 3hl2 h GLY 110 N 1.01 -0.31 0.50 0.00 0.00 -1.74 -2.23 103.07 100.31 3hl2 h GLY 110 Ca 0.29 0.12 0.06 0.00 0.00 0.00 0.00 47.33 47.79 3hl2 h GLY 110 CO -0.08 -0.11 0.03 1.76 0.00 0.00 0.00 176.54 178.14 3hl2 h SER 111 N -0.44 -0.08 -0.96 0.19 0.02 -1.76 -1.09 113.55 109.43 3hl2 h SER 111 Ca -0.03 0.07 0.02 0.00 -0.84 0.00 0.00 61.79 61.01 3hl2 h SER 111 Cb 0.33 0.12 -0.05 0.00 0.14 0.00 0.00 62.40 62.94 3hl2 h SER 111 CO 0.05 -0.00 0.63 0.77 -1.14 0.00 0.00 176.83 177.14 3hl2 h SER 112 N 0.13 1.09 -0.34 3.07 4.64 -1.03 -0.64 113.55 120.46 3hl2 h SER 112 Ca 0.17 -0.02 -0.10 0.00 -0.47 0.00 0.00 61.79 61.37 3hl2 h SER 112 Cb 0.22 -0.27 -0.02 0.00 -0.31 0.00 0.00 62.40 62.02 3hl2 h SER 112 CO -0.26 0.78 -0.12 0.25 -0.87 0.00 0.00 176.83 176.61 3hl2 h LEU 113 N 1.28 0.77 -0.58 5.97 5.85 -0.79 -1.79 115.31 126.02 3hl2 h LEU 113 Ca 0.36 -0.23 0.00 0.00 0.84 0.00 0.00 57.88 58.85 3hl2 h LEU 113 Cb -0.11 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 40.68 3hl2 h LEU 113 CO -0.09 0.91 0.38 0.25 -0.34 0.00 0.00 178.44 179.56 3hl2 h LEU 114 N 0.71 0.67 -0.28 2.25 6.46 -0.22 -1.71 115.31 123.18 3hl2 h LEU 114 Ca 0.12 -0.02 0.05 0.00 -0.12 0.00 0.00 57.88 57.91 3hl2 h LEU 114 Cb 0.60 -0.17 -0.04 0.00 -0.73 0.00 0.00 40.66 40.32 3hl2 h LEU 114 CO 0.04 0.49 -0.00 -1.13 -0.62 0.00 0.00 178.44 177.22 3hl2 h ASN 115 N 0.78 -0.11 -0.62 1.25 -1.24 -0.71 -1.17 115.58 113.77 3hl2 h ASN 115 Ca 0.21 0.06 0.01 0.00 0.71 0.00 0.00 56.30 57.30 3hl2 h ASN 115 Cb -0.08 0.11 -0.03 0.00 0.73 0.00 0.00 38.32 39.05 3hl2 h ASN 115 CO -0.05 -0.02 0.40 0.11 -1.29 0.00 0.00 177.43 176.58 3hl2 h LYS 116 N 0.08 0.79 -0.08 6.67 1.57 -1.01 -2.12 116.57 122.48 3hl2 h LYS 116 Ca 0.13 -0.05 -0.05 0.00 -1.87 0.00 0.00 60.65 58.82 3hl2 h LYS 116 Cb 0.18 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.31 3hl2 h LYS 116 CO -0.23 0.52 -0.15 0.82 -0.57 0.00 0.00 179.45 179.85 3hl2 h ILE 117 N 0.81 1.40 -0.38 1.86 2.04 -1.16 -2.23 117.51 119.86 3hl2 h ILE 117 Ca 0.24 -1.43 0.08 0.00 1.00 0.00 0.00 64.86 64.75 3hl2 h ILE 117 Cb -0.05 2.15 -0.08 0.00 -0.74 0.00 0.00 36.82 38.09 3hl2 h ILE 117 CO -0.07 0.40 -0.21 0.74 0.00 0.00 0.00 178.15 179.01 3hl2 h THR 118 N -0.23 0.40 -0.78 -0.27 2.02 -1.15 0.34 112.91 113.25 3hl2 h THR 118 Ca 0.00 0.00 0.08 0.00 0.77 0.00 0.00 66.41 67.27 3hl2 h THR 118 Cb 0.72 0.40 -0.07 0.00 -1.74 0.00 0.00 68.15 67.46 3hl2 h THR 118 CO 0.03 0.00 0.44 0.78 0.37 0.00 0.00 175.52 177.14 3hl2 h ASN 119 N -0.15 0.64 -0.44 4.18 2.35 -1.38 0.13 115.58 120.91 3hl2 h ASN 119 Ca 0.19 0.04 -0.03 0.00 -0.55 0.00 0.00 56.30 55.95 3hl2 h ASN 119 Cb 0.44 -0.08 -0.02 0.00 0.05 0.00 0.00 38.32 38.71 3hl2 h ASN 119 CO -0.47 0.38 0.17 -1.28 -1.65 0.00 0.00 177.43 174.59 3hl2 h SER 120 N 0.77 0.61 -0.07 5.81 0.87 -0.49 0.16 113.55 121.20 3hl2 h SER 120 Ca 0.36 -0.17 -0.00 0.00 -1.23 0.00 0.00 61.79 60.75 3hl2 h SER 120 Cb 0.29 -0.16 -0.00 0.00 -0.44 0.00 0.00 62.40 62.09 3hl2 h SER 120 CO -0.22 0.61 0.04 -0.07 -0.53 0.00 0.00 176.83 176.66 3hl2 h LEU 121 N 0.56 0.08 -0.67 2.23 3.38 0.29 -1.48 115.31 119.70 3hl2 h LEU 121 Ca 0.15 -0.03 0.02 0.00 0.09 0.00 0.00 57.88 58.10 3hl2 h LEU 121 Cb 0.20 -0.02 -0.04 0.00 0.09 0.00 0.00 40.66 40.89 3hl2 h LEU 121 CO -0.01 0.09 0.43 0.58 0.09 0.00 0.00 178.44 179.62 3hl2 h VAL 122 N 0.07 1.13 -0.97 1.22 2.07 -0.55 -0.76 116.25 118.45 3hl2 h VAL 122 Ca 0.03 -0.30 0.10 0.00 0.82 0.00 0.00 66.70 67.35 3hl2 h VAL 122 Cb 0.02 0.19 -0.08 0.00 -1.52 0.00 0.00 31.29 29.90 3hl2 h VAL 122 CO -0.00 0.16 0.61 0.25 0.02 0.00 0.00 177.57 178.60 3hl2 h LEU 123 N 0.86 0.91 0.13 2.57 5.85 -0.45 -0.31 115.31 124.87 3hl2 h LEU 123 Ca 0.26 0.04 -0.01 0.00 0.84 0.00 0.00 57.88 59.01 3hl2 h LEU 123 Cb -0.04 -0.15 0.00 0.00 0.37 0.00 0.00 40.66 40.85 3hl2 h LEU 123 CO -0.08 0.52 -0.06 -0.78 -0.34 0.00 0.00 178.44 177.70 3hl2 h ASP 124 N 1.01 -0.14 -0.90 1.25 3.58 -0.09 -1.97 116.42 119.15 3hl2 h ASP 124 Ca 0.46 -0.03 -0.01 0.00 0.42 0.00 0.00 57.03 57.87 3hl2 h ASP 124 Cb 0.38 0.04 -0.04 0.00 1.72 0.00 0.00 39.33 41.43 3hl2 h ASP 124 CO -0.24 -0.07 0.50 0.40 -2.88 0.00 0.00 179.24 176.95 3hl2 h ILE 125 N -0.21 1.26 -0.49 2.25 5.03 -0.75 -1.61 117.51 123.00 3hl2 h ILE 125 Ca -0.02 -0.62 0.03 0.00 -0.12 0.00 0.00 64.86 64.14 3hl2 h ILE 125 Cb 0.16 0.03 -0.04 0.00 -3.03 0.00 0.00 36.82 33.94 3hl2 h ILE 125 CO 0.03 0.28 0.27 0.40 -0.68 0.00 0.00 178.15 178.45 3hl2 h ILE 126 N 1.25 1.00 0.34 -0.67 2.04 -0.85 0.87 117.51 121.49 3hl2 h ILE 126 Ca 0.32 -0.18 -0.01 0.00 1.00 0.00 0.00 64.86 65.99 3hl2 h ILE 126 Cb 0.01 0.42 -0.01 0.00 -0.74 0.00 0.00 36.82 36.50 3hl2 h ILE 126 CO -0.05 0.10 -0.23 0.11 0.00 0.00 0.00 178.15 178.07 3hl2 h LYS 127 N 0.53 -0.54 0.00 2.37 1.57 -0.96 -2.72 116.57 116.82 3hl2 h LYS 127 Ca 0.21 0.04 0.00 0.00 -1.87 0.00 0.00 60.65 59.02 3hl2 h LYS 127 Cb 0.07 0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.51 3hl2 h LYS 127 CO -0.12 -0.36 0.00 1.47 -0.57 0.00 0.00 179.45 179.87 3hl2 n LEU 128 N -5.36 0.00 0.00 2.94 -0.00 -0.64 -1.92 117.00 112.02 3hl2 n LEU 128 Ca -0.10 0.15 0.11 0.00 -0.00 0.00 0.00 56.01 56.17 3hl2 n LEU 128 Cb 0.27 -0.15 0.04 0.00 -0.00 0.00 0.00 43.42 43.57 3hl2 n LEU 128 CO 0.33 -0.05 0.14 0.00 -0.00 0.00 0.00 177.39 177.81 3hl2 n ALA 129 N -1.15 4.13 0.00 1.47 0.00 0.26 -4.96 120.51 120.26 3hl2 n ALA 129 Ca 0.13 -0.48 0.00 0.00 0.00 0.00 0.00 53.44 53.09 3hl2 n ALA 129 Cb 0.12 -0.93 0.00 0.00 0.00 0.00 0.00 19.45 18.65 3hl2 n ALA 129 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hl2 n GLY 130 N 1.48 2.04 3.34 0.00 0.00 -0.81 -4.34 105.19 106.90 3hl2 n GLY 130 Ca 0.04 -0.20 -0.46 0.00 0.00 0.00 0.00 46.02 45.41 3hl2 n GLY 130 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hl2 s VAL 131 N 0.00 5.81 -0.21 1.61 1.01 -1.08 -4.58 120.40 122.95 3hl2 s VAL 131 Ca 0.00 -2.99 0.28 0.00 0.00 0.00 0.00 61.98 59.27 3hl2 s VAL 131 Cb 0.00 -4.56 0.36 0.00 0.00 0.00 0.00 36.38 32.18 3hl2 s VAL 131 CO 0.00 -1.14 1.79 0.45 0.00 0.00 0.00 175.10 176.20 3hl2 h HIS 132 N 7.16 0.00 -0.60 5.22 -0.00 -1.82 -3.07 115.15 122.04 3hl2 h HIS 132 Ca 0.15 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.52 3hl2 h HIS 132 Cb 0.94 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.35 3hl2 h HIS 132 CO 0.89 0.00 0.00 0.25 -0.00 0.00 0.00 177.93 179.07 3hl2 n THR 133 N -3.02 1.86 -1.88 2.45 -2.24 -1.26 -4.94 114.28 105.25 3hl2 n THR 133 Ca 0.02 -1.13 -0.41 0.00 -2.27 0.00 0.00 64.05 60.26 3hl2 n THR 133 Cb 0.41 0.02 -0.02 0.00 -2.10 0.00 0.00 70.33 68.65 3hl2 n THR 133 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 3hl2 s VAL 134 N -1.97 2.30 -0.13 2.28 0.11 -1.16 -4.81 120.40 117.02 3hl2 s VAL 134 Ca 0.48 0.26 0.11 0.00 -2.93 0.00 0.00 61.98 59.91 3hl2 s VAL 134 Cb 0.32 -3.17 -0.24 0.00 -1.53 0.00 0.00 36.38 31.77 3hl2 s VAL 134 CO 0.22 0.04 0.34 0.00 -3.33 0.00 0.00 175.10 172.37 3hl2 n ALA 135 N 2.08 1.42 -3.63 1.54 0.00 0.37 -5.00 120.51 117.29 3hl2 n ALA 135 Ca 0.07 -0.98 -0.03 0.00 0.00 0.00 0.00 53.44 52.50 3hl2 n ALA 135 Cb 0.39 -0.53 -0.03 0.00 0.00 0.00 0.00 19.45 19.27 3hl2 n ALA 135 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 177.50 178.71 3hl2 s ASN 136 N -6.02 -0.08 0.30 0.00 2.47 -1.13 -4.88 114.94 105.61 3hl2 s ASN 136 Ca -0.11 0.06 -0.18 0.00 0.42 0.00 0.00 52.86 53.05 3hl2 s ASN 136 Cb 0.07 0.07 0.02 0.00 -1.45 0.00 0.00 41.25 39.97 3hl2 s ASN 136 CO 0.80 -0.09 0.69 0.00 -3.72 0.00 0.00 177.10 174.77 3hl2 s PHE 138 N -3.52 -0.47 -0.10 0.00 -0.71 -0.49 -4.94 117.98 107.74 3hl2 s PHE 138 Ca 0.15 0.78 -0.22 0.00 -1.04 0.00 0.00 56.93 56.59 3hl2 s PHE 138 Cb -0.05 0.29 -0.03 0.00 -1.21 0.00 0.00 43.02 42.02 3hl2 s PHE 138 CO 0.09 -0.53 0.66 0.08 -1.34 0.00 0.00 175.22 174.18 3hl2 s VAL 139 N -1.32 5.05 -0.11 -2.49 1.01 -1.26 -1.58 120.40 119.71 3hl2 s VAL 139 Ca -0.12 1.34 0.04 0.00 0.00 0.00 0.00 61.98 63.24 3hl2 s VAL 139 Cb -0.02 -4.00 0.00 0.00 0.00 0.00 0.00 36.38 32.36 3hl2 s VAL 139 CO 0.07 0.22 -0.23 0.54 0.00 0.00 0.00 175.10 175.71 3hl2 s VAL 140 N 1.06 2.13 0.00 2.92 0.11 -0.05 -4.99 120.40 121.58 3hl2 s VAL 140 Ca 0.34 -0.99 0.00 0.00 -2.93 0.00 0.00 61.98 58.40 3hl2 s VAL 140 Cb -0.17 -1.82 0.00 0.00 -1.53 0.00 0.00 36.38 32.86 3hl2 s VAL 140 CO 0.15 0.56 1.06 -2.65 -3.33 0.00 0.00 175.10 170.89 3hl2 n PRO 141 N 3.59 0.53 -4.50 1.54 -0.02 -1.26 -1.14 135.00 133.74 3hl2 n PRO 141 Ca -0.19 0.00 -0.26 0.00 -2.02 0.00 0.00 63.50 61.03 3hl2 n PRO 141 Cb 0.53 -1.23 -0.10 0.00 -0.02 0.00 0.00 33.50 32.67 3hl2 n PRO 141 CO 0.00 0.00 0.00 -1.64 1.98 0.00 0.00 175.50 175.84 3hl2 s MET 142 N 0.92 1.96 0.73 -0.52 -1.94 -1.26 -4.36 119.30 114.83 3hl2 s MET 142 Ca 0.00 -1.97 -0.12 0.00 -1.71 0.00 0.00 55.69 51.89 3hl2 s MET 142 Cb 0.00 -1.74 0.19 0.00 2.01 0.00 0.00 34.83 35.28 3hl2 s MET 142 CO 0.00 0.04 0.54 0.00 -0.01 0.00 0.00 175.02 175.59 3hl2 n ALA 143 N -0.93 -2.32 0.14 3.03 0.00 -1.26 0.55 120.51 119.71 3hl2 n ALA 143 Ca -0.04 -0.87 -0.25 0.00 0.00 0.00 0.00 53.44 52.28 3hl2 n ALA 143 Cb 0.65 -0.07 -0.16 0.00 0.00 0.00 0.00 19.45 19.87 3hl2 n ALA 143 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 3hl2 h THR 144 N -2.51 1.27 0.22 0.00 2.02 -1.91 -2.51 112.91 109.50 3hl2 h THR 144 Ca -0.22 -2.68 0.01 0.00 0.77 0.00 0.00 66.41 64.29 3hl2 h THR 144 Cb 0.70 3.04 -0.03 0.00 -1.74 0.00 0.00 68.15 70.13 3hl2 h THR 144 CO 0.14 0.81 -0.27 1.23 0.37 0.00 0.00 175.52 177.79 3hl2 h GLY 145 N 0.15 -0.58 1.44 2.16 0.00 -1.93 0.63 103.07 104.93 3hl2 h GLY 145 Ca -0.26 0.32 -0.02 0.00 0.00 0.00 0.00 47.33 47.37 3hl2 h GLY 145 CO 0.26 -0.24 0.24 -0.33 0.00 0.00 0.00 176.54 176.47 3hl2 h MET 146 N -0.54 0.73 -0.78 4.80 2.07 -1.90 -0.40 114.93 118.90 3hl2 h MET 146 Ca 0.00 -0.09 -0.02 0.00 -2.07 0.00 0.00 59.70 57.52 3hl2 h MET 146 Cb 0.52 -0.14 -0.04 0.00 -1.87 0.00 0.00 31.60 30.08 3hl2 h MET 146 CO -0.09 0.58 0.40 0.77 1.07 0.00 0.00 176.91 179.64 3hl2 h SER 147 N 0.73 1.00 -0.20 1.22 0.02 -1.08 0.81 113.55 116.04 3hl2 h SER 147 Ca 0.18 -0.12 0.01 0.00 -0.84 0.00 0.00 61.79 61.03 3hl2 h SER 147 Cb 0.10 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.36 3hl2 h SER 147 CO -0.02 0.83 0.10 -0.07 -1.14 0.00 0.00 176.83 176.53 3hl2 h LEU 148 N 1.09 0.14 -0.56 5.07 3.38 -0.11 -2.72 115.31 121.61 3hl2 h LEU 148 Ca 0.27 0.01 0.10 0.00 0.09 0.00 0.00 57.88 58.35 3hl2 h LEU 148 Cb 0.07 -0.02 -0.08 0.00 0.09 0.00 0.00 40.66 40.73 3hl2 h LEU 148 CO -0.04 0.11 0.12 0.74 0.09 0.00 0.00 178.44 179.47 3hl2 h THR 149 N 0.21 0.68 -0.89 0.22 2.02 -0.50 0.67 112.91 115.33 3hl2 h THR 149 Ca 0.08 -0.09 0.18 0.00 0.77 0.00 0.00 66.41 67.35 3hl2 h THR 149 Cb 0.02 0.40 -0.07 0.00 -1.74 0.00 0.00 68.15 66.76 3hl2 h THR 149 CO -0.06 0.05 0.58 0.25 0.37 0.00 0.00 175.52 176.71 3hl2 h LEU 150 N 0.26 0.52 -0.29 2.58 5.85 -0.61 0.14 115.31 123.76 3hl2 h LEU 150 Ca 0.29 0.04 -0.09 0.00 0.84 0.00 0.00 57.88 58.96 3hl2 h LEU 150 Cb 0.40 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.37 3hl2 h LEU 150 CO -0.36 0.23 -0.18 0.00 -0.34 0.00 0.00 178.44 177.79 3hl2 h PHE 152 N 0.38 1.13 -0.55 0.00 0.04 -0.39 -1.02 116.94 116.53 3hl2 h PHE 152 Ca 0.06 -0.13 0.01 0.00 2.80 0.00 0.00 57.97 60.71 3hl2 h PHE 152 Cb 0.71 -0.32 -0.03 0.00 2.20 0.00 0.00 35.95 38.52 3hl2 h PHE 152 CO 0.06 0.92 0.36 -0.07 -0.60 0.00 0.00 178.31 178.99 3hl2 h LEU 153 N 1.00 0.60 -0.19 1.54 3.38 -0.69 -1.93 115.31 119.03 3hl2 h LEU 153 Ca 0.21 -0.01 -0.17 0.00 0.09 0.00 0.00 57.88 58.00 3hl2 h LEU 153 Cb 0.36 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.97 3hl2 h LEU 153 CO 0.00 0.43 -0.55 0.74 0.09 0.00 0.00 178.44 179.15 3hl2 h THR 154 N 0.71 1.31 -0.64 0.22 2.02 -0.70 -3.27 112.91 112.56 3hl2 h THR 154 Ca 0.21 -1.78 -0.02 0.00 0.77 0.00 0.00 66.41 65.58 3hl2 h THR 154 Cb -0.04 1.91 -0.03 0.00 -1.74 0.00 0.00 68.15 68.26 3hl2 h THR 154 CO -0.05 0.56 0.31 -0.07 0.37 0.00 0.00 175.52 176.64 3hl2 h LEU 155 N 0.41 0.81 -0.70 2.58 3.38 -0.74 -2.98 115.31 118.07 3hl2 h LEU 155 Ca -0.02 -0.08 0.14 0.00 0.09 0.00 0.00 57.88 58.01 3hl2 h LEU 155 Cb 1.18 -0.21 -0.13 0.00 0.09 0.00 0.00 40.66 41.59 3hl2 h LEU 155 CO 0.12 0.68 -0.21 -0.09 0.09 0.00 0.00 178.44 179.03 3hl2 h ARG 156 N 0.90 -0.03 0.00 1.13 2.43 -1.42 0.21 114.38 117.61 3hl2 h ARG 156 Ca 0.22 0.00 -0.06 0.00 -0.81 0.00 0.00 59.98 59.34 3hl2 h ARG 156 Cb 0.09 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.64 3hl2 h ARG 156 CO -0.03 -0.02 -0.28 0.45 -1.51 0.00 0.00 179.97 178.58 3hl2 h HIS 157 N -0.03 0.00 0.00 2.20 3.86 -1.68 -1.95 115.15 117.55 3hl2 h HIS 157 Ca 0.33 0.00 -0.09 0.00 -1.16 0.00 0.00 60.37 59.45 3hl2 h HIS 157 Cb 0.53 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.99 3hl2 h HIS 157 CO -0.59 0.28 -0.41 0.87 0.86 0.00 0.00 177.93 178.93 3hl2 h LYS 158 N 0.00 0.00 -2.07 2.45 1.79 -0.72 -3.39 116.57 114.63 3hl2 h LYS 158 Ca -0.00 0.00 -0.56 0.00 -2.18 0.00 0.00 60.65 57.91 3hl2 h LYS 158 Cb 0.54 0.00 -0.38 0.00 -1.58 0.00 0.00 32.23 30.81 3hl2 h LYS 158 CO 0.04 0.41 -1.06 0.54 -1.08 0.00 0.00 179.45 178.30 3hl2 n ARG 159 N -3.31 0.56 0.09 3.15 1.74 0.03 -5.00 116.66 113.92 3hl2 n ARG 159 Ca 0.01 -3.18 0.10 0.00 -0.77 0.00 0.00 57.85 54.01 3hl2 n ARG 159 Cb 0.63 -1.35 0.57 0.00 -1.02 0.00 0.00 32.46 31.30 3hl2 n ARG 159 CO 0.00 0.00 0.00 -1.35 -1.52 0.00 0.00 177.63 174.76 3hl2 h PRO 160 N 4.47 0.20 -0.08 5.56 0.11 -1.65 -1.72 132.00 138.89 3hl2 h PRO 160 Ca 0.12 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.22 3hl2 h PRO 160 Cb 0.89 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.96 3hl2 h PRO 160 CO 0.43 0.13 0.00 1.63 -0.21 0.00 0.00 178.00 179.98 3hl2 n LYS 161 N -4.48 1.29 -3.16 1.05 4.01 -1.26 -4.89 118.16 110.72 3hl2 n LYS 161 Ca 0.03 -0.44 -0.39 0.00 -0.51 0.00 0.00 58.31 57.00 3hl2 n LYS 161 Cb 0.23 -1.28 -0.06 0.00 -0.51 0.00 0.00 35.03 33.41 3hl2 n LYS 161 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 3hl2 s ALA 162 N -1.90 3.51 0.00 7.82 0.00 -0.65 -4.52 121.76 126.02 3hl2 s ALA 162 Ca 0.25 0.14 0.00 0.00 0.00 0.00 0.00 51.96 52.36 3hl2 s ALA 162 Cb 0.13 -2.77 0.00 0.00 0.00 0.00 0.00 23.12 20.47 3hl2 s ALA 162 CO 0.20 0.30 0.00 1.63 0.00 0.00 0.00 175.76 177.89 3hl2 n LYS 163 N 1.96 2.51 -4.34 0.00 4.01 -0.66 -4.85 118.16 116.79 3hl2 n LYS 163 Ca -0.08 0.00 -0.30 0.00 -0.51 0.00 0.00 58.31 57.42 3hl2 n LYS 163 Cb 0.50 -0.88 -0.11 0.00 -0.51 0.00 0.00 35.03 34.04 3hl2 n LYS 163 CO 0.00 0.00 0.00 0.71 -1.11 0.00 0.00 177.40 177.00 3hl2 s TYR 164 N -1.67 2.66 -0.17 2.13 2.02 -0.78 -1.77 117.35 119.77 3hl2 s TYR 164 Ca 0.00 -0.20 0.00 0.00 -0.37 0.00 0.00 57.07 56.51 3hl2 s TYR 164 Cb 0.00 -1.43 0.01 0.00 -0.40 0.00 0.00 41.96 40.14 3hl2 s TYR 164 CO 0.00 0.38 -0.16 0.42 -1.57 0.00 0.00 175.55 174.62 3hl2 s ILE 165 N -1.13 2.46 0.01 2.71 1.01 -0.42 0.97 121.20 126.82 3hl2 s ILE 165 Ca 0.19 -0.82 -0.24 0.00 0.00 0.00 0.00 60.65 59.78 3hl2 s ILE 165 Cb -0.11 -2.05 -0.05 0.00 0.01 0.00 0.00 42.46 40.26 3hl2 s ILE 165 CO 0.11 0.51 0.74 -0.63 0.00 0.00 0.00 174.94 175.68 3hl2 s ILE 166 N 1.11 4.82 -0.29 2.92 1.01 -0.83 0.06 121.20 130.01 3hl2 s ILE 166 Ca 0.00 1.57 -0.00 0.00 0.00 0.00 0.00 60.65 62.22 3hl2 s ILE 166 Cb -0.14 -4.09 0.14 0.00 0.01 0.00 0.00 42.46 38.38 3hl2 s ILE 166 CO -0.06 0.34 0.32 0.86 0.00 0.00 0.00 174.94 176.40 3hl2 s TRP 167 N 0.16 -0.58 -0.17 3.97 -0.00 -0.76 0.20 118.94 121.76 3hl2 s TRP 167 Ca 0.38 -0.02 -0.36 0.00 -0.00 0.00 0.00 56.10 56.09 3hl2 s TRP 167 Cb -0.20 -0.38 -0.13 0.00 -0.00 0.00 0.00 33.47 32.76 3hl2 s TRP 167 CO 0.22 -0.92 1.85 -2.30 -0.00 0.00 0.00 176.95 175.80 3hl2 n PRO 168 N 5.32 1.75 -1.61 5.86 -0.02 -1.25 -1.55 135.00 143.51 3hl2 n PRO 168 Ca -0.02 0.64 -0.46 0.00 -2.02 0.00 0.00 63.50 61.64 3hl2 n PRO 168 Cb 0.47 -2.44 -0.02 0.00 -0.02 0.00 0.00 33.50 31.48 3hl2 n PRO 168 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 3hl2 n ARG 169 N 6.29 1.49 -3.69 -0.52 0.63 -0.25 -4.86 116.66 115.76 3hl2 n ARG 169 Ca 0.25 0.53 -0.10 0.00 -0.92 0.00 0.00 57.85 57.61 3hl2 n ARG 169 Cb 0.23 -2.01 -0.11 0.00 0.45 0.00 0.00 32.46 31.03 3hl2 n ARG 169 CO 0.00 0.00 0.00 -1.50 -2.51 0.00 0.00 177.63 173.62 3hl2 s ILE 170 N -0.59 -0.14 -1.26 5.15 2.07 -1.26 -4.88 121.20 120.28 3hl2 s ILE 170 Ca 0.65 0.11 -0.13 0.00 -1.41 0.00 0.00 60.65 59.86 3hl2 s ILE 170 Cb -0.73 -0.63 0.15 0.00 0.13 0.00 0.00 42.46 41.38 3hl2 s ILE 170 CO 0.56 0.04 1.66 0.47 -1.91 0.00 0.00 174.94 175.76 3hl2 n ASP 171 N 4.48 5.06 -3.61 4.50 9.92 -1.26 -4.85 116.55 130.79 3hl2 n ASP 171 Ca -0.20 -3.00 -0.20 0.00 -0.53 0.00 0.00 54.79 50.85 3hl2 n ASP 171 Cb 0.54 -1.57 -0.16 0.00 -0.64 0.00 0.00 41.12 39.29 3hl2 n ASP 171 CO 0.00 0.00 0.00 -1.58 0.13 0.00 0.00 177.20 175.75 3hl2 s GLN 172 N 1.64 0.06 0.30 -1.24 2.00 -1.26 -4.66 119.66 116.50 3hl2 s GLN 172 Ca 0.44 0.25 0.00 0.00 -2.00 0.00 0.00 55.36 54.05 3hl2 s GLN 172 Cb 0.03 -1.02 0.51 0.00 0.80 0.00 0.00 33.01 33.33 3hl2 s GLN 172 CO 0.01 -0.51 1.92 0.87 -0.50 0.00 0.00 175.29 177.08 3hl2 h LYS 173 N 8.38 1.02 0.21 1.67 1.57 -2.01 -3.07 116.57 124.34 3hl2 h LYS 173 Ca -0.14 -0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.56 3hl2 h LYS 173 Cb 1.14 -0.23 0.00 0.00 0.08 0.00 0.00 32.23 33.22 3hl2 h LYS 173 CO 0.22 0.68 -0.10 1.03 -0.57 0.00 0.00 179.45 180.71 3hl2 h SER 174 N 1.05 -0.24 0.14 0.86 0.87 -1.98 -1.01 113.55 113.25 3hl2 h SER 174 Ca 0.38 -0.03 -0.12 0.00 -1.23 0.00 0.00 61.79 60.79 3hl2 h SER 174 Cb 0.15 0.06 -0.01 0.00 -0.44 0.00 0.00 62.40 62.16 3hl2 h SER 174 CO -0.13 -0.13 -0.43 0.00 -0.53 0.00 0.00 176.83 175.61 3hl2 h PHE 176 N 0.30 -0.70 -0.83 0.00 3.57 -1.43 -2.89 116.94 114.96 3hl2 h PHE 176 Ca 0.02 -0.02 0.11 0.00 3.53 0.00 0.00 57.97 61.62 3hl2 h PHE 176 Cb 0.88 0.23 -0.06 0.00 2.79 0.00 0.00 35.95 39.79 3hl2 h PHE 176 CO 0.02 -0.40 0.54 0.87 -2.23 0.00 0.00 178.31 177.11 3hl2 h LYS 177 N -0.82 0.70 -1.06 1.11 1.57 -1.10 -2.19 116.57 114.78 3hl2 h LYS 177 Ca -0.08 -0.04 0.29 0.00 -1.87 0.00 0.00 60.65 58.95 3hl2 h LYS 177 Cb 0.61 -0.16 -0.11 0.00 0.08 0.00 0.00 32.23 32.65 3hl2 h LYS 177 CO 0.13 0.46 0.66 0.66 -0.57 0.00 0.00 179.45 180.79 3hl2 h SER 178 N 0.72 0.48 -0.30 0.86 4.64 -0.95 0.37 113.55 119.37 3hl2 h SER 178 Ca 0.39 0.11 -0.09 0.00 -0.47 0.00 0.00 61.79 61.74 3hl2 h SER 178 Cb 0.53 0.04 -0.01 0.00 -0.31 0.00 0.00 62.40 62.66 3hl2 h SER 178 CO -0.16 0.03 -0.15 0.24 -0.87 0.00 0.00 176.83 175.92 3hl2 h MET 179 N 0.39 0.63 -0.18 4.77 2.86 -1.46 -2.70 114.93 119.24 3hl2 h MET 179 Ca 0.65 -0.28 -0.12 0.00 -2.06 0.00 0.00 59.70 57.90 3hl2 h MET 179 Cb 1.59 -0.02 0.00 0.00 0.06 0.00 0.00 31.60 33.23 3hl2 h MET 179 CO -0.39 0.86 -0.34 0.82 1.06 0.00 0.00 176.91 178.92 3hl2 h ILE 180 N 0.38 1.34 -0.63 -1.22 2.04 -0.51 -2.25 117.51 116.65 3hl2 h ILE 180 Ca 0.07 -1.58 0.12 0.00 1.00 0.00 0.00 64.86 64.47 3hl2 h ILE 180 Cb 0.68 1.90 -0.04 0.00 -0.74 0.00 0.00 36.82 38.62 3hl2 h ILE 180 CO 0.05 0.48 0.43 0.74 0.00 0.00 0.00 178.15 179.85 3hl2 h THR 181 N 0.21 0.84 0.00 -0.27 2.02 -0.73 0.33 112.91 115.30 3hl2 h THR 181 Ca 0.01 -0.12 0.00 0.00 0.77 0.00 0.00 66.41 67.07 3hl2 h THR 181 Cb 0.94 0.47 0.00 0.00 -1.74 0.00 0.00 68.15 67.81 3hl2 h THR 181 CO 0.08 0.06 0.00 0.00 0.37 0.00 0.00 175.52 176.03 3hl2 n ALA 182 N -2.54 2.03 -2.10 6.16 0.00 -1.02 -4.88 120.51 118.15 3hl2 n ALA 182 Ca 0.11 -0.08 0.00 0.00 0.00 0.00 0.00 53.44 53.47 3hl2 n ALA 182 Cb 0.46 -1.35 0.00 0.00 0.00 0.00 0.00 19.45 18.56 3hl2 n ALA 182 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hl2 n GLY 183 N 0.65 0.80 3.31 0.00 0.00 0.12 -4.80 105.19 105.26 3hl2 n GLY 183 Ca 0.07 -0.69 -0.17 0.00 0.00 0.00 0.00 46.02 45.23 3hl2 n GLY 183 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3hl2 s PHE 184 N -2.58 1.55 -0.31 1.61 0.08 -0.87 -5.03 117.98 112.42 3hl2 s PHE 184 Ca 0.00 -0.63 -0.13 0.00 0.12 0.00 0.00 56.93 56.29 3hl2 s PHE 184 Cb 0.00 -0.74 -0.03 0.00 -0.57 0.00 0.00 43.02 41.68 3hl2 s PHE 184 CO 0.00 0.25 0.26 -2.00 -0.10 0.00 0.00 175.22 173.63 3hl2 s GLU 185 N -3.59 3.71 0.13 0.44 2.12 -0.73 -3.99 118.70 116.80 3hl2 s GLU 185 Ca 0.19 -0.43 -0.30 0.00 0.36 0.00 0.00 54.97 54.80 3hl2 s GLU 185 Cb -0.00 -3.74 -0.07 0.00 0.26 0.00 0.00 34.13 30.58 3hl2 s GLU 185 CO 0.05 -0.36 1.12 -2.14 -0.54 0.00 0.00 175.26 173.39 3hl2 s PRO 186 N 1.82 4.54 -0.54 4.30 0.02 -1.26 -1.30 135.00 142.58 3hl2 s PRO 186 Ca 0.08 1.72 -0.11 0.00 0.02 0.00 0.00 61.00 62.71 3hl2 s PRO 186 Cb -0.17 -3.31 0.14 0.00 0.02 0.00 0.00 34.50 31.18 3hl2 s PRO 186 CO 0.11 -0.03 0.45 0.08 -0.33 0.00 0.00 177.00 177.27 3hl2 s VAL 187 N 0.22 4.61 -0.34 3.83 1.01 0.11 -4.90 120.40 124.94 3hl2 s VAL 187 Ca 0.52 -1.88 -0.29 0.00 0.00 0.00 0.00 61.98 60.34 3hl2 s VAL 187 Cb -0.29 -3.98 -0.01 0.00 0.00 0.00 0.00 36.38 32.10 3hl2 s VAL 187 CO 0.33 -0.84 1.62 -0.69 0.00 0.00 0.00 175.10 175.52 3hl2 s VAL 188 N 1.17 3.68 -0.45 2.92 1.01 -1.26 -1.82 120.40 125.64 3hl2 s VAL 188 Ca 0.07 0.70 -0.19 0.00 0.00 0.00 0.00 61.98 62.56 3hl2 s VAL 188 Cb -0.25 -3.87 0.03 0.00 0.00 0.00 0.00 36.38 32.30 3hl2 s VAL 188 CO -0.01 -0.52 0.59 -0.63 0.00 0.00 0.00 175.10 174.53 3hl2 s ILE 189 N 6.06 4.90 0.97 2.22 -1.09 -0.59 -4.91 121.20 128.76 3hl2 s ILE 189 Ca 0.71 -0.18 -0.11 0.00 -2.23 0.00 0.00 60.65 58.84 3hl2 s ILE 189 Cb -0.19 -4.19 0.18 0.00 -1.58 0.00 0.00 42.46 36.67 3hl2 s ILE 189 CO 0.33 -0.62 1.10 -1.61 -1.23 0.00 0.00 174.94 172.91 3hl2 s GLU 190 N 2.60 0.59 0.29 2.79 0.41 -1.26 -1.09 118.70 123.03 3hl2 s GLU 190 Ca 0.18 1.25 0.04 0.00 -0.41 0.00 0.00 54.97 56.03 3hl2 s GLU 190 Cb -0.16 -1.70 -0.03 0.00 -1.78 0.00 0.00 34.13 30.46 3hl2 s GLU 190 CO 0.16 -2.83 0.43 -0.80 -0.49 0.00 0.00 175.26 171.73 3hl2 s ASN 191 N -2.76 6.25 -0.15 -0.19 0.01 -1.26 -4.27 114.94 112.56 3hl2 s ASN 191 Ca 0.66 0.14 -0.17 0.00 -0.71 0.00 0.00 52.86 52.78 3hl2 s ASN 191 Cb -0.22 -1.81 -0.04 0.00 0.41 0.00 0.00 41.25 39.58 3hl2 s ASN 191 CO 0.60 -0.20 0.45 -0.69 -1.51 0.00 0.00 177.10 175.75 3hl2 s VAL 192 N -2.11 5.19 -0.25 1.60 1.01 0.58 -4.81 120.40 121.59 3hl2 s VAL 192 Ca 0.37 0.86 -0.28 0.00 0.00 0.00 0.00 61.98 62.94 3hl2 s VAL 192 Cb -0.09 -3.78 0.01 0.00 0.00 0.00 0.00 36.38 32.51 3hl2 s VAL 192 CO 0.31 0.29 0.99 -0.22 0.00 0.00 0.00 175.10 176.47 3hl2 s LEU 193 N 0.92 4.06 -0.41 3.92 2.96 -1.26 -0.59 118.68 128.28 3hl2 s LEU 193 Ca 0.23 1.20 0.02 0.00 -0.22 0.00 0.00 54.13 55.37 3hl2 s LEU 193 Cb -0.15 -3.44 0.12 0.00 0.50 0.00 0.00 46.19 43.22 3hl2 s LEU 193 CO 0.09 -0.68 0.17 -1.61 -1.32 0.00 0.00 176.35 173.00 3hl2 s GLU 194 N 3.20 1.40 7.70 1.98 2.02 0.93 -4.98 118.70 130.95 3hl2 s GLU 194 Ca 0.42 -1.94 0.00 0.00 0.02 0.00 0.00 54.97 53.46 3hl2 s GLU 194 Cb -0.14 -2.74 0.00 0.00 0.10 0.00 0.00 34.13 31.35 3hl2 s GLU 194 CO 0.08 -1.06 0.00 0.41 0.02 0.00 0.00 175.26 174.72 3hl2 n GLY 195 N 3.87 2.95 0.01 -1.39 0.00 -1.26 -2.44 105.19 106.94 3hl2 n GLY 195 Ca 0.04 -0.16 0.11 0.00 0.00 0.00 0.00 46.02 46.02 3hl2 n GLY 195 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3hl2 n ASP 196 N 9.28 0.66 -4.87 1.61 8.00 -1.26 -4.98 116.55 124.99 3hl2 n ASP 196 Ca 0.00 -0.47 -0.32 0.00 0.71 0.00 0.00 54.79 54.71 3hl2 n ASP 196 Cb 0.00 0.99 -0.06 0.00 -0.02 0.00 0.00 41.12 42.04 3hl2 n ASP 196 CO 0.00 0.00 0.00 -1.61 -0.39 0.00 0.00 177.20 175.20 3hl2 s GLU 197 N -3.15 3.87 -0.18 -1.24 2.02 -1.02 -4.83 118.70 114.17 3hl2 s GLU 197 Ca 0.04 0.41 -0.05 0.00 0.02 0.00 0.00 54.97 55.39 3hl2 s GLU 197 Cb 0.15 -2.57 -0.03 0.00 0.10 0.00 0.00 34.13 31.79 3hl2 s GLU 197 CO 0.83 0.25 0.00 -0.51 0.02 0.00 0.00 175.26 175.86 3hl2 s LEU 198 N -2.91 3.40 0.30 1.80 1.43 -0.75 -0.05 118.68 121.90 3hl2 s LEU 198 Ca 0.50 -0.10 0.04 0.00 -1.03 0.00 0.00 54.13 53.54 3hl2 s LEU 198 Cb -0.11 -1.84 -0.03 0.00 0.03 0.00 0.00 46.19 44.23 3hl2 s LEU 198 CO 0.20 0.14 0.21 -0.13 0.23 0.00 0.00 176.35 176.99 3hl2 s ARG 199 N 0.57 1.59 0.01 1.70 0.52 0.24 -2.72 118.95 120.86 3hl2 s ARG 199 Ca -0.01 -1.91 -0.30 0.00 -0.52 0.00 0.00 55.73 53.00 3hl2 s ARG 199 Cb -0.14 0.16 -0.07 0.00 0.52 0.00 0.00 34.95 35.42 3hl2 s ARG 199 CO 0.02 -0.53 1.70 0.99 0.02 0.00 0.00 175.30 177.50 3hl2 s THR 200 N -3.65 3.27 -1.20 0.02 2.01 -1.26 -0.31 115.64 114.52 3hl2 s THR 200 Ca 0.38 0.51 -0.18 0.00 0.31 0.00 0.00 61.69 62.71 3hl2 s THR 200 Cb 0.04 -3.33 0.09 0.00 0.01 0.00 0.00 72.50 69.31 3hl2 s THR 200 CO 0.21 -0.03 1.58 -0.62 -0.69 0.00 0.00 174.62 175.07 3hl2 s ASP 201 N 3.12 6.79 0.31 3.53 -1.08 -1.26 -4.74 116.67 123.34 3hl2 s ASP 201 Ca 0.76 -2.31 0.02 0.00 -0.52 0.00 0.00 52.55 50.50 3hl2 s ASP 201 Cb -0.37 -2.53 0.57 0.00 -1.46 0.00 0.00 42.92 39.12 3hl2 s ASP 201 CO 0.33 -1.16 1.90 -0.07 0.52 0.00 0.00 175.17 176.69 3hl2 h LEU 202 N 11.94 0.87 -0.06 -1.34 3.38 -1.95 -1.63 115.31 126.52 3hl2 h LEU 202 Ca 0.35 0.01 0.04 0.00 0.09 0.00 0.00 57.88 58.37 3hl2 h LEU 202 Cb 0.91 -0.17 -0.05 0.00 0.09 0.00 0.00 40.66 41.44 3hl2 h LEU 202 CO 1.39 0.54 -0.23 0.11 0.09 0.00 0.00 178.44 180.35 3hl2 h LYS 203 N 0.98 -0.31 -0.84 1.13 1.57 -2.00 -2.42 116.57 114.68 3hl2 h LYS 203 Ca 0.40 0.02 -0.03 0.00 -1.87 0.00 0.00 60.65 59.17 3hl2 h LYS 203 Cb 0.28 0.07 -0.04 0.00 0.08 0.00 0.00 32.23 32.62 3hl2 h LYS 203 CO -0.16 -0.21 0.40 0.00 -0.57 0.00 0.00 179.45 178.91 3hl2 h ALA 204 N 0.60 1.11 0.35 3.86 0.00 -1.75 -1.74 119.26 121.68 3hl2 h ALA 204 Ca 0.08 -0.17 -0.01 0.00 0.00 0.00 0.00 54.91 54.82 3hl2 h ALA 204 Cb 0.43 -0.33 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 3hl2 h ALA 204 CO -0.25 0.66 -0.24 0.28 0.00 0.00 0.00 179.25 179.70 3hl2 h VAL 205 N 1.20 0.50 0.00 0.00 2.07 -1.09 -0.70 116.25 118.23 3hl2 h VAL 205 Ca 0.29 0.00 -0.05 0.00 0.82 0.00 0.00 66.70 67.76 3hl2 h VAL 205 Cb 0.13 0.50 -0.01 0.00 -1.52 0.00 0.00 31.29 30.39 3hl2 h VAL 205 CO -0.03 0.00 -0.23 -0.08 0.02 0.00 0.00 177.57 177.24 3hl2 h GLU 206 N -0.58 0.00 -0.12 1.57 4.81 -1.30 -1.29 114.58 117.66 3hl2 h GLU 206 Ca -0.03 0.00 -0.03 0.00 -0.13 0.00 0.00 59.36 59.17 3hl2 h GLU 206 Cb 0.49 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.87 3hl2 h GLU 206 CO 0.01 0.23 -0.03 0.00 -0.73 0.00 0.00 179.01 178.50 3hl2 h ALA 207 N 1.77 0.17 -0.34 2.92 0.00 -0.94 -2.33 119.26 120.50 3hl2 h ALA 207 Ca -0.00 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.69 3hl2 h ALA 207 Cb 0.47 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 3hl2 h ALA 207 CO 0.03 -0.10 0.22 0.87 0.00 0.00 0.00 179.25 180.28 3hl2 h LYS 208 N -0.08 0.46 -0.81 0.00 1.79 -0.64 0.56 116.57 117.85 3hl2 h LYS 208 Ca 0.03 -0.03 0.16 0.00 -2.18 0.00 0.00 60.65 58.62 3hl2 h LYS 208 Cb 0.44 -0.10 -0.10 0.00 -1.58 0.00 0.00 32.23 30.89 3hl2 h LYS 208 CO 0.01 0.32 0.36 0.28 -1.08 0.00 0.00 179.45 179.33 3hl2 h VAL 209 N 0.46 0.65 -0.12 0.50 2.07 -1.23 0.22 116.25 118.80 3hl2 h VAL 209 Ca 0.13 -0.17 -0.21 0.00 0.82 0.00 0.00 66.70 67.26 3hl2 h VAL 209 Cb -0.04 0.11 0.01 0.00 -1.52 0.00 0.00 31.29 29.86 3hl2 h VAL 209 CO -0.03 0.09 -0.76 1.56 0.02 0.00 0.00 177.57 178.46 3hl2 h GLN 210 N 0.49 0.72 -0.50 1.57 4.20 -0.92 0.12 115.11 120.80 3hl2 h GLN 210 Ca 0.45 -0.62 0.00 0.00 0.06 0.00 0.00 58.65 58.54 3hl2 h GLN 210 Cb 0.70 0.14 -0.02 0.00 0.30 0.00 0.00 27.48 28.60 3hl2 h GLN 210 CO -0.41 1.23 0.31 1.49 -0.67 0.00 0.00 178.83 180.78 3hl2 h GLU 211 N 0.42 0.67 0.00 1.46 4.81 0.13 -3.23 114.58 118.84 3hl2 h GLU 211 Ca -0.06 -0.05 -0.17 0.00 -0.13 0.00 0.00 59.36 58.94 3hl2 h GLU 211 Cb 1.40 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 30.60 3hl2 h GLU 211 CO 0.16 0.47 -1.65 1.28 -0.73 0.00 0.00 179.01 178.54 3hl2 n LEU 212 N -4.71 0.59 -0.08 1.64 4.77 0.66 -5.07 117.00 114.80 3hl2 n LEU 212 Ca 0.02 0.26 0.00 0.00 -0.03 0.00 0.00 56.01 56.26 3hl2 n LEU 212 Cb 0.04 0.13 0.00 0.00 -2.33 0.00 0.00 43.42 41.26 3hl2 n LEU 212 CO 0.35 0.17 0.00 0.61 -1.33 0.00 0.00 177.39 177.20 3hl2 n GLY 213 N 1.43 -1.29 0.30 -0.72 0.00 0.41 -4.53 105.19 100.79 3hl2 n GLY 213 Ca -0.12 -1.09 0.12 0.00 0.00 0.00 0.00 46.02 44.92 3hl2 n GLY 213 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 3hl2 h PRO 214 N 0.00 0.27 -0.09 1.61 0.11 -1.89 0.22 132.00 132.22 3hl2 h PRO 214 Ca 0.00 -0.02 0.03 0.00 0.11 0.00 0.00 66.00 66.12 3hl2 h PRO 214 Cb 0.00 -0.06 -0.00 0.00 0.11 0.00 0.00 31.00 31.05 3hl2 h PRO 214 CO 0.00 0.18 0.15 -0.44 -0.21 0.00 0.00 178.00 177.68 3hl2 h ASP 215 N 0.28 0.00 0.05 -2.05 5.19 -1.90 -1.14 116.42 116.85 3hl2 h ASP 215 Ca 0.54 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.95 3hl2 h ASP 215 Cb 1.05 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.56 3hl2 h ASP 215 CO -0.59 0.00 -0.30 0.00 -3.12 0.00 0.00 179.24 175.23 3hl2 s ILE 217 N -2.37 5.25 0.07 0.00 -1.09 -0.43 -1.66 121.20 120.97 3hl2 s ILE 217 Ca 0.23 0.56 -0.16 0.00 -2.23 0.00 0.00 60.65 59.05 3hl2 s ILE 217 Cb 0.19 -3.66 -0.16 0.00 -1.58 0.00 0.00 42.46 37.25 3hl2 s ILE 217 CO 0.49 0.29 1.28 0.25 -1.23 0.00 0.00 174.94 176.02 3hl2 h LEU 218 N 7.52 0.71 -7.05 2.97 5.85 0.32 -3.46 115.31 122.17 3hl2 h LEU 218 Ca -0.37 -0.61 0.38 0.00 0.84 0.00 0.00 57.88 58.13 3hl2 h LEU 218 Cb 1.16 -0.21 -0.14 0.00 0.37 0.00 0.00 40.66 41.85 3hl2 h LEU 218 CO 0.70 1.19 0.96 0.00 -0.34 0.00 0.00 178.44 180.96 3hl2 s ILE 220 N -2.10 5.20 -0.49 0.00 1.01 0.17 -1.97 121.20 123.01 3hl2 s ILE 220 Ca 0.15 0.12 -0.07 0.00 0.00 0.00 0.00 60.65 60.84 3hl2 s ILE 220 Cb 0.07 -3.38 0.13 0.00 0.01 0.00 0.00 42.46 39.29 3hl2 s ILE 220 CO -0.06 0.42 0.35 -2.28 0.00 0.00 0.00 174.94 173.36 3hl2 s HIS 221 N 0.57 3.48 0.27 3.97 5.65 0.13 -1.22 115.29 128.15 3hl2 s HIS 221 Ca 0.06 -2.10 0.06 0.00 0.25 0.00 0.00 55.06 53.33 3hl2 s HIS 221 Cb -0.12 -3.42 -0.03 0.00 -1.18 0.00 0.00 32.58 27.83 3hl2 s HIS 221 CO 0.00 -0.97 0.29 -1.54 -0.65 0.00 0.00 174.74 171.87 3hl2 s SER 222 N 2.22 5.77 -0.07 9.88 1.04 -0.63 -3.88 113.70 128.03 3hl2 s SER 222 Ca 0.08 -0.19 -0.01 0.00 0.48 0.00 0.00 55.95 56.32 3hl2 s SER 222 Cb -0.24 -1.45 0.03 0.00 0.10 0.00 0.00 66.02 64.46 3hl2 s SER 222 CO -0.02 -0.14 -0.02 -0.89 0.98 0.00 0.00 173.24 173.15 3hl2 s THR 223 N -2.12 0.48 0.00 2.02 2.01 -1.26 -0.13 115.64 116.63 3hl2 s THR 223 Ca 0.36 0.02 0.00 0.00 0.31 0.00 0.00 61.69 62.37 3hl2 s THR 223 Cb -0.08 -0.58 0.00 0.00 0.01 0.00 0.00 72.50 71.85 3hl2 s THR 223 CO 0.27 0.26 0.00 0.35 -0.69 0.00 0.00 174.62 174.81 3hl2 n THR 224 N 4.80 0.00 -1.86 -0.82 -2.24 -0.74 -1.22 114.28 112.20 3hl2 n THR 224 Ca -0.13 0.23 -0.42 0.00 -2.27 0.00 0.00 64.05 61.46 3hl2 n THR 224 Cb 0.50 -0.86 -0.03 0.00 -2.10 0.00 0.00 70.33 67.85 3hl2 n THR 224 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 3hl2 s SER 225 N -2.07 6.54 0.25 3.42 1.04 -1.26 -3.31 113.70 118.31 3hl2 s SER 225 Ca 0.00 2.59 -0.21 0.00 0.48 0.00 0.00 55.95 58.81 3hl2 s SER 225 Cb 0.00 -2.57 0.06 0.00 0.10 0.00 0.00 66.02 63.61 3hl2 s SER 225 CO 0.00 -0.92 0.89 0.00 0.98 0.00 0.00 173.24 174.20 3hl2 s PHE 227 N -2.84 3.55 0.49 0.00 0.08 -1.26 -4.53 117.98 113.47 3hl2 s PHE 227 Ca 0.15 1.29 -0.23 0.00 0.12 0.00 0.00 56.93 58.27 3hl2 s PHE 227 Cb -0.03 -2.88 -0.08 0.00 -0.57 0.00 0.00 43.02 39.46 3hl2 s PHE 227 CO 0.06 0.01 1.24 0.00 -0.10 0.00 0.00 175.22 176.43 3hl2 n ALA 228 N 4.07 1.16 1.89 5.36 0.00 -1.26 -0.93 120.51 130.80 3hl2 n ALA 228 Ca 0.01 0.18 0.15 0.00 0.00 0.00 0.00 53.44 53.77 3hl2 n ALA 228 Cb 0.51 -2.26 0.81 0.00 0.00 0.00 0.00 19.45 18.51 3hl2 n ALA 228 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 3hl2 n PRO 229 N -0.44 1.14 -2.18 0.00 -0.02 -1.26 -4.78 135.00 127.46 3hl2 n PRO 229 Ca 0.09 -0.20 -0.34 0.00 -2.02 0.00 0.00 63.50 61.03 3hl2 n PRO 229 Cb 0.42 -1.47 0.01 0.00 -0.02 0.00 0.00 33.50 32.44 3hl2 n PRO 229 CO 0.00 0.00 0.00 0.50 1.98 0.00 0.00 175.50 177.98 3hl2 s ARG 230 N -1.99 3.32 0.21 -0.52 3.52 -0.10 -1.80 118.95 121.58 3hl2 s ARG 230 Ca 0.43 1.46 0.07 0.00 -0.13 0.00 0.00 55.73 57.56 3hl2 s ARG 230 Cb 0.21 -2.02 -0.05 0.00 -1.56 0.00 0.00 34.95 31.53 3hl2 s ARG 230 CO 0.34 -0.84 -0.11 0.14 -0.81 0.00 0.00 175.30 174.02 3hl2 s VAL 231 N -2.03 1.56 0.13 7.11 -7.23 -1.10 -4.55 120.40 114.28 3hl2 s VAL 231 Ca 0.69 -2.16 -0.35 0.00 -1.81 0.00 0.00 61.98 58.36 3hl2 s VAL 231 Cb -0.21 -2.11 -0.17 0.00 0.56 0.00 0.00 36.38 34.46 3hl2 s VAL 231 CO 0.30 -0.54 1.15 -2.65 -0.31 0.00 0.00 175.10 173.04 3hl2 n PRO 232 N -0.39 0.90 -1.68 4.82 -0.02 -1.21 -4.88 135.00 132.54 3hl2 n PRO 232 Ca -0.08 0.32 -0.37 0.00 -2.02 0.00 0.00 63.50 61.36 3hl2 n PRO 232 Cb 0.61 -1.82 0.07 0.00 -0.02 0.00 0.00 33.50 32.34 3hl2 n PRO 232 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 3hl2 n ASP 233 N 2.06 1.78 -4.57 2.55 8.00 -0.36 -4.83 116.55 121.17 3hl2 n ASP 233 Ca 0.17 0.81 -0.23 0.00 0.71 0.00 0.00 54.79 56.25 3hl2 n ASP 233 Cb 0.21 -1.52 -0.07 0.00 -0.02 0.00 0.00 41.12 39.71 3hl2 n ASP 233 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 3hl2 s ARG 234 N -3.30 2.13 0.01 -1.24 0.52 -1.26 -4.80 118.95 111.01 3hl2 s ARG 234 Ca 0.81 -0.58 -0.25 0.00 -0.52 0.00 0.00 55.73 55.19 3hl2 s ARG 234 Cb -0.38 -5.09 -0.15 0.00 0.52 0.00 0.00 34.95 29.85 3hl2 s ARG 234 CO 0.42 -4.20 1.14 -0.07 0.02 0.00 0.00 175.30 172.61 3hl2 h LEU 235 N 19.33 -0.54 -0.87 2.53 4.07 -1.90 -2.10 115.31 135.83 3hl2 h LEU 235 Ca 0.12 -0.08 0.14 0.00 0.08 0.00 0.00 57.88 58.14 3hl2 h LEU 235 Cb 0.98 0.14 -0.09 0.00 1.08 0.00 0.00 40.66 42.76 3hl2 h LEU 235 CO 1.15 -0.16 0.47 1.05 -1.08 0.00 0.00 178.44 179.87 3hl2 h GLU 236 N -0.98 0.67 0.12 1.13 4.11 -1.87 1.00 114.58 118.75 3hl2 h GLU 236 Ca -0.06 -0.04 -0.01 0.00 0.07 0.00 0.00 59.36 59.32 3hl2 h GLU 236 Cb 0.59 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.69 3hl2 h GLU 236 CO 0.11 0.44 -0.06 0.93 0.07 0.00 0.00 179.01 180.50 3hl2 h GLU 237 N 0.69 -0.15 -0.60 1.06 3.07 -1.96 -2.22 114.58 114.47 3hl2 h GLU 237 Ca 0.47 0.01 0.03 0.00 -0.50 0.00 0.00 59.36 59.37 3hl2 h GLU 237 Cb 0.62 0.03 -0.04 0.00 -0.84 0.00 0.00 28.75 28.52 3hl2 h GLU 237 CO -0.34 -0.02 0.35 -0.07 -1.40 0.00 0.00 179.01 177.53 3hl2 h LEU 238 N -0.25 0.56 -1.88 1.33 3.38 -0.36 -1.63 115.31 116.47 3hl2 h LEU 238 Ca -0.02 0.01 0.10 0.00 0.09 0.00 0.00 57.88 58.06 3hl2 h LEU 238 Cb 0.20 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 3hl2 h LEU 238 CO 0.03 0.38 0.30 0.00 0.09 0.00 0.00 178.44 179.24 3hl2 h ALA 239 N 1.28 2.22 -0.00 1.53 0.00 0.11 -0.54 119.26 123.86 3hl2 h ALA 239 Ca 0.25 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 55.06 3hl2 h ALA 239 Cb 0.07 -0.01 0.01 0.00 0.00 0.00 0.00 17.79 17.85 3hl2 h ALA 239 CO -0.12 -0.33 -0.36 0.28 0.00 0.00 0.00 179.25 178.72 3hl2 h VAL 240 N 0.14 1.51 -0.76 0.00 2.07 -0.69 -0.68 116.25 117.84 3hl2 h VAL 240 Ca 0.20 -2.00 0.15 0.00 0.82 0.00 0.00 66.70 65.87 3hl2 h VAL 240 Cb 0.61 2.73 -0.10 0.00 -1.52 0.00 0.00 31.29 33.01 3hl2 h VAL 240 CO -0.03 0.56 0.28 0.40 0.02 0.00 0.00 177.57 178.80 3hl2 h ILE 241 N -0.39 0.62 -0.33 4.57 2.04 -0.68 -0.47 117.51 122.87 3hl2 h ILE 241 Ca -0.04 -0.14 -0.06 0.00 1.00 0.00 0.00 64.86 65.61 3hl2 h ILE 241 Cb 1.10 0.18 -0.01 0.00 -0.74 0.00 0.00 36.82 37.35 3hl2 h ILE 241 CO 0.07 0.07 -0.04 0.00 0.00 0.00 0.00 178.15 178.25 3hl2 h ALA 243 N 0.83 1.53 -0.09 0.00 0.00 -0.71 -0.58 119.26 120.22 3hl2 h ALA 243 Ca 0.09 -0.21 -0.15 0.00 0.00 0.00 0.00 54.91 54.64 3hl2 h ALA 243 Cb 0.52 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.25 3hl2 h ALA 243 CO 0.03 0.34 -0.52 -0.91 0.00 0.00 0.00 179.25 178.18 3hl2 h ASN 244 N 0.17 0.62 -0.43 0.00 2.35 -0.73 -3.28 115.58 114.29 3hl2 h ASN 244 Ca 0.03 -0.65 0.00 0.00 -0.55 0.00 0.00 56.30 55.13 3hl2 h ASN 244 Cb 0.39 -0.18 0.00 0.00 0.05 0.00 0.00 38.32 38.58 3hl2 h ASN 244 CO 0.02 1.17 0.00 -1.22 -1.65 0.00 0.00 177.43 175.76 3hl2 n TYR 245 N -4.22 0.56 -3.61 1.19 4.01 -0.66 -4.95 117.16 109.49 3hl2 n TYR 245 Ca -0.08 -0.28 -0.22 0.00 -0.16 0.00 0.00 57.90 57.15 3hl2 n TYR 245 Cb 0.61 0.00 0.04 0.00 -0.31 0.00 0.00 39.34 39.69 3hl2 n TYR 245 CO 0.00 0.00 0.00 -3.47 -0.46 0.00 0.00 176.86 172.93 3hl2 n ASP 246 N 0.98 -3.08 -4.18 7.72 2.03 -0.75 -4.87 116.55 114.39 3hl2 n ASP 246 Ca 0.18 -0.84 -0.31 0.00 0.52 0.00 0.00 54.79 54.34 3hl2 n ASP 246 Cb 0.45 -4.15 -0.17 0.00 -0.72 0.00 0.00 41.12 36.54 3hl2 n ASP 246 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 3hl2 s ILE 247 N -3.56 1.88 0.37 5.18 1.01 -0.30 -4.98 121.20 120.79 3hl2 s ILE 247 Ca 0.19 -0.91 -0.28 0.00 0.00 0.00 0.00 60.65 59.65 3hl2 s ILE 247 Cb -0.05 -1.64 -0.11 0.00 0.01 0.00 0.00 42.46 40.67 3hl2 s ILE 247 CO 0.81 0.52 1.49 -2.84 0.00 0.00 0.00 174.94 174.91 3hl2 s PRO 248 N 0.45 4.12 -0.23 2.79 0.02 -1.26 -4.53 135.00 136.36 3hl2 s PRO 248 Ca -0.17 2.56 -0.00 0.00 0.02 0.00 0.00 61.00 63.40 3hl2 s PRO 248 Cb -0.17 -2.98 0.03 0.00 0.02 0.00 0.00 34.50 31.40 3hl2 s PRO 248 CO 0.07 -0.53 -0.10 -1.58 -0.33 0.00 0.00 177.00 174.53 3hl2 s HIS 249 N -1.03 3.02 -0.15 6.54 2.46 -1.26 -0.66 115.29 124.21 3hl2 s HIS 249 Ca 0.53 -1.68 -0.01 0.00 0.47 0.00 0.00 55.06 54.38 3hl2 s HIS 249 Cb -0.46 -2.00 -0.01 0.00 -0.13 0.00 0.00 32.58 29.97 3hl2 s HIS 249 CO 0.61 -0.77 -0.12 0.42 -2.47 0.00 0.00 174.74 172.41 3hl2 s ILE 250 N 1.28 2.97 -0.26 0.89 1.09 -0.35 -0.72 121.20 126.09 3hl2 s ILE 250 Ca 0.00 -0.67 -0.07 0.00 -1.10 0.00 0.00 60.65 58.81 3hl2 s ILE 250 Cb -0.16 -2.27 -0.02 0.00 -1.06 0.00 0.00 42.46 38.95 3hl2 s ILE 250 CO -0.07 0.50 0.07 -0.69 -0.10 0.00 0.00 174.94 174.66 3hl2 s VAL 251 N 0.71 4.23 -0.56 2.92 1.01 -0.51 -1.61 120.40 126.60 3hl2 s VAL 251 Ca -0.06 -0.31 -0.28 0.00 0.00 0.00 0.00 61.98 61.34 3hl2 s VAL 251 Cb -0.15 -3.03 0.01 0.00 0.00 0.00 0.00 36.38 33.21 3hl2 s VAL 251 CO 0.02 0.27 1.47 0.21 0.00 0.00 0.00 175.10 177.06 3hl2 s ASN 252 N 1.59 6.04 -0.42 3.32 2.47 0.82 -0.90 114.94 127.86 3hl2 s ASN 252 Ca 0.05 0.33 0.04 0.00 0.42 0.00 0.00 52.86 53.70 3hl2 s ASN 252 Cb -0.16 -2.54 0.46 0.00 -1.45 0.00 0.00 41.25 37.56 3hl2 s ASN 252 CO 0.03 -1.77 1.48 -3.20 -3.72 0.00 0.00 177.10 169.92 3hl2 n ASN 253 N 9.88 5.79 -0.33 -4.21 5.15 0.78 -1.79 115.26 130.53 3hl2 n ASN 253 Ca 0.13 -3.76 -0.09 0.00 -0.60 0.00 0.00 54.58 50.26 3hl2 n ASN 253 Cb 0.49 -0.56 -0.08 0.00 -0.53 0.00 0.00 39.78 39.10 3hl2 n ASN 253 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3hl2 n ALA 254 N -0.79 -0.51 -1.80 5.20 0.00 -1.18 -1.23 120.51 120.20 3hl2 n ALA 254 Ca 0.50 0.67 0.02 0.00 0.00 0.00 0.00 53.44 54.64 3hl2 n ALA 254 Cb 0.87 -0.11 0.16 0.00 0.00 0.00 0.00 19.45 20.36 3hl2 n ALA 254 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 3hl2 n TYR 255 N -4.99 0.35 0.65 0.00 4.11 -1.26 -1.31 117.16 114.71 3hl2 n TYR 255 Ca 0.02 -1.46 0.13 0.00 -0.00 0.00 0.00 57.90 56.58 3hl2 n TYR 255 Cb 0.21 -0.25 0.41 0.00 -0.00 0.00 0.00 39.34 39.71 3hl2 n TYR 255 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.86 177.27 3hl2 n GLY 256 N -0.84 -1.68 0.33 -7.48 0.00 -0.37 -3.89 105.19 91.27 3hl2 n GLY 256 Ca 0.20 -0.04 0.03 0.00 0.00 0.00 0.00 46.02 46.21 3hl2 n GLY 256 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3hl2 h VAL 257 N 0.00 1.13 0.00 1.61 2.07 -1.87 -0.58 116.25 118.61 3hl2 h VAL 257 Ca 0.00 -0.26 0.00 0.00 0.82 0.00 0.00 66.70 67.26 3hl2 h VAL 257 Cb 0.72 0.29 0.00 0.00 -1.52 0.00 0.00 31.29 30.78 3hl2 h VAL 257 CO 0.00 0.14 0.00 0.00 0.02 0.00 0.00 177.57 177.73 3hl2 n GLN 258 N -4.45 0.82 -3.85 1.57 10.64 -1.25 -4.59 117.38 116.27 3hl2 n GLN 258 Ca 0.06 0.00 -0.30 0.00 -1.83 0.00 0.00 57.00 54.93 3hl2 n GLN 258 Cb 0.07 -1.21 -0.15 0.00 -0.86 0.00 0.00 30.24 28.09 3hl2 n GLN 258 CO 0.00 0.00 0.00 0.45 -1.83 0.00 0.00 177.06 175.68 3hl2 s SER 259 N -1.52 4.18 0.46 2.61 0.15 -0.22 -4.94 113.70 114.42 3hl2 s SER 259 Ca 0.16 -1.69 0.22 0.00 0.70 0.00 0.00 55.95 55.34 3hl2 s SER 259 Cb 0.08 -1.13 1.21 0.00 -1.71 0.00 0.00 66.02 64.47 3hl2 s SER 259 CO 0.13 -0.37 1.88 0.77 1.20 0.00 0.00 173.24 176.84 3hl2 h SER 260 N 7.93 0.27 0.44 5.45 4.64 -1.81 0.41 113.55 130.87 3hl2 h SER 260 Ca -0.12 0.03 -0.02 0.00 -0.47 0.00 0.00 61.79 61.21 3hl2 h SER 260 Cb 1.03 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 63.10 3hl2 h SER 260 CO 0.47 0.11 -0.21 0.50 -0.87 0.00 0.00 176.83 176.83 3hl2 h LYS 261 N 0.27 -0.57 -0.39 4.77 1.63 -1.91 0.23 116.57 120.60 3hl2 h LYS 261 Ca 0.44 0.04 0.03 0.00 -0.85 0.00 0.00 60.65 60.31 3hl2 h LYS 261 Cb 1.29 0.13 -0.03 0.00 -0.60 0.00 0.00 32.23 33.02 3hl2 h LYS 261 CO -0.12 -0.32 0.19 0.00 -3.45 0.00 0.00 179.45 175.75 3hl2 h MET 263 N 0.38 0.19 -0.29 0.00 2.86 -0.95 -2.38 114.93 114.75 3hl2 h MET 263 Ca 0.17 -0.04 -0.05 0.00 -2.06 0.00 0.00 59.70 57.72 3hl2 h MET 263 Cb 0.08 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.70 3hl2 h MET 263 CO -0.12 0.32 -0.00 1.25 1.06 0.00 0.00 176.91 179.42 3hl2 h HIS 264 N 0.18 0.55 -0.61 -0.22 6.17 -0.08 -0.56 115.15 120.58 3hl2 h HIS 264 Ca 0.04 -0.10 0.09 0.00 0.71 0.00 0.00 60.37 61.12 3hl2 h HIS 264 Cb 0.34 -0.14 -0.07 0.00 2.52 0.00 0.00 27.41 30.06 3hl2 h HIS 264 CO 0.00 0.65 0.22 -0.07 0.71 0.00 0.00 177.93 179.45 3hl2 h LEU 265 N 0.29 0.22 -0.17 0.26 4.07 -0.82 0.18 115.31 119.34 3hl2 h LEU 265 Ca 0.08 0.08 -0.01 0.00 0.08 0.00 0.00 57.88 58.11 3hl2 h LEU 265 Cb 0.43 0.06 -0.01 0.00 1.08 0.00 0.00 40.66 42.22 3hl2 h LEU 265 CO 0.01 0.13 0.08 0.40 -1.08 0.00 0.00 178.44 177.98 3hl2 h ILE 266 N 0.40 1.13 -0.33 1.22 2.04 -1.26 0.68 117.51 121.38 3hl2 h ILE 266 Ca 0.31 -0.37 0.07 0.00 1.00 0.00 0.00 64.86 65.87 3hl2 h ILE 266 Cb 0.38 1.07 -0.08 0.00 -0.74 0.00 0.00 36.82 37.45 3hl2 h ILE 266 CO -0.31 0.12 -0.27 -0.61 0.00 0.00 0.00 178.15 177.08 3hl2 h GLN 267 N 0.14 -0.23 -0.13 2.37 5.75 -0.28 -2.57 115.11 120.16 3hl2 h GLN 267 Ca 0.06 0.02 -0.01 0.00 -0.15 0.00 0.00 58.65 58.56 3hl2 h GLN 267 Cb 0.12 0.05 -0.01 0.00 1.07 0.00 0.00 27.48 28.72 3hl2 h GLN 267 CO -0.01 -0.15 0.03 1.96 -2.65 0.00 0.00 178.83 178.01 3hl2 h GLN 268 N -0.24 0.20 -0.99 1.69 1.08 -0.38 -2.65 115.11 113.82 3hl2 h GLN 268 Ca 0.16 -0.05 0.22 0.00 -1.45 0.00 0.00 58.65 57.54 3hl2 h GLN 268 Cb 0.50 -0.03 -0.12 0.00 -0.05 0.00 0.00 27.48 27.78 3hl2 h GLN 268 CO -0.47 0.37 0.58 0.78 -0.95 0.00 0.00 178.83 179.14 3hl2 h GLY 269 N 0.00 1.84 1.85 3.46 0.00 -0.70 0.21 103.07 109.73 3hl2 h GLY 269 Ca 0.04 -0.32 -0.15 0.00 0.00 0.00 0.00 47.33 46.91 3hl2 h GLY 269 CO 0.00 -0.19 -0.64 0.00 0.00 0.00 0.00 176.54 175.71 3hl2 h ALA 270 N 1.70 0.85 -0.36 3.60 0.00 -1.29 0.20 119.26 123.97 3hl2 h ALA 270 Ca 0.62 -0.57 -0.03 0.00 0.00 0.00 0.00 54.91 54.92 3hl2 h ALA 270 Cb 1.10 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 3hl2 h ALA 270 CO -0.45 0.77 0.10 -0.09 0.00 0.00 0.00 179.25 179.58 3hl2 h ARG 271 N 0.11 0.56 0.00 0.00 2.43 -0.29 -3.37 114.38 113.82 3hl2 h ARG 271 Ca -0.01 -0.13 -0.38 0.00 -0.81 0.00 0.00 59.98 58.65 3hl2 h ARG 271 Cb 1.15 -0.08 -0.07 0.00 -0.42 0.00 0.00 29.97 30.55 3hl2 h ARG 271 CO 0.09 0.59 -2.46 1.33 -1.51 0.00 0.00 179.97 178.02 3hl2 n VAL 272 N -4.63 1.47 -0.26 0.20 0.24 -0.40 -5.02 118.33 109.93 3hl2 n VAL 272 Ca -0.01 -0.56 0.00 0.00 -2.04 0.00 0.00 64.34 61.73 3hl2 n VAL 272 Cb 0.18 -1.41 0.00 0.00 -1.47 0.00 0.00 33.84 31.14 3hl2 n VAL 272 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3hl2 n GLY 273 N 2.27 4.80 3.09 7.63 0.00 0.70 -4.80 105.19 118.88 3hl2 n GLY 273 Ca -0.45 -1.65 -0.22 0.00 0.00 0.00 0.00 46.02 43.70 3hl2 n GLY 273 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3hl2 s ARG 274 N 4.62 1.18 -0.22 1.61 1.70 -0.38 -4.51 118.95 122.95 3hl2 s ARG 274 Ca 0.00 -0.47 0.00 0.00 -0.47 0.00 0.00 55.73 54.79 3hl2 s ARG 274 Cb 0.00 -1.11 0.06 0.00 -0.57 0.00 0.00 34.95 33.33 3hl2 s ARG 274 CO 0.00 0.26 -0.04 0.42 -1.08 0.00 0.00 175.30 174.85 3hl2 s ILE 275 N -0.18 1.38 -0.01 4.99 1.01 -1.26 -4.59 121.20 122.53 3hl2 s ILE 275 Ca 0.03 -1.08 -0.25 0.00 0.00 0.00 0.00 60.65 59.34 3hl2 s ILE 275 Cb -0.07 -1.66 -0.19 0.00 0.01 0.00 0.00 42.46 40.56 3hl2 s ILE 275 CO -0.00 -0.08 1.25 0.44 0.00 0.00 0.00 174.94 176.55 3hl2 h ASP 276 N 8.00 -0.10 -4.96 3.58 3.32 -1.30 -3.39 116.42 121.57 3hl2 h ASP 276 Ca -0.19 -0.36 -0.11 0.00 0.02 0.00 0.00 57.03 56.39 3hl2 h ASP 276 Cb 1.08 0.03 -0.20 0.00 0.22 0.00 0.00 39.33 40.46 3hl2 h ASP 276 CO 0.41 0.33 -0.21 0.00 -1.72 0.00 0.00 179.24 178.05 3hl2 s ALA 277 N -4.46 -0.93 0.03 3.45 0.00 -1.17 -4.12 121.76 114.56 3hl2 s ALA 277 Ca -0.15 0.49 0.06 0.00 0.00 0.00 0.00 51.96 52.37 3hl2 s ALA 277 Cb 0.02 0.05 -0.02 0.00 0.00 0.00 0.00 23.12 23.16 3hl2 s ALA 277 CO 0.62 -0.27 -0.18 -0.59 0.00 0.00 0.00 175.76 175.33 3hl2 s PHE 278 N -1.27 1.61 -0.05 0.00 -0.71 0.39 -1.42 117.98 116.54 3hl2 s PHE 278 Ca -0.13 -0.36 0.06 0.00 -1.04 0.00 0.00 56.93 55.46 3hl2 s PHE 278 Cb -0.04 -0.97 -0.01 0.00 -1.21 0.00 0.00 43.02 40.78 3hl2 s PHE 278 CO 0.05 0.06 -0.24 0.08 -1.34 0.00 0.00 175.22 173.83 3hl2 s VAL 279 N -0.76 2.21 0.06 -2.49 1.01 -0.08 -1.35 120.40 119.00 3hl2 s VAL 279 Ca 0.06 -1.02 0.04 0.00 0.00 0.00 0.00 61.98 61.06 3hl2 s VAL 279 Cb -0.08 -1.80 -0.03 0.00 0.00 0.00 0.00 36.38 34.47 3hl2 s VAL 279 CO 0.01 0.57 -0.12 -1.10 0.00 0.00 0.00 175.10 174.46 3hl2 s GLN 280 N -0.28 0.73 0.21 2.72 1.11 -0.56 -0.15 119.66 123.44 3hl2 s GLN 280 Ca 0.00 -0.90 -0.12 0.00 0.01 0.00 0.00 55.36 54.36 3hl2 s GLN 280 Cb -0.13 -0.67 -0.07 0.00 -1.01 0.00 0.00 33.01 31.13 3hl2 s GLN 280 CO 0.03 0.14 0.57 -1.54 0.01 0.00 0.00 175.29 174.50 3hl2 s SER 281 N -1.69 6.71 0.09 5.90 1.04 -0.43 0.86 113.70 126.19 3hl2 s SER 281 Ca -0.04 1.01 -0.14 0.00 0.48 0.00 0.00 55.95 57.26 3hl2 s SER 281 Cb -0.10 -2.26 -0.15 0.00 0.10 0.00 0.00 66.02 63.61 3hl2 s SER 281 CO 0.02 -0.02 1.31 -0.07 0.98 0.00 0.00 173.24 175.45 3hl2 h LEU 282 N 2.89 0.90 -0.53 2.42 3.38 -1.61 -3.23 115.31 119.53 3hl2 h LEU 282 Ca -0.48 -0.61 -0.09 0.00 0.09 0.00 0.00 57.88 56.79 3hl2 h LEU 282 Cb 1.18 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.65 3hl2 h LEU 282 CO 0.68 1.36 -0.02 -2.24 0.09 0.00 0.00 178.44 178.30 3hl2 h ASP 283 N 0.49 0.94 1.28 -0.43 2.03 -1.78 0.18 116.42 119.13 3hl2 h ASP 283 Ca -0.04 -0.32 0.00 0.00 -0.73 0.00 0.00 57.03 55.94 3hl2 h ASP 283 Cb 1.32 -0.25 0.00 0.00 -0.83 0.00 0.00 39.33 39.56 3hl2 h ASP 283 CO 0.14 1.03 0.00 0.11 -1.03 0.00 0.00 179.24 179.49 3hl2 h LYS 284 N 0.82 0.00 0.00 4.15 1.57 -1.87 -2.69 116.57 118.55 3hl2 h LYS 284 Ca 0.15 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.93 3hl2 h LYS 284 Cb 0.56 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.87 3hl2 h LYS 284 CO 0.03 0.00 -0.99 0.09 -0.57 0.00 0.00 179.45 178.01 3hl2 n ASN 285 N -2.61 3.42 0.00 0.86 3.02 -1.09 -4.70 115.26 114.17 3hl2 n ASN 285 Ca 0.03 -0.11 0.00 0.00 -0.03 0.00 0.00 54.58 54.48 3hl2 n ASN 285 Cb 0.37 1.14 0.00 0.00 -0.61 0.00 0.00 39.78 40.68 3hl2 n ASN 285 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 3hl2 n PHE 286 N -1.53 0.00 -3.46 3.10 3.72 0.62 -4.85 117.46 115.06 3hl2 n PHE 286 Ca -0.00 -0.23 -0.21 0.00 -0.05 0.00 0.00 57.45 56.95 3hl2 n PHE 286 Cb 0.09 -0.02 0.04 0.00 -0.94 0.00 0.00 39.48 38.65 3hl2 n PHE 286 CO 0.00 0.00 0.00 -1.33 -0.05 0.00 0.00 176.76 175.38 3hl2 n MET 287 N -0.23 -1.58 -4.31 -1.08 2.81 -1.02 -4.98 117.12 106.73 3hl2 n MET 287 Ca 0.00 0.75 -0.17 0.00 -1.81 0.00 0.00 57.70 56.47 3hl2 n MET 287 Cb 0.26 -4.80 -0.09 0.00 -0.71 0.00 0.00 33.22 27.88 3hl2 n MET 287 CO 0.00 0.00 0.00 0.14 1.51 0.00 0.00 175.97 177.62 3hl2 s VAL 288 N -3.35 0.26 0.70 2.03 -7.23 -1.25 -5.04 120.40 106.51 3hl2 s VAL 288 Ca 0.38 -2.00 -0.15 0.00 -1.81 0.00 0.00 61.98 58.40 3hl2 s VAL 288 Cb -0.10 -2.52 0.02 0.00 0.56 0.00 0.00 36.38 34.34 3hl2 s VAL 288 CO 0.81 0.00 1.17 -2.84 -0.31 0.00 0.00 175.10 173.93 3hl2 s PRO 289 N -3.85 2.39 0.80 4.82 0.02 -1.26 -4.27 135.00 133.64 3hl2 s PRO 289 Ca 0.37 1.61 -0.13 0.00 0.02 0.00 0.00 61.00 62.87 3hl2 s PRO 289 Cb 0.05 -1.88 0.08 0.00 0.02 0.00 0.00 34.50 32.77 3hl2 s PRO 289 CO 0.17 -1.61 1.20 0.08 -0.33 0.00 0.00 177.00 176.51 3hl2 s VAL 290 N -2.13 2.11 0.00 3.83 1.01 -1.26 -4.45 120.40 119.51 3hl2 s VAL 290 Ca 0.71 0.05 0.00 0.00 0.00 0.00 0.00 61.98 62.74 3hl2 s VAL 290 Cb -0.26 -2.46 0.00 0.00 0.00 0.00 0.00 36.38 33.66 3hl2 s VAL 290 CO 0.44 -0.04 0.00 0.61 0.00 0.00 0.00 175.10 176.11 3hl2 n GLY 291 N 0.43 -0.42 0.00 4.51 0.00 -1.26 -5.03 105.19 103.41 3hl2 n GLY 291 Ca 0.13 -0.87 0.00 0.00 0.00 0.00 0.00 46.02 45.28 3hl2 n GLY 291 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hl2 n GLY 292 N 1.99 3.95 3.48 -0.02 0.00 0.19 -4.72 105.19 110.06 3hl2 n GLY 292 Ca 0.00 -1.28 -0.10 0.00 0.00 0.00 0.00 46.02 44.64 3hl2 n GLY 292 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hl2 s ALA 293 N -0.22 0.22 -0.07 4.61 0.00 -0.29 -1.56 121.76 124.44 3hl2 s ALA 293 Ca 0.00 -1.15 0.05 0.00 0.00 0.00 0.00 51.96 50.86 3hl2 s ALA 293 Cb 0.00 1.16 -0.01 0.00 0.00 0.00 0.00 23.12 24.27 3hl2 s ALA 293 CO 0.00 -0.78 -0.24 0.42 0.00 0.00 0.00 175.76 175.16 3hl2 s ILE 294 N -3.96 2.09 -0.21 0.00 1.01 0.25 -0.87 121.20 119.51 3hl2 s ILE 294 Ca 0.27 -1.04 -0.04 0.00 0.00 0.00 0.00 60.65 59.84 3hl2 s ILE 294 Cb 0.01 -1.77 -0.02 0.00 0.01 0.00 0.00 42.46 40.70 3hl2 s ILE 294 CO 0.11 0.57 -0.02 -0.63 0.00 0.00 0.00 174.94 174.97 3hl2 s ILE 295 N 0.01 3.68 0.15 2.92 1.01 -0.61 -1.49 121.20 126.88 3hl2 s ILE 295 Ca -0.09 -0.40 0.06 0.00 0.00 0.00 0.00 60.65 60.23 3hl2 s ILE 295 Cb -0.15 -2.67 -0.04 0.00 0.01 0.00 0.00 42.46 39.60 3hl2 s ILE 295 CO 0.06 0.42 -0.13 0.00 0.00 0.00 0.00 174.94 175.28 3hl2 s ALA 296 N 1.25 1.65 0.33 9.38 0.00 -0.46 -1.40 121.76 132.51 3hl2 s ALA 296 Ca 0.03 -1.46 -0.17 0.00 0.00 0.00 0.00 51.96 50.36 3hl2 s ALA 296 Cb -0.14 -0.05 0.06 0.00 0.00 0.00 0.00 23.12 22.99 3hl2 s ALA 296 CO -0.00 0.04 0.87 0.20 0.00 0.00 0.00 175.76 176.88 3hl2 s GLY 297 N -2.90 0.32 -0.04 0.00 0.00 -0.52 -0.46 107.32 103.72 3hl2 s GLY 297 Ca 0.15 -0.66 0.10 0.00 0.00 0.00 0.00 44.72 44.31 3hl2 s GLY 297 CO 0.04 0.62 0.16 0.69 0.00 0.00 0.00 173.10 174.61 3hl2 n PHE 298 N -0.59 0.00 -3.10 1.90 3.72 -1.26 -0.48 117.46 117.65 3hl2 n PHE 298 Ca -0.07 0.00 -0.44 0.00 -0.05 0.00 0.00 57.45 56.90 3hl2 n PHE 298 Cb 0.60 -0.31 -0.06 0.00 -0.94 0.00 0.00 39.48 38.77 3hl2 n PHE 298 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 3hl2 s ASN 299 N -3.48 6.24 0.27 4.37 2.47 -1.26 -4.57 114.94 118.97 3hl2 s ASN 299 Ca -0.04 -0.88 -0.03 0.00 0.42 0.00 0.00 52.86 52.33 3hl2 s ASN 299 Cb 0.05 -2.32 0.39 0.00 -1.45 0.00 0.00 41.25 37.92 3hl2 s ASN 299 CO 0.41 -0.98 1.92 -0.78 -3.72 0.00 0.00 177.10 173.96 3hl2 h ASP 300 N 9.07 1.04 -0.86 -4.21 1.82 -1.89 -1.79 116.42 119.60 3hl2 h ASP 300 Ca -0.27 -0.01 0.09 0.00 -0.39 0.00 0.00 57.03 56.45 3hl2 h ASP 300 Cb 1.09 -0.24 -0.07 0.00 0.68 0.00 0.00 39.33 40.79 3hl2 h ASP 300 CO 1.00 0.71 0.50 -1.28 -1.61 0.00 0.00 179.24 178.57 3hl2 h SER 301 N 1.20 0.74 0.51 2.28 0.87 -2.00 -2.90 113.55 114.25 3hl2 h SER 301 Ca 0.38 0.04 -0.30 0.00 -1.23 0.00 0.00 61.79 60.68 3hl2 h SER 301 Cb -0.00 -0.10 0.01 0.00 -0.44 0.00 0.00 62.40 61.87 3hl2 h SER 301 CO -0.11 0.43 -1.37 0.15 -0.53 0.00 0.00 176.83 175.39 3hl2 h PHE 302 N 0.85 0.60 -0.95 2.24 3.57 -1.76 -3.11 116.94 118.38 3hl2 h PHE 302 Ca 0.41 -0.44 0.05 0.00 3.53 0.00 0.00 57.97 61.52 3hl2 h PHE 302 Cb 0.35 -0.02 -0.06 0.00 2.79 0.00 0.00 35.95 39.01 3hl2 h PHE 302 CO -0.05 1.37 0.62 0.82 -2.23 0.00 0.00 178.31 178.84 3hl2 h ILE 303 N 0.09 1.12 -0.68 1.41 1.08 -1.38 -0.93 117.51 118.23 3hl2 h ILE 303 Ca -0.19 -0.39 0.06 0.00 -0.39 0.00 0.00 64.86 63.94 3hl2 h ILE 303 Cb 2.03 -0.13 -0.05 0.00 -3.07 0.00 0.00 36.82 35.60 3hl2 h ILE 303 CO 0.21 0.21 0.39 -0.61 -0.69 0.00 0.00 178.15 177.66 3hl2 h GLN 304 N 1.15 0.70 -0.83 2.37 5.75 -1.50 -2.12 115.11 120.62 3hl2 h GLN 304 Ca 0.39 -0.04 0.02 0.00 -0.15 0.00 0.00 58.65 58.87 3hl2 h GLN 304 Cb 0.09 -0.16 -0.04 0.00 1.07 0.00 0.00 27.48 28.43 3hl2 h GLN 304 CO -0.13 0.46 0.55 0.93 -2.65 0.00 0.00 178.83 177.98 3hl2 h GLU 305 N 0.72 1.06 -0.32 1.69 5.08 -1.11 0.10 114.58 121.80 3hl2 h GLU 305 Ca 0.30 -0.06 -0.00 0.00 -1.00 0.00 0.00 59.36 58.60 3hl2 h GLU 305 Cb 0.18 -0.24 -0.02 0.00 0.50 0.00 0.00 28.75 29.17 3hl2 h GLU 305 CO -0.18 0.70 0.19 0.82 -1.00 0.00 0.00 179.01 179.54 3hl2 h ILE 306 N 1.09 1.11 -0.40 3.13 2.04 -1.13 -2.24 117.51 121.12 3hl2 h ILE 306 Ca 0.32 -0.27 0.05 0.00 1.00 0.00 0.00 64.86 65.96 3hl2 h ILE 306 Cb -0.07 0.72 -0.05 0.00 -0.74 0.00 0.00 36.82 36.68 3hl2 h ILE 306 CO -0.09 0.11 0.12 -1.28 0.00 0.00 0.00 178.15 177.01 3hl2 h SER 307 N 0.41 0.10 0.56 1.72 0.87 -0.69 -1.90 113.55 114.61 3hl2 h SER 307 Ca 0.11 0.05 0.00 0.00 -1.23 0.00 0.00 61.79 60.73 3hl2 h SER 307 Cb 0.02 0.05 0.00 0.00 -0.44 0.00 0.00 62.40 62.03 3hl2 h SER 307 CO -0.02 0.09 0.00 0.29 -0.53 0.00 0.00 176.83 176.66 3hl2 n LYS 308 N -5.04 0.08 0.01 2.24 5.02 -0.05 -2.28 118.16 118.13 3hl2 n LYS 308 Ca 0.02 0.16 0.13 0.00 -2.02 0.00 0.00 58.31 56.61 3hl2 n LYS 308 Cb 0.16 -1.50 0.59 0.00 -0.02 0.00 0.00 35.03 34.26 3hl2 n LYS 308 CO 0.00 0.00 0.00 -0.12 -0.52 0.00 0.00 177.40 176.76 3hl2 n MET 309 N -1.44 0.01 -2.88 1.97 1.56 -0.72 -4.78 117.12 110.84 3hl2 n MET 309 Ca 0.06 0.03 -0.41 0.00 -0.27 0.00 0.00 57.70 57.10 3hl2 n MET 309 Cb 0.20 -1.52 -0.04 0.00 2.15 0.00 0.00 33.22 34.01 3hl2 n MET 309 CO 0.00 0.00 0.00 -0.47 -0.73 0.00 0.00 175.97 174.77 3hl2 s TYR 310 N -3.01 3.44 -0.45 1.12 6.14 -0.97 -5.01 117.35 118.62 3hl2 s TYR 310 Ca 0.13 1.28 -0.28 0.00 0.64 0.00 0.00 57.07 58.85 3hl2 s TYR 310 Cb 0.18 -3.01 0.03 0.00 0.42 0.00 0.00 41.96 39.57 3hl2 s TYR 310 CO 0.51 -0.21 1.06 -2.14 0.64 0.00 0.00 175.55 175.41 3hl2 s PRO 311 N 2.04 3.72 0.53 4.97 0.02 -1.26 -4.52 135.00 140.49 3hl2 s PRO 311 Ca 0.39 0.51 0.00 0.00 0.02 0.00 0.00 61.00 61.92 3hl2 s PRO 311 Cb -0.17 -3.89 0.00 0.00 0.02 0.00 0.00 34.50 30.46 3hl2 s PRO 311 CO 0.13 -1.26 0.00 0.41 -0.33 0.00 0.00 177.00 175.96 3hl2 n GLY 312 N 4.74 -1.89 3.93 0.52 0.00 -1.00 -4.96 105.19 106.53 3hl2 n GLY 312 Ca 0.10 -1.74 -0.25 0.00 0.00 0.00 0.00 46.02 44.13 3hl2 n GLY 312 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3hl2 s ARG 313 N 0.00 2.51 0.07 1.61 0.52 -1.24 -4.56 118.95 117.86 3hl2 s ARG 313 Ca 0.00 -0.24 -0.01 0.00 -0.52 0.00 0.00 55.73 54.96 3hl2 s ARG 313 Cb 0.00 -2.25 -0.04 0.00 0.52 0.00 0.00 34.95 33.18 3hl2 s ARG 313 CO 0.00 -0.97 -0.01 0.00 0.02 0.00 0.00 175.30 174.34 3hl2 s ALA 314 N -3.08 0.60 0.46 2.13 0.00 -1.02 -4.95 121.76 115.90 3hl2 s ALA 314 Ca 0.57 -1.27 -0.23 0.00 0.00 0.00 0.00 51.96 51.03 3hl2 s ALA 314 Cb -0.11 0.40 -0.09 0.00 0.00 0.00 0.00 23.12 23.32 3hl2 s ALA 314 CO 0.44 -0.39 1.13 0.45 0.00 0.00 0.00 175.76 177.39 3hl2 n SER 315 N 0.06 1.81 0.00 0.00 2.88 -1.26 -0.49 113.62 116.61 3hl2 n SER 315 Ca -0.12 1.02 0.10 0.00 -1.33 0.00 0.00 58.87 58.54 3hl2 n SER 315 Cb 0.62 -1.44 -0.09 0.00 -0.75 0.00 0.00 64.21 62.55 3hl2 n SER 315 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 3hl2 n ALA 316 N -0.64 4.54 -0.04 -1.46 0.00 -1.26 -4.54 120.51 117.10 3hl2 n ALA 316 Ca 0.09 -0.57 -0.10 0.00 0.00 0.00 0.00 53.44 52.86 3hl2 n ALA 316 Cb 0.41 -0.80 -0.04 0.00 0.00 0.00 0.00 19.45 19.01 3hl2 n ALA 316 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3hl2 h SER 317 N 0.00 -1.21 -0.92 0.00 0.87 -1.93 0.27 113.55 110.63 3hl2 h SER 317 Ca 0.00 0.18 0.03 0.00 -1.23 0.00 0.00 61.79 60.77 3hl2 h SER 317 Cb 0.53 0.52 -0.05 0.00 -0.44 0.00 0.00 62.40 62.95 3hl2 h SER 317 CO 0.00 -0.38 0.60 -0.65 -0.53 0.00 0.00 176.83 175.87 3hl2 h PRO 318 N -0.39 1.13 -0.52 2.24 0.11 -1.84 0.05 132.00 132.77 3hl2 h PRO 318 Ca 0.11 -0.07 -0.04 0.00 0.11 0.00 0.00 66.00 66.11 3hl2 h PRO 318 Cb 0.58 -0.26 -0.02 0.00 0.11 0.00 0.00 31.00 31.41 3hl2 h PRO 318 CO -0.44 0.75 0.15 0.77 -0.21 0.00 0.00 178.00 179.02 3hl2 h SER 319 N 1.17 0.77 -0.86 -2.05 0.02 -1.60 -2.53 113.55 108.47 3hl2 h SER 319 Ca 0.36 -0.22 0.06 0.00 -0.84 0.00 0.00 61.79 61.15 3hl2 h SER 319 Cb -0.02 -0.20 -0.06 0.00 0.14 0.00 0.00 62.40 62.26 3hl2 h SER 319 CO -0.11 0.78 0.54 0.25 -1.14 0.00 0.00 176.83 177.15 3hl2 h LEU 320 N 0.72 0.85 0.15 5.07 5.85 0.46 -1.41 115.31 127.00 3hl2 h LEU 320 Ca 0.17 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.89 3hl2 h LEU 320 Cb 0.30 -0.17 0.00 0.00 0.37 0.00 0.00 40.66 41.16 3hl2 h LEU 320 CO -0.00 0.55 -0.07 0.44 -0.34 0.00 0.00 178.44 179.02 3hl2 h ASP 321 N 0.99 -0.17 -0.09 1.25 3.32 -0.63 -1.44 116.42 119.66 3hl2 h ASP 321 Ca 0.37 -0.05 -0.15 0.00 0.02 0.00 0.00 57.03 57.23 3hl2 h ASP 321 Cb 0.15 0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.74 3hl2 h ASP 321 CO -0.17 -0.06 -0.44 -0.37 -1.72 0.00 0.00 179.24 176.48 3hl2 h VAL 322 N -0.26 1.30 0.09 -1.35 -1.51 -1.28 0.99 116.25 114.23 3hl2 h VAL 322 Ca -0.02 -1.63 0.02 0.00 -1.23 0.00 0.00 66.70 63.84 3hl2 h VAL 322 Cb 0.21 1.58 -0.05 0.00 -2.13 0.00 0.00 31.29 30.90 3hl2 h VAL 322 CO 0.03 0.52 -0.42 0.25 -1.23 0.00 0.00 177.57 176.72 3hl2 h LEU 323 N 0.52 -1.26 -0.48 4.19 5.85 -1.18 0.31 115.31 123.25 3hl2 h LEU 323 Ca 0.03 0.14 0.08 0.00 0.84 0.00 0.00 57.88 58.98 3hl2 h LEU 323 Cb 0.98 0.48 -0.07 0.00 0.37 0.00 0.00 40.66 42.41 3hl2 h LEU 323 CO 0.09 -0.48 0.07 0.40 -0.34 0.00 0.00 178.44 178.18 3hl2 h ILE 324 N -0.64 0.71 0.18 4.05 2.04 -0.95 -0.74 117.51 122.17 3hl2 h ILE 324 Ca 0.03 -0.07 -0.01 0.00 1.00 0.00 0.00 64.86 65.81 3hl2 h ILE 324 Cb 0.68 0.49 0.00 0.00 -0.74 0.00 0.00 36.82 37.25 3hl2 h ILE 324 CO -0.26 0.04 -0.09 0.74 0.00 0.00 0.00 178.15 178.57 3hl2 h THR 325 N 0.20 0.82 -0.05 -0.27 2.02 -0.13 -1.85 112.91 113.64 3hl2 h THR 325 Ca 0.24 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.41 3hl2 h THR 325 Cb 0.33 0.82 -0.00 0.00 -1.74 0.00 0.00 68.15 67.55 3hl2 h THR 325 CO -0.33 0.00 -0.01 -0.07 0.37 0.00 0.00 175.52 175.48 3hl2 h LEU 326 N -0.25 0.10 -1.44 2.58 3.38 -0.17 0.01 115.31 119.52 3hl2 h LEU 326 Ca -0.03 -0.35 0.16 0.00 0.09 0.00 0.00 57.88 57.76 3hl2 h LEU 326 Cb 0.19 -0.03 -0.06 0.00 0.09 0.00 0.00 40.66 40.85 3hl2 h LEU 326 CO 0.04 0.43 0.56 -0.07 0.09 0.00 0.00 178.44 179.49 3hl2 h LEU 327 N -0.23 0.50 0.00 1.67 3.38 -1.17 0.35 115.31 119.80 3hl2 h LEU 327 Ca 0.01 0.04 -0.06 0.00 0.09 0.00 0.00 57.88 57.96 3hl2 h LEU 327 Cb 0.38 -0.06 0.01 0.00 0.09 0.00 0.00 40.66 41.08 3hl2 h LEU 327 CO 0.00 0.24 -0.25 0.28 0.09 0.00 0.00 178.44 178.80 3hl2 h SER 328 N 0.52 0.22 -0.19 -0.43 0.02 -0.91 -0.78 113.55 111.99 3hl2 h SER 328 Ca 0.43 -0.78 -0.15 0.00 -0.84 0.00 0.00 61.79 60.45 3hl2 h SER 328 Cb 0.90 -0.07 -0.01 0.00 0.14 0.00 0.00 62.40 63.37 3hl2 h SER 328 CO -0.17 0.97 -0.43 -0.07 -1.14 0.00 0.00 176.83 175.99 3hl2 h LEU 329 N -0.51 0.80 -0.24 5.07 3.38 -0.76 -3.35 115.31 119.70 3hl2 h LEU 329 Ca -0.03 -0.38 0.17 0.00 0.09 0.00 0.00 57.88 57.74 3hl2 h LEU 329 Cb 1.01 -0.23 -0.08 0.00 0.09 0.00 0.00 40.66 41.46 3hl2 h LEU 329 CO 0.05 1.12 -0.50 0.61 0.09 0.00 0.00 178.44 179.80 3hl2 n GLY 330 N 0.11 -2.55 0.26 0.83 0.00 0.12 -1.19 105.19 102.78 3hl2 n GLY 330 Ca -0.02 -1.29 0.04 0.00 0.00 0.00 0.00 46.02 44.75 3hl2 n GLY 330 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 3hl2 h SER 331 N -0.67 0.26 0.15 1.61 4.64 -0.63 -1.64 113.55 117.27 3hl2 h SER 331 Ca -0.06 -0.03 -0.01 0.00 -0.47 0.00 0.00 61.79 61.22 3hl2 h SER 331 Cb 0.66 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 62.68 3hl2 h SER 331 CO 0.03 0.31 -0.07 0.78 -0.87 0.00 0.00 176.83 177.00 3hl2 h ASN 332 N 0.29 -0.17 -0.63 4.97 2.35 -1.45 0.11 115.58 121.04 3hl2 h ASN 332 Ca 0.07 -0.07 0.13 0.00 -0.55 0.00 0.00 56.30 55.88 3hl2 h ASN 332 Cb 0.18 0.04 -0.10 0.00 0.05 0.00 0.00 38.32 38.50 3hl2 h ASN 332 CO 0.00 -0.04 0.11 1.23 -1.65 0.00 0.00 177.43 177.08 3hl2 h GLY 333 N -0.29 0.80 0.87 2.83 0.00 -0.52 0.21 103.07 106.97 3hl2 h GLY 333 Ca -0.02 -0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.28 3hl2 h GLY 333 CO 0.03 -0.15 0.05 -1.82 0.00 0.00 0.00 176.54 174.65 3hl2 h TYR 334 N 0.23 0.43 -0.37 5.60 3.20 -0.96 -2.18 116.97 122.92 3hl2 h TYR 334 Ca 0.34 -0.06 0.07 0.00 3.14 0.00 0.00 58.73 62.22 3hl2 h TYR 334 Cb 0.54 -0.12 -0.06 0.00 1.54 0.00 0.00 36.73 38.62 3hl2 h TYR 334 CO -0.28 0.52 -0.04 0.87 -1.64 0.00 0.00 178.16 177.58 3hl2 h LYS 335 N 0.23 0.05 -0.56 1.82 1.57 -0.40 -1.32 116.57 117.96 3hl2 h LYS 335 Ca 0.08 -0.00 0.11 0.00 -1.87 0.00 0.00 60.65 58.97 3hl2 h LYS 335 Cb 0.31 -0.01 -0.09 0.00 0.08 0.00 0.00 32.23 32.52 3hl2 h LYS 335 CO 0.00 0.03 -0.00 -0.22 -0.57 0.00 0.00 179.45 178.70 3hl2 h LYS 336 N 0.05 0.11 -0.53 3.15 3.64 -0.69 0.26 116.57 122.56 3hl2 h LYS 336 Ca 0.18 -0.01 0.03 0.00 -1.27 0.00 0.00 60.65 59.58 3hl2 h LYS 336 Cb 0.26 -0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 32.02 3hl2 h LYS 336 CO -0.34 0.07 0.31 -0.07 -2.27 0.00 0.00 179.45 177.16 3hl2 h LEU 337 N 0.12 0.49 -0.53 5.20 3.38 -0.74 0.06 115.31 123.30 3hl2 h LEU 337 Ca 0.29 0.01 0.03 0.00 0.09 0.00 0.00 57.88 58.29 3hl2 h LEU 337 Cb 0.45 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 41.07 3hl2 h LEU 337 CO -0.47 0.34 0.31 -0.07 0.09 0.00 0.00 178.44 178.64 3hl2 h LEU 338 N 0.61 0.49 0.30 1.67 3.38 -0.15 -0.51 115.31 121.10 3hl2 h LEU 338 Ca 0.22 0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.19 3hl2 h LEU 338 Cb 0.05 -0.09 -0.00 0.00 0.09 0.00 0.00 40.66 40.70 3hl2 h LEU 338 CO -0.11 0.34 -0.18 0.50 0.09 0.00 0.00 178.44 179.08 3hl2 h LYS 339 N 0.61 -0.44 -0.76 1.13 1.63 -0.39 -2.39 116.57 115.96 3hl2 h LYS 339 Ca 0.21 0.03 0.07 0.00 -0.85 0.00 0.00 60.65 60.12 3hl2 h LYS 339 Cb 0.04 0.10 -0.05 0.00 -0.60 0.00 0.00 32.23 31.72 3hl2 h LYS 339 CO -0.11 -0.29 0.50 0.93 -3.45 0.00 0.00 179.45 177.03 3hl2 h GLU 340 N -0.46 0.75 -0.87 1.90 5.08 -0.75 -0.97 114.58 119.26 3hl2 h GLU 340 Ca -0.03 -0.05 0.01 0.00 -1.00 0.00 0.00 59.36 58.30 3hl2 h GLU 340 Cb 0.38 -0.17 -0.04 0.00 0.50 0.00 0.00 28.75 29.41 3hl2 h GLU 340 CO 0.03 0.50 0.58 -0.09 -1.00 0.00 0.00 179.01 179.03 3hl2 h ARG 341 N 0.77 1.13 0.12 2.33 2.43 -0.59 0.79 114.38 121.36 3hl2 h ARG 341 Ca 0.34 -0.07 -0.01 0.00 -0.81 0.00 0.00 59.98 59.43 3hl2 h ARG 341 Cb 0.31 -0.26 0.00 0.00 -0.42 0.00 0.00 29.97 29.61 3hl2 h ARG 341 CO -0.12 0.75 -0.06 0.87 -1.51 0.00 0.00 179.97 179.90 3hl2 h LYS 342 N 1.16 -0.15 -0.33 0.20 1.57 -0.90 -0.72 116.57 117.41 3hl2 h LYS 342 Ca 0.33 0.01 0.05 0.00 -1.87 0.00 0.00 60.65 59.16 3hl2 h LYS 342 Cb -0.10 0.03 -0.04 0.00 0.08 0.00 0.00 32.23 32.20 3hl2 h LYS 342 CO -0.08 0.15 0.06 0.93 -0.57 0.00 0.00 179.45 179.94 3hl2 h GLU 343 N -0.45 0.17 -0.71 3.15 5.08 -1.16 -0.91 114.58 119.75 3hl2 h GLU 343 Ca -0.02 -0.01 0.06 0.00 -1.00 0.00 0.00 59.36 58.39 3hl2 h GLU 343 Cb 0.37 -0.04 -0.04 0.00 0.50 0.00 0.00 28.75 29.53 3hl2 h GLU 343 CO 0.03 0.11 0.47 0.52 -1.00 0.00 0.00 179.01 179.14 3hl2 h MET 344 N 0.18 0.73 0.26 2.33 2.86 -0.76 0.58 114.93 121.11 3hl2 h MET 344 Ca 0.16 -0.04 -0.01 0.00 -2.06 0.00 0.00 59.70 57.74 3hl2 h MET 344 Cb 0.17 -0.16 0.00 0.00 0.06 0.00 0.00 31.60 31.67 3hl2 h MET 344 CO -0.21 0.48 -0.13 0.35 1.06 0.00 0.00 176.91 178.47 3hl2 h PHE 345 N 0.75 -0.33 -0.06 -0.22 3.57 0.18 0.50 116.94 121.34 3hl2 h PHE 345 Ca 0.30 -0.01 0.04 0.00 3.53 0.00 0.00 57.97 61.84 3hl2 h PHE 345 Cb 0.24 0.11 -0.05 0.00 2.79 0.00 0.00 35.95 39.03 3hl2 h PHE 345 CO -0.00 -0.10 -0.30 1.03 -2.23 0.00 0.00 178.31 176.72 3hl2 h SER 346 N -0.50 -0.90 -0.57 0.41 0.87 -0.82 0.26 113.55 112.30 3hl2 h SER 346 Ca -0.04 0.13 0.09 0.00 -1.23 0.00 0.00 61.79 60.74 3hl2 h SER 346 Cb 0.38 0.37 -0.07 0.00 -0.44 0.00 0.00 62.40 62.64 3hl2 h SER 346 CO 0.06 -0.35 0.20 0.22 -0.53 0.00 0.00 176.83 176.43 3hl2 h TYR 347 N -0.41 0.35 -0.60 2.24 3.20 -0.75 0.59 116.97 121.59 3hl2 h TYR 347 Ca 0.08 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.97 3hl2 h TYR 347 Cb 0.52 -0.07 -0.03 0.00 1.54 0.00 0.00 36.73 38.70 3hl2 h TYR 347 CO -0.35 0.09 0.32 1.25 -1.64 0.00 0.00 178.16 177.83 3hl2 h LEU 348 N 0.38 0.75 0.33 2.82 5.85 0.58 -1.13 115.31 124.89 3hl2 h LEU 348 Ca 0.28 -0.09 -0.00 0.00 0.84 0.00 0.00 57.88 58.91 3hl2 h LEU 348 Cb 0.34 -0.19 -0.02 0.00 0.37 0.00 0.00 40.66 41.16 3hl2 h LEU 348 CO -0.29 0.63 -0.32 -1.28 -0.34 0.00 0.00 178.44 176.84 3hl2 h SER 349 N 0.81 -0.85 -0.71 1.25 0.87 0.60 -1.62 113.55 113.90 3hl2 h SER 349 Ca 0.21 0.07 0.01 0.00 -1.23 0.00 0.00 61.79 60.85 3hl2 h SER 349 Cb 0.05 0.29 -0.04 0.00 -0.44 0.00 0.00 62.40 62.26 3hl2 h SER 349 CO -0.03 -0.45 0.47 0.78 -0.53 0.00 0.00 176.83 177.06 3hl2 h ASN 350 N -0.67 0.82 0.17 6.23 2.35 -0.79 -0.45 115.58 123.25 3hl2 h ASN 350 Ca -0.02 -0.02 -0.09 0.00 -0.55 0.00 0.00 56.30 55.62 3hl2 h ASN 350 Cb 0.60 -0.21 -0.01 0.00 0.05 0.00 0.00 38.32 38.76 3hl2 h ASN 350 CO -0.05 0.60 -0.32 1.56 -1.65 0.00 0.00 177.43 177.57 3hl2 h GLN 351 N 0.97 0.22 0.08 0.81 1.08 -0.93 -2.38 115.11 114.96 3hl2 h GLN 351 Ca 0.26 -0.09 -0.27 0.00 -1.45 0.00 0.00 58.65 57.11 3hl2 h GLN 351 Cb -0.11 -0.01 0.01 0.00 -0.05 0.00 0.00 27.48 27.33 3hl2 h GLN 351 CO -0.06 0.52 -1.15 0.82 -0.95 0.00 0.00 178.83 178.02 3hl2 h ILE 352 N 0.20 1.38 -0.91 2.54 2.04 -0.53 -2.09 117.51 120.13 3hl2 h ILE 352 Ca 0.03 -2.61 0.16 0.00 1.00 0.00 0.00 64.86 63.43 3hl2 h ILE 352 Cb 0.66 2.67 -0.10 0.00 -0.74 0.00 0.00 36.82 39.32 3hl2 h ILE 352 CO 0.05 0.78 0.51 0.11 0.00 0.00 0.00 178.15 179.60 3hl2 h LYS 353 N 0.21 0.68 0.03 2.37 1.57 -0.87 -0.91 116.57 119.64 3hl2 h LYS 353 Ca -0.14 -0.04 -0.14 0.00 -1.87 0.00 0.00 60.65 58.46 3hl2 h LYS 353 Cb 1.82 -0.15 0.01 0.00 0.08 0.00 0.00 32.23 33.99 3hl2 h LYS 353 CO 0.20 0.45 -0.57 -0.22 -0.57 0.00 0.00 179.45 178.75 3hl2 h LYS 354 N 0.70 0.34 -0.62 3.15 3.64 -1.41 -3.03 116.57 119.34 3hl2 h LYS 354 Ca 0.50 -0.40 -0.01 0.00 -1.27 0.00 0.00 60.65 59.47 3hl2 h LYS 354 Cb 0.70 0.12 -0.03 0.00 -0.41 0.00 0.00 32.23 32.62 3hl2 h LYS 354 CO -0.36 1.10 0.34 1.25 -2.27 0.00 0.00 179.45 179.51 3hl2 h LEU 355 N -0.24 0.77 -0.66 5.20 5.85 -1.13 -3.04 115.31 122.06 3hl2 h LEU 355 Ca -0.08 -0.09 -0.07 0.00 0.84 0.00 0.00 57.88 58.47 3hl2 h LEU 355 Cb 1.32 -0.20 -0.03 0.00 0.37 0.00 0.00 40.66 42.13 3hl2 h LEU 355 CO 0.11 0.64 0.12 0.77 -0.34 0.00 0.00 178.44 179.75 3hl2 h SER 356 N 0.84 1.04 -0.47 1.25 4.64 -1.27 -2.73 113.55 116.85 3hl2 h SER 356 Ca 0.22 -0.25 0.10 0.00 -0.47 0.00 0.00 61.79 61.38 3hl2 h SER 356 Cb 0.04 -0.28 -0.09 0.00 -0.31 0.00 0.00 62.40 61.76 3hl2 h SER 356 CO -0.04 1.03 -0.16 -0.08 -0.87 0.00 0.00 176.83 176.71 3hl2 h GLU 357 N 1.01 -0.05 0.00 4.77 4.81 -1.41 0.10 114.58 123.81 3hl2 h GLU 357 Ca 0.20 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.44 3hl2 h GLU 357 Cb 0.42 0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.81 3hl2 h GLU 357 CO 0.01 -0.03 0.02 0.00 -0.73 0.00 0.00 179.01 178.27 3hl2 h ALA 358 N 1.36 1.01 -0.02 2.92 0.00 -1.47 -1.32 119.26 121.75 3hl2 h ALA 358 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.14 3hl2 h ALA 358 Cb 0.40 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.19 3hl2 h ALA 358 CO -0.51 -0.01 0.00 0.66 0.00 0.00 0.00 179.25 179.38 3hl2 n TYR 359 N -2.46 0.02 -2.22 0.00 4.01 0.20 -4.99 117.16 111.72 3hl2 n TYR 359 Ca -0.02 -0.37 -0.13 0.00 -0.16 0.00 0.00 57.90 57.22 3hl2 n TYR 359 Cb 0.06 -0.04 -0.01 0.00 -0.31 0.00 0.00 39.34 39.04 3hl2 n TYR 359 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 3hl2 n ASN 360 N -0.31 -4.17 -4.31 7.72 5.03 -0.32 -4.91 115.26 114.00 3hl2 n ASN 360 Ca 0.01 0.00 -0.22 0.00 0.87 0.00 0.00 54.58 55.24 3hl2 n ASN 360 Cb 0.20 -3.34 -0.00 0.00 -1.02 0.00 0.00 39.78 35.62 3hl2 n ASN 360 CO 0.00 0.00 0.00 -0.62 -1.83 0.00 0.00 177.26 174.81 3hl2 n GLU 361 N -2.30 0.84 -3.89 3.52 -0.58 -0.50 -4.84 120.64 112.89 3hl2 n GLU 361 Ca -0.16 -2.83 -0.09 0.00 -0.42 0.00 0.00 57.16 53.66 3hl2 n GLU 361 Cb 0.61 0.34 -0.06 0.00 -0.57 0.00 0.00 31.44 31.76 3hl2 n GLU 361 CO 0.00 0.00 0.00 -0.98 -0.48 0.00 0.00 177.13 175.67 3hl2 s ARG 362 N -3.82 1.12 -0.46 3.49 1.70 -1.26 -3.76 118.95 115.96 3hl2 s ARG 362 Ca 0.23 -1.07 -0.28 0.00 -0.47 0.00 0.00 55.73 54.15 3hl2 s ARG 362 Cb -0.02 0.39 0.03 0.00 -0.57 0.00 0.00 34.95 34.78 3hl2 s ARG 362 CO 0.15 -0.41 1.07 -1.17 -1.08 0.00 0.00 175.30 173.85 3hl2 s LEU 363 N -2.93 3.77 0.17 -1.89 2.96 -1.26 -1.51 118.68 117.99 3hl2 s LEU 363 Ca 0.13 0.40 -0.33 0.00 -0.22 0.00 0.00 54.13 54.11 3hl2 s LEU 363 Cb 0.03 -3.44 -0.16 0.00 0.50 0.00 0.00 46.19 43.12 3hl2 s LEU 363 CO -0.03 -1.16 1.12 0.18 -1.32 0.00 0.00 176.35 175.14 3hl2 n LEU 364 N 7.56 1.33 -4.56 -0.68 4.77 0.19 -4.82 117.00 120.80 3hl2 n LEU 364 Ca 0.10 1.14 -0.38 0.00 -0.03 0.00 0.00 56.01 56.85 3hl2 n LEU 364 Cb 0.49 -1.19 -0.03 0.00 -2.33 0.00 0.00 43.42 40.35 3hl2 n LEU 364 CO 0.68 -1.41 1.42 -2.28 -1.33 0.00 0.00 177.39 174.47 3hl2 s HIS 365 N -0.25 2.31 -0.49 -1.77 5.65 -1.26 -4.73 115.29 114.75 3hl2 s HIS 365 Ca 0.73 -0.36 0.08 0.00 0.25 0.00 0.00 55.06 55.76 3hl2 s HIS 365 Cb -0.87 -4.53 0.34 0.00 -1.18 0.00 0.00 32.58 26.34 3hl2 s HIS 365 CO 0.53 -1.94 0.84 0.25 -0.65 0.00 0.00 174.74 173.77 3hl2 n THR 366 N 7.04 1.57 -0.09 0.89 -2.24 -1.26 -4.22 114.28 115.96 3hl2 n THR 366 Ca 0.30 -5.11 0.13 0.00 -2.27 0.00 0.00 64.05 57.09 3hl2 n THR 366 Cb 0.50 -0.92 0.51 0.00 -2.10 0.00 0.00 70.33 68.31 3hl2 n THR 366 CO 0.00 0.00 0.00 -0.65 -0.57 0.00 0.00 175.07 173.85 3hl2 h PRO 367 N 3.03 0.38 -0.01 -0.78 0.11 -1.98 -2.12 132.00 130.63 3hl2 h PRO 367 Ca 0.12 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.20 3hl2 h PRO 367 Cb 0.72 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.74 3hl2 h PRO 367 CO 0.67 0.25 0.00 0.72 -0.21 0.00 0.00 178.00 179.43 3hl2 n HIS 368 N -4.47 0.01 -3.68 0.65 8.25 -1.26 -4.58 115.22 110.15 3hl2 n HIS 368 Ca 0.10 -0.01 -0.39 0.00 -0.26 0.00 0.00 57.72 57.17 3hl2 n HIS 368 Cb 0.41 0.00 -0.12 0.00 1.12 0.00 0.00 29.99 31.40 3hl2 n HIS 368 CO 0.00 0.00 0.00 1.21 0.64 0.00 0.00 176.34 178.19 3hl2 s ASN 369 N -1.74 5.49 0.13 0.41 3.84 -0.80 -4.32 114.94 117.95 3hl2 s ASN 369 Ca 0.36 -1.19 0.25 0.00 0.21 0.00 0.00 52.86 52.48 3hl2 s ASN 369 Cb 0.17 -1.93 0.94 0.00 -0.55 0.00 0.00 41.25 39.88 3hl2 s ASN 369 CO 0.28 -0.39 1.78 -2.65 -2.79 0.00 0.00 177.10 173.32 3hl2 n PRO 370 N 4.88 0.14 0.00 0.43 -0.02 -1.26 -4.24 135.00 134.93 3hl2 n PRO 370 Ca -0.12 0.19 0.00 0.00 -2.02 0.00 0.00 63.50 61.56 3hl2 n PRO 370 Cb 0.45 -1.69 0.00 0.00 -0.02 0.00 0.00 33.50 32.23 3hl2 n PRO 370 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 3hl2 n ILE 371 N -1.95 0.00 -4.41 4.25 5.41 -1.26 -4.96 119.36 116.44 3hl2 n ILE 371 Ca 0.05 0.00 -0.35 0.00 1.00 0.00 0.00 62.75 63.46 3hl2 n ILE 371 Cb 0.34 -0.56 -0.10 0.00 -0.71 0.00 0.00 39.64 38.61 3hl2 n ILE 371 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 176.55 176.00 3hl2 s SER 372 N -4.02 5.10 0.33 4.38 0.15 -1.26 -2.13 113.70 116.24 3hl2 s SER 372 Ca 0.00 0.09 0.08 0.00 0.70 0.00 0.00 55.95 56.82 3hl2 s SER 372 Cb 0.00 -1.46 -0.04 0.00 -1.71 0.00 0.00 66.02 62.80 3hl2 s SER 372 CO 0.00 0.35 0.10 -0.76 1.20 0.00 0.00 173.24 174.13 3hl2 s LEU 373 N -0.71 3.21 -0.09 3.45 1.43 0.58 -4.33 118.68 122.23 3hl2 s LEU 373 Ca 0.11 -0.79 -0.04 0.00 -1.03 0.00 0.00 54.13 52.38 3hl2 s LEU 373 Cb -0.12 -1.68 0.05 0.00 0.03 0.00 0.00 46.19 44.47 3hl2 s LEU 373 CO 0.02 -0.25 0.19 0.00 0.23 0.00 0.00 176.35 176.54 3hl2 s ALA 374 N -2.43 -0.33 -0.11 4.21 0.00 -1.26 -2.50 121.76 119.34 3hl2 s ALA 374 Ca 0.36 0.74 -0.04 0.00 0.00 0.00 0.00 51.96 53.02 3hl2 s ALA 374 Cb -0.03 -0.71 -0.04 0.00 0.00 0.00 0.00 23.12 22.35 3hl2 s ALA 374 CO 0.22 -0.38 0.05 1.41 0.00 0.00 0.00 175.76 177.06 3hl2 s MET 375 N 1.78 3.24 0.94 0.00 1.75 -0.05 -0.64 119.30 126.32 3hl2 s MET 375 Ca -0.03 -0.31 -0.12 0.00 -1.25 0.00 0.00 55.69 53.98 3hl2 s MET 375 Cb -0.12 -2.97 0.15 0.00 2.84 0.00 0.00 34.83 34.74 3hl2 s MET 375 CO -0.07 0.68 1.10 0.95 -0.65 0.00 0.00 175.02 177.04 3hl2 s THR 376 N -0.80 2.27 -0.22 10.11 -4.23 -0.57 0.59 115.64 122.79 3hl2 s THR 376 Ca 0.13 0.09 0.19 0.00 -1.18 0.00 0.00 61.69 60.92 3hl2 s THR 376 Cb -0.12 -2.67 0.43 0.00 1.34 0.00 0.00 72.50 71.48 3hl2 s THR 376 CO 0.03 -0.12 1.22 0.18 -0.54 0.00 0.00 174.62 175.40 3hl2 n LEU 377 N -3.94 0.50 0.20 4.79 4.77 -0.02 -4.67 117.00 118.63 3hl2 n LEU 377 Ca 0.06 -2.84 0.09 0.00 -0.03 0.00 0.00 56.01 53.29 3hl2 n LEU 377 Cb 0.57 0.27 0.35 0.00 -2.33 0.00 0.00 43.42 42.28 3hl2 n LEU 377 CO 0.57 1.16 0.73 0.07 -1.33 0.00 0.00 177.39 178.60 3hl2 h LYS 378 N 1.75 0.00 -0.05 3.23 2.10 -1.93 -2.84 116.57 118.82 3hl2 h LYS 378 Ca -0.27 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.38 3hl2 h LYS 378 Cb 1.38 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.71 3hl2 h LYS 378 CO 0.04 0.27 0.00 0.25 -2.00 0.00 0.00 179.45 178.00 3hl2 n THR 379 N -3.34 0.00 -4.95 0.07 -2.24 -1.26 -4.72 114.28 97.84 3hl2 n THR 379 Ca 0.01 0.00 -0.32 0.00 -2.27 0.00 0.00 64.05 61.46 3hl2 n THR 379 Cb 0.50 -0.07 -0.15 0.00 -2.10 0.00 0.00 70.33 68.52 3hl2 n THR 379 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3hl2 s LEU 380 N -0.94 2.53 -0.71 3.22 1.02 -1.07 -5.08 118.68 117.65 3hl2 s LEU 380 Ca 0.00 -0.34 -0.16 0.00 0.02 0.00 0.00 54.13 53.65 3hl2 s LEU 380 Cb 0.00 -1.53 0.16 0.00 0.02 0.00 0.00 46.19 44.84 3hl2 s LEU 380 CO 0.00 0.24 0.72 -0.62 0.02 0.00 0.00 176.35 176.72 3hl2 s ASP 381 N -0.12 6.47 0.02 2.29 2.15 -1.26 -4.85 116.67 121.36 3hl2 s ASP 381 Ca -0.03 -2.09 0.21 0.00 0.43 0.00 0.00 52.55 51.07 3hl2 s ASP 381 Cb -0.14 -2.25 0.88 0.00 -0.30 0.00 0.00 42.92 41.11 3hl2 s ASP 381 CO 0.04 -0.83 1.66 1.21 -0.17 0.00 0.00 175.17 177.08 3hl2 n GLU 382 N 5.14 0.02 -0.09 4.34 4.07 -1.26 -1.98 120.64 130.88 3hl2 n GLU 382 Ca 0.02 0.16 -0.14 0.00 -0.06 0.00 0.00 57.16 57.15 3hl2 n GLU 382 Cb 0.44 -1.53 -0.07 0.00 -0.06 0.00 0.00 31.44 30.23 3hl2 n GLU 382 CO 0.00 0.00 0.00 1.25 -0.06 0.00 0.00 177.13 178.32 3hl2 h HIS 383 N 0.00 0.00 0.22 4.31 2.76 -1.95 -3.20 115.15 117.28 3hl2 h HIS 383 Ca 0.00 0.00 -0.32 0.00 -2.20 0.00 0.00 60.37 57.85 3hl2 h HIS 383 Cb 0.37 0.00 0.03 0.00 1.55 0.00 0.00 27.41 29.35 3hl2 h HIS 383 CO 0.00 0.80 -1.47 0.00 -1.30 0.00 0.00 177.93 175.96 3hl2 h ARG 384 N -1.00 0.46 -0.01 5.26 -0.00 -2.00 -3.38 114.38 113.72 3hl2 h ARG 384 Ca -0.18 -0.78 0.00 0.00 -0.50 0.00 0.00 59.98 58.52 3hl2 h ARG 384 Cb 0.91 0.29 0.00 0.00 0.00 0.00 0.00 29.97 31.17 3hl2 h ARG 384 CO -0.11 1.38 -0.38 -0.25 0.00 0.00 0.00 179.97 180.61 3hl2 n ASP 385 N -3.75 1.15 -4.17 7.04 8.00 -0.87 -4.97 116.55 118.98 3hl2 n ASP 385 Ca -0.19 -1.08 -0.36 0.00 0.71 0.00 0.00 54.79 53.88 3hl2 n ASP 385 Cb 1.05 0.64 -0.02 0.00 -0.02 0.00 0.00 41.12 42.77 3hl2 n ASP 385 CO 0.00 0.00 0.00 2.29 -0.39 0.00 0.00 177.20 179.10 3hl2 n LYS 386 N -0.55 -3.26 0.21 -1.24 2.85 -0.84 -4.82 118.16 110.51 3hl2 n LYS 386 Ca 0.04 0.38 0.07 0.00 -1.05 0.00 0.00 58.31 57.76 3hl2 n LYS 386 Cb 0.25 -5.13 0.43 0.00 -0.65 0.00 0.00 35.03 29.94 3hl2 n LYS 386 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 3hl2 h ALA 387 N 0.92 1.09 -0.10 0.58 0.00 -1.74 -2.52 119.26 117.50 3hl2 h ALA 387 Ca -0.58 -0.27 -0.08 0.00 0.00 0.00 0.00 54.91 53.98 3hl2 h ALA 387 Cb 1.38 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 19.12 3hl2 h ALA 387 CO 0.77 0.37 -0.26 0.28 0.00 0.00 0.00 179.25 180.41 3hl2 h VAL 388 N 0.00 1.40 -0.57 0.00 2.07 -1.88 -1.61 116.25 115.67 3hl2 h VAL 388 Ca -0.00 -1.59 -0.10 0.00 0.82 0.00 0.00 66.70 65.83 3hl2 h VAL 388 Cb 0.74 2.18 -0.02 0.00 -1.52 0.00 0.00 31.29 32.67 3hl2 h VAL 388 CO 0.04 0.46 -0.03 0.71 0.02 0.00 0.00 177.57 178.77 3hl2 h THR 389 N -0.11 1.26 -0.20 2.57 1.35 -1.93 -2.97 112.91 112.88 3hl2 h THR 389 Ca -0.01 -1.16 0.06 0.00 -0.55 0.00 0.00 66.41 64.75 3hl2 h THR 389 Cb 0.88 0.86 -0.06 0.00 -1.73 0.00 0.00 68.15 68.09 3hl2 h THR 389 CO 0.06 0.42 -0.23 1.56 -0.25 0.00 0.00 175.52 177.08 3hl2 h GLN 390 N 0.91 -0.24 -0.99 4.72 4.20 -1.41 -1.89 115.11 120.42 3hl2 h GLN 390 Ca 0.16 0.02 0.19 0.00 0.06 0.00 0.00 58.65 59.08 3hl2 h GLN 390 Cb 0.57 0.05 -0.10 0.00 0.30 0.00 0.00 27.48 28.31 3hl2 h GLN 390 CO 0.03 -0.16 0.61 1.25 -0.67 0.00 0.00 178.83 179.90 3hl2 h LEU 391 N -0.25 0.69 -0.30 1.46 5.85 -1.14 -0.92 115.31 120.69 3hl2 h LEU 391 Ca 0.12 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.93 3hl2 h LEU 391 Cb 0.44 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.41 3hl2 h LEU 391 CO -0.35 0.25 0.19 1.23 -0.34 0.00 0.00 178.44 179.43 3hl2 h GLY 392 N 0.67 0.43 0.90 3.75 0.00 -1.21 -1.59 103.07 106.03 3hl2 h GLY 392 Ca 0.55 -0.17 -0.01 0.00 0.00 0.00 0.00 47.33 47.70 3hl2 h GLY 392 CO -0.32 0.16 -0.12 1.76 0.00 0.00 0.00 176.54 178.02 3hl2 h SER 393 N 0.40 -0.27 -0.53 0.19 0.02 -0.90 -2.55 113.55 109.91 3hl2 h SER 393 Ca 0.11 -0.07 0.08 0.00 -0.84 0.00 0.00 61.79 61.07 3hl2 h SER 393 Cb -0.02 0.07 -0.06 0.00 0.14 0.00 0.00 62.40 62.52 3hl2 h SER 393 CO -0.02 -0.11 0.17 0.24 -1.14 0.00 0.00 176.83 175.97 3hl2 h MET 394 N -0.43 0.33 -0.91 3.45 2.07 -1.22 0.25 114.93 118.47 3hl2 h MET 394 Ca -0.03 -0.02 0.09 0.00 -2.07 0.00 0.00 59.70 57.66 3hl2 h MET 394 Cb 0.32 -0.07 -0.06 0.00 -1.87 0.00 0.00 31.60 29.92 3hl2 h MET 394 CO 0.05 0.22 0.59 -0.07 1.07 0.00 0.00 176.91 178.77 3hl2 h LEU 395 N 0.34 0.86 0.68 1.22 3.38 -1.25 -0.20 115.31 120.34 3hl2 h LEU 395 Ca 0.26 0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.22 3hl2 h LEU 395 Cb 0.31 -0.16 0.01 0.00 0.09 0.00 0.00 40.66 40.90 3hl2 h LEU 395 CO -0.28 0.52 -0.33 0.15 0.09 0.00 0.00 178.44 178.59 3hl2 h PHE 396 N 0.96 -0.84 -0.32 1.13 3.57 -0.34 -0.59 116.94 120.50 3hl2 h PHE 396 Ca 0.41 -0.02 0.09 0.00 3.53 0.00 0.00 57.97 61.99 3hl2 h PHE 396 Cb 0.33 0.28 -0.01 0.00 2.79 0.00 0.00 35.95 39.34 3hl2 h PHE 396 CO -0.00 -0.51 0.34 1.79 -2.23 0.00 0.00 178.31 177.69 3hl2 h THR 397 N -1.23 0.45 -0.30 4.41 1.35 -0.37 1.13 112.91 118.35 3hl2 h THR 397 Ca -0.09 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.77 3hl2 h THR 397 Cb 0.71 0.73 0.00 0.00 -1.73 0.00 0.00 68.15 67.86 3hl2 h THR 397 CO 0.15 0.00 0.00 0.54 -0.25 0.00 0.00 175.52 175.96 3hl2 n ARG 398 N -3.81 1.80 -3.05 4.72 1.74 -0.11 -4.91 116.66 113.03 3hl2 n ARG 398 Ca 0.05 -1.13 -0.13 0.00 -0.77 0.00 0.00 57.85 55.87 3hl2 n ARG 398 Cb 0.49 -1.29 0.06 0.00 -1.02 0.00 0.00 32.46 30.70 3hl2 n ARG 398 CO 0.00 0.00 0.00 1.04 -1.52 0.00 0.00 177.63 177.15 3hl2 n GLN 399 N 0.40 -4.74 -3.92 5.56 6.02 0.39 -5.02 117.38 116.06 3hl2 n GLN 399 Ca 0.10 0.56 -0.35 0.00 -0.01 0.00 0.00 57.00 57.31 3hl2 n GLN 399 Cb 0.30 -4.75 -0.14 0.00 1.02 0.00 0.00 30.24 26.67 3hl2 n GLN 399 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 177.06 176.13 3hl2 s VAL 400 N -3.23 3.03 0.07 5.09 1.01 -0.24 -5.03 120.40 121.11 3hl2 s VAL 400 Ca 0.14 -1.14 0.05 0.00 0.00 0.00 0.00 61.98 61.03 3hl2 s VAL 400 Cb -0.06 -2.63 -0.04 0.00 0.00 0.00 0.00 36.38 33.65 3hl2 s VAL 400 CO 0.49 0.06 -0.05 -0.94 0.00 0.00 0.00 175.10 174.65 3hl2 s SER 401 N 1.31 4.70 0.00 3.32 1.04 -1.26 -4.17 113.70 118.64 3hl2 s SER 401 Ca -0.02 -0.24 0.00 0.00 0.48 0.00 0.00 55.95 56.17 3hl2 s SER 401 Cb -0.18 -1.04 0.00 0.00 0.10 0.00 0.00 66.02 64.90 3hl2 s SER 401 CO -0.02 0.20 0.00 0.61 0.98 0.00 0.00 173.24 175.01 3hl2 n GLY 402 N 0.87 1.61 3.55 7.32 0.00 -1.26 -5.01 105.19 112.27 3hl2 n GLY 402 Ca -0.13 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.51 3hl2 n GLY 402 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hl2 s ALA 403 N -2.41 2.30 -0.40 4.61 0.00 -1.26 -4.49 121.76 120.11 3hl2 s ALA 403 Ca 0.00 -1.02 -0.17 0.00 0.00 0.00 0.00 51.96 50.77 3hl2 s ALA 403 Cb 0.00 -4.33 0.01 0.00 0.00 0.00 0.00 23.12 18.80 3hl2 s ALA 403 CO 0.00 -3.81 0.41 0.50 0.00 0.00 0.00 175.76 172.86 3hl2 s ARG 404 N 6.58 3.19 -0.02 0.00 3.52 -1.14 -4.92 118.95 126.15 3hl2 s ARG 404 Ca 0.58 -0.70 -0.20 0.00 -0.13 0.00 0.00 55.73 55.27 3hl2 s ARG 404 Cb -0.10 -3.93 -0.05 0.00 -1.56 0.00 0.00 34.95 29.30 3hl2 s ARG 404 CO 0.15 -0.78 0.59 0.08 -0.81 0.00 0.00 175.30 174.54 3hl2 s VAL 405 N 2.08 4.94 -0.30 7.11 1.01 -1.26 0.24 120.40 134.23 3hl2 s VAL 405 Ca 0.12 1.23 0.02 0.00 0.00 0.00 0.00 61.98 63.35 3hl2 s VAL 405 Cb -0.17 -3.93 0.09 0.00 0.00 0.00 0.00 36.38 32.37 3hl2 s VAL 405 CO 0.13 0.40 0.03 -0.69 0.00 0.00 0.00 175.10 174.97 3hl2 s VAL 406 N -0.05 1.62 0.69 2.92 1.01 -0.64 -5.00 120.40 120.95 3hl2 s VAL 406 Ca 0.31 -1.70 -0.09 0.00 0.00 0.00 0.00 61.98 60.51 3hl2 s VAL 406 Cb -0.18 -2.10 0.03 0.00 0.00 0.00 0.00 36.38 34.14 3hl2 s VAL 406 CO 0.17 -0.45 1.03 -2.16 0.00 0.00 0.00 175.10 173.69 3hl2 s PRO 407 N 1.27 2.62 0.27 2.72 0.05 -1.26 -2.16 135.00 138.51 3hl2 s PRO 407 Ca 0.05 0.13 -0.25 0.00 0.05 0.00 0.00 61.00 60.99 3hl2 s PRO 407 Cb -0.18 -2.11 -0.09 0.00 0.05 0.00 0.00 34.50 32.16 3hl2 s PRO 407 CO -0.12 -1.06 0.87 -0.51 0.05 0.00 0.00 177.00 176.23 3hl2 s LEU 408 N -5.26 4.40 -0.77 -3.56 1.43 -1.26 -4.47 118.68 109.19 3hl2 s LEU 408 Ca 0.58 1.72 0.00 0.00 -1.03 0.00 0.00 54.13 55.40 3hl2 s LEU 408 Cb -0.11 -3.79 0.00 0.00 0.03 0.00 0.00 46.19 42.32 3hl2 s LEU 408 CO 0.48 0.01 0.00 0.61 0.23 0.00 0.00 176.35 177.68 3hl2 n GLY 409 N 0.81 0.24 3.68 -3.19 0.00 -1.26 -5.00 105.19 100.46 3hl2 n GLY 409 Ca -0.00 -0.56 -0.43 0.00 0.00 0.00 0.00 46.02 45.04 3hl2 n GLY 409 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3hl2 s SER 410 N -2.68 7.05 -0.07 1.61 0.01 -1.26 -4.58 113.70 113.77 3hl2 s SER 410 Ca 0.00 1.69 -0.17 0.00 1.31 0.00 0.00 55.95 58.79 3hl2 s SER 410 Cb 0.00 -2.55 -0.05 0.00 0.21 0.00 0.00 66.02 63.63 3hl2 s SER 410 CO 0.00 -0.63 0.44 -0.04 0.41 0.00 0.00 173.24 173.42 3hl2 s MET 411 N 2.70 4.19 -0.12 12.44 -1.94 -1.26 -0.15 119.30 135.16 3hl2 s MET 411 Ca 0.53 0.42 -0.09 0.00 -1.71 0.00 0.00 55.69 54.84 3hl2 s MET 411 Cb -0.22 -3.36 0.03 0.00 2.01 0.00 0.00 34.83 33.30 3hl2 s MET 411 CO 0.17 0.36 0.30 -1.14 -0.01 0.00 0.00 175.02 174.70 3hl2 s GLN 412 N -0.03 0.32 -0.10 2.03 2.00 -0.78 -4.97 119.66 118.13 3hl2 s GLN 412 Ca 0.24 0.47 -0.04 0.00 -2.00 0.00 0.00 55.36 54.04 3hl2 s GLN 412 Cb -0.16 0.10 -0.04 0.00 0.80 0.00 0.00 33.01 33.71 3hl2 s GLN 412 CO 0.11 -0.08 0.04 0.99 -0.50 0.00 0.00 175.29 175.85 3hl2 s THR 413 N 0.48 4.61 -0.17 -0.34 2.01 -1.26 -0.86 115.64 120.12 3hl2 s THR 413 Ca -0.03 -0.13 -0.02 0.00 0.31 0.00 0.00 61.69 61.82 3hl2 s THR 413 Cb -0.04 -2.97 0.05 0.00 0.01 0.00 0.00 72.50 69.55 3hl2 s THR 413 CO -0.03 0.59 0.02 -0.69 -0.69 0.00 0.00 174.62 173.83 3hl2 s VAL 414 N -0.75 0.53 -1.54 3.82 1.01 0.07 -4.84 120.40 118.70 3hl2 s VAL 414 Ca 0.12 -0.42 -0.09 0.00 0.00 0.00 0.00 61.98 61.59 3hl2 s VAL 414 Cb -0.12 -0.94 0.07 0.00 0.00 0.00 0.00 36.38 35.40 3hl2 s VAL 414 CO 0.02 -0.09 0.66 -1.20 0.00 0.00 0.00 175.10 174.49 3hl2 n SER 415 N 5.06 -2.19 0.00 3.32 7.64 -1.26 -1.60 113.62 124.59 3hl2 n SER 415 Ca -0.09 -0.96 0.00 0.00 1.01 0.00 0.00 58.87 58.83 3hl2 n SER 415 Cb 0.48 -3.12 0.00 0.00 -1.01 0.00 0.00 64.21 60.56 3hl2 n SER 415 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3hl2 n GLY 416 N -1.70 2.94 3.77 0.23 0.00 -1.26 -5.02 105.19 104.14 3hl2 n GLY 416 Ca -0.11 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.52 3hl2 n GLY 416 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3hl2 s TYR 417 N -2.10 3.91 -0.18 1.61 5.04 -0.63 -5.05 117.35 119.96 3hl2 s TYR 417 Ca 0.00 1.69 -0.07 0.00 -2.44 0.00 0.00 57.07 56.25 3hl2 s TYR 417 Cb 0.00 -2.82 -0.04 0.00 0.35 0.00 0.00 41.96 39.45 3hl2 s TYR 417 CO 0.00 0.49 0.06 -0.08 -1.34 0.00 0.00 175.55 174.68 3hl2 s THR 418 N -1.07 4.79 -0.23 4.34 -1.32 -1.26 -0.75 115.64 120.14 3hl2 s THR 418 Ca 0.37 -0.04 -0.05 0.00 -1.21 0.00 0.00 61.69 60.76 3hl2 s THR 418 Cb -0.24 -3.15 -0.02 0.00 -1.51 0.00 0.00 72.50 67.59 3hl2 s THR 418 CO 0.27 0.47 0.00 -0.36 -2.21 0.00 0.00 174.62 172.79 3hl2 s PHE 419 N 0.30 3.01 0.19 9.09 0.08 -0.04 -5.00 117.98 125.62 3hl2 s PHE 419 Ca 0.03 -0.69 -0.18 0.00 0.12 0.00 0.00 56.93 56.21 3hl2 s PHE 419 Cb -0.12 -2.15 -0.08 0.00 -0.57 0.00 0.00 43.02 40.10 3hl2 s PHE 419 CO 0.00 -0.44 0.67 1.03 -0.10 0.00 0.00 175.22 176.38 3hl2 s ARG 420 N 1.45 4.18 -1.39 0.44 0.52 -1.26 -1.87 118.95 121.03 3hl2 s ARG 420 Ca 0.05 0.76 -0.07 0.00 -0.52 0.00 0.00 55.73 55.96 3hl2 s ARG 420 Cb -0.15 -2.93 0.03 0.00 0.52 0.00 0.00 34.95 32.43 3hl2 s ARG 420 CO -0.00 0.44 0.95 0.41 0.02 0.00 0.00 175.30 177.12 3hl2 n GLY 421 N 0.83 -0.43 3.76 -3.53 0.00 -0.29 -4.19 105.19 101.34 3hl2 n GLY 421 Ca -0.04 0.18 -0.38 0.00 0.00 0.00 0.00 46.02 45.78 3hl2 n GLY 421 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3hl2 s PHE 422 N -3.42 2.59 0.00 1.61 5.36 0.78 -2.28 117.98 122.63 3hl2 s PHE 422 Ca 0.38 1.41 0.00 0.00 -0.96 0.00 0.00 56.93 57.76 3hl2 s PHE 422 Cb -0.18 -3.67 0.00 0.00 -0.34 0.00 0.00 43.02 38.82 3hl2 s PHE 422 CO 0.79 -2.34 0.00 -1.33 -1.46 0.00 0.00 175.22 170.88 3hl2 n MET 423 N -0.49 0.00 0.00 10.12 2.81 -1.26 -4.65 117.12 123.65 3hl2 n MET 423 Ca 0.07 0.00 0.04 0.00 -1.81 0.00 0.00 57.70 56.00 3hl2 n MET 423 Cb 0.45 -1.55 -0.03 0.00 -0.71 0.00 0.00 33.22 31.38 3hl2 n MET 423 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 3hl2 n SER 424 N 0.00 0.53 -0.01 7.83 3.41 -0.96 -4.95 113.62 119.46 3hl2 n SER 424 Ca 0.00 -0.76 -0.00 0.00 -0.26 0.00 0.00 58.87 57.85 3hl2 n SER 424 Cb 0.00 0.87 -0.00 0.00 -0.26 0.00 0.00 64.21 64.82 3hl2 n SER 424 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 3hl2 n HIS 425 N -0.97 0.00 -3.55 7.33 -0.00 -1.25 -4.89 115.22 111.89 3hl2 n HIS 425 Ca 0.02 0.00 -0.13 0.00 -0.00 0.00 0.00 57.72 57.61 3hl2 n HIS 425 Cb 0.13 -0.54 -0.05 0.00 -0.00 0.00 0.00 29.99 29.53 3hl2 n HIS 425 CO 0.00 0.00 0.00 -0.08 -0.00 0.00 0.00 176.34 176.26 3hl2 s THR 426 N -1.76 0.00 0.25 1.59 -1.32 -1.26 -4.51 115.64 108.63 3hl2 s THR 426 Ca 0.00 0.00 -0.05 0.00 -1.21 0.00 0.00 61.69 60.43 3hl2 s THR 426 Cb 0.00 -1.00 0.23 0.00 -1.51 0.00 0.00 72.50 70.22 3hl2 s THR 426 CO 0.00 0.00 1.88 0.78 -2.21 0.00 0.00 174.62 175.07 3hl2 h ASN 427 N 2.65 0.98 -2.27 8.08 -0.26 -1.86 -3.39 115.58 119.51 3hl2 h ASN 427 Ca -0.22 -0.00 -0.51 0.00 -0.56 0.00 0.00 56.30 55.01 3hl2 h ASN 427 Cb 1.17 -0.21 -0.36 0.00 -1.06 0.00 0.00 38.32 37.86 3hl2 h ASN 427 CO 0.34 0.66 -0.84 0.20 -1.06 0.00 0.00 177.43 176.73 3hl2 s ASN 428 N -5.91 1.78 0.34 5.81 -0.87 -1.26 -4.00 114.94 110.84 3hl2 s ASN 428 Ca -0.13 -2.32 -0.26 0.00 -1.57 0.00 0.00 52.86 48.58 3hl2 s ASN 428 Cb 0.18 -0.06 -0.10 0.00 -0.02 0.00 0.00 41.25 41.26 3hl2 s ASN 428 CO 0.80 -0.24 0.97 -0.47 -2.57 0.00 0.00 177.10 175.60 3hl2 s TYR 429 N 0.80 3.60 0.24 2.20 5.04 -1.26 -4.97 117.35 123.00 3hl2 s TYR 429 Ca 0.23 1.75 -0.09 0.00 -2.44 0.00 0.00 57.07 56.52 3hl2 s TYR 429 Cb -0.11 -2.97 0.38 0.00 0.35 0.00 0.00 41.96 39.61 3hl2 s TYR 429 CO -0.07 0.03 1.63 -1.35 -1.34 0.00 0.00 175.55 174.44 3hl2 h PRO 430 N 3.02 0.06 -4.73 4.97 0.11 -1.99 -3.45 132.00 129.99 3hl2 h PRO 430 Ca -0.47 -0.00 -0.28 0.00 0.11 0.00 0.00 66.00 65.35 3hl2 h PRO 430 Cb 1.20 -0.01 -0.15 0.00 0.11 0.00 0.00 31.00 32.14 3hl2 h PRO 430 CO 0.64 0.04 -0.63 0.00 -0.21 0.00 0.00 178.00 177.84 3hl2 s ALA 432 N -3.86 3.27 0.11 0.00 0.00 -1.26 -4.81 121.76 115.21 3hl2 s ALA 432 Ca 0.32 0.04 -0.01 0.00 0.00 0.00 0.00 51.96 52.31 3hl2 s ALA 432 Cb 0.07 -2.82 0.01 0.00 0.00 0.00 0.00 23.12 20.37 3hl2 s ALA 432 CO 0.09 0.18 0.16 2.48 0.00 0.00 0.00 175.76 178.68 3hl2 n TYR 433 N -0.71 -0.86 -3.87 0.00 0.18 -0.92 -0.84 117.16 110.14 3hl2 n TYR 433 Ca 0.04 -0.68 -0.20 0.00 1.88 0.00 0.00 57.90 58.95 3hl2 n TYR 433 Cb 0.53 0.19 -0.17 0.00 -0.38 0.00 0.00 39.34 39.51 3hl2 n TYR 433 CO 0.00 0.00 0.00 -1.17 -2.08 0.00 0.00 176.86 173.61 3hl2 s LEU 434 N 0.00 0.85 0.27 -3.48 2.96 0.20 -1.62 118.68 117.85 3hl2 s LEU 434 Ca 0.08 -0.04 -0.07 0.00 -0.22 0.00 0.00 54.13 53.88 3hl2 s LEU 434 Cb -0.01 -0.30 -0.06 0.00 0.50 0.00 0.00 46.19 46.32 3hl2 s LEU 434 CO 0.06 -0.15 0.56 0.20 -1.32 0.00 0.00 176.35 175.70 3hl2 s ASN 435 N 1.48 6.53 -0.17 3.68 0.02 0.14 -0.87 114.94 125.74 3hl2 s ASN 435 Ca -0.03 0.83 -0.28 0.00 -1.02 0.00 0.00 52.86 52.35 3hl2 s ASN 435 Cb -0.13 -2.19 0.10 0.00 0.02 0.00 0.00 41.25 39.05 3hl2 s ASN 435 CO -0.03 -0.15 0.87 0.00 0.02 0.00 0.00 177.10 177.81 3hl2 s ALA 436 N -1.97 -1.87 0.08 0.60 0.00 -1.04 -2.90 121.76 114.65 3hl2 s ALA 436 Ca 0.46 1.65 0.02 0.00 0.00 0.00 0.00 51.96 54.09 3hl2 s ALA 436 Cb -0.11 -0.75 -0.04 0.00 0.00 0.00 0.00 23.12 22.22 3hl2 s ALA 436 CO 0.26 -0.31 -0.07 0.00 0.00 0.00 0.00 175.76 175.63 3hl2 s ALA 437 N -0.57 0.87 -0.68 0.00 0.00 -1.26 -0.31 121.76 119.81 3hl2 s ALA 437 Ca -0.03 -1.14 -0.12 0.00 0.00 0.00 0.00 51.96 50.67 3hl2 s ALA 437 Cb -0.02 0.10 0.17 0.00 0.00 0.00 0.00 23.12 23.38 3hl2 s ALA 437 CO 0.02 -0.13 0.60 0.45 0.00 0.00 0.00 175.76 176.69 3hl2 s SER 438 N -2.48 6.27 0.33 0.00 0.15 -0.91 -5.01 113.70 112.05 3hl2 s SER 438 Ca 0.04 -2.37 0.07 0.00 0.70 0.00 0.00 55.95 54.39 3hl2 s SER 438 Cb -0.01 -2.14 -0.01 0.00 -1.71 0.00 0.00 66.02 62.15 3hl2 s SER 438 CO -0.02 -0.64 0.45 0.00 1.20 0.00 0.00 173.24 174.22 3hl2 s ALA 439 N 0.68 4.19 0.32 5.45 0.00 -1.26 -4.81 121.76 126.33 3hl2 s ALA 439 Ca 0.12 -1.46 -0.28 0.00 0.00 0.00 0.00 51.96 50.33 3hl2 s ALA 439 Cb -0.19 -1.63 -0.13 0.00 0.00 0.00 0.00 23.12 21.17 3hl2 s ALA 439 CO -0.04 -0.01 1.25 1.51 0.00 0.00 0.00 175.76 178.47 3hl2 n ILE 440 N -1.60 1.89 -0.30 0.00 3.06 -1.26 -2.26 119.36 118.88 3hl2 n ILE 440 Ca -0.01 -0.47 0.00 0.00 -2.50 0.00 0.00 62.75 59.77 3hl2 n ILE 440 Cb 0.58 -1.46 0.00 0.00 0.54 0.00 0.00 39.64 39.31 3hl2 n ILE 440 CO 0.00 0.00 0.00 0.61 -2.50 0.00 0.00 176.55 174.66 3hl2 n GLY 441 N 1.00 1.54 3.77 4.50 0.00 -1.26 -4.99 105.19 109.74 3hl2 n GLY 441 Ca 0.06 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.68 3hl2 n GLY 441 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3hl2 s MET 442 N -0.31 4.35 0.24 1.61 -2.45 -0.96 -5.04 119.30 116.76 3hl2 s MET 442 Ca 0.00 2.11 0.09 0.00 -1.25 0.00 0.00 55.69 56.64 3hl2 s MET 442 Cb 0.00 -3.04 -0.04 0.00 1.25 0.00 0.00 34.83 33.00 3hl2 s MET 442 CO 0.00 -0.15 -0.03 0.15 1.05 0.00 0.00 175.02 176.04 3hl2 s LYS 443 N -1.81 2.23 0.27 4.11 1.02 -1.26 -4.90 119.74 119.41 3hl2 s LYS 443 Ca 0.49 -1.38 0.01 0.00 0.02 0.00 0.00 55.97 55.11 3hl2 s LYS 443 Cb -0.37 -2.15 0.63 0.00 -0.52 0.00 0.00 37.83 35.41 3hl2 s LYS 443 CO 0.49 0.38 1.70 1.98 -0.92 0.00 0.00 175.35 178.99 3hl2 h MET 444 N 2.16 0.38 -0.82 1.68 1.85 -1.99 0.24 114.93 118.43 3hl2 h MET 444 Ca -0.45 -0.02 0.18 0.00 -0.61 0.00 0.00 59.70 58.80 3hl2 h MET 444 Cb 1.24 -0.09 -0.11 0.00 0.43 0.00 0.00 31.60 33.07 3hl2 h MET 444 CO 0.59 0.25 0.32 0.37 -0.40 0.00 0.00 176.91 178.04 3hl2 h GLN 445 N 0.40 0.39 -0.72 0.39 4.15 -1.99 0.10 115.11 117.83 3hl2 h GLN 445 Ca 0.51 -0.02 0.11 0.00 0.77 0.00 0.00 58.65 60.02 3hl2 h GLN 445 Cb 0.91 -0.09 -0.08 0.00 0.21 0.00 0.00 27.48 28.43 3hl2 h GLN 445 CO -0.50 0.26 0.33 -0.44 -1.93 0.00 0.00 178.83 176.54 3hl2 h ASP 446 N 0.40 0.38 -0.18 -0.69 3.32 -0.92 -0.51 116.42 118.22 3hl2 h ASP 446 Ca 0.48 0.08 -0.07 0.00 0.02 0.00 0.00 57.03 57.53 3hl2 h ASP 446 Cb 0.82 0.02 -0.00 0.00 0.22 0.00 0.00 39.33 40.39 3hl2 h ASP 446 CO -0.48 0.20 -0.17 0.58 -1.72 0.00 0.00 179.24 177.65 3hl2 h VAL 447 N 0.53 1.34 -0.40 -1.35 2.07 -0.78 -1.99 116.25 115.67 3hl2 h VAL 447 Ca 0.37 -1.33 -0.03 0.00 0.82 0.00 0.00 66.70 66.52 3hl2 h VAL 447 Cb 0.46 1.81 -0.02 0.00 -1.52 0.00 0.00 31.29 32.03 3hl2 h VAL 447 CO -0.32 0.40 0.12 0.44 0.02 0.00 0.00 177.57 178.23 3hl2 h ASP 448 N 0.08 0.59 -0.59 0.57 3.32 -0.91 -0.49 116.42 119.00 3hl2 h ASP 448 Ca 0.03 -0.21 -0.02 0.00 0.02 0.00 0.00 57.03 56.84 3hl2 h ASP 448 Cb 0.71 -0.15 -0.03 0.00 0.22 0.00 0.00 39.33 40.08 3hl2 h ASP 448 CO 0.04 0.65 0.28 -0.07 -1.72 0.00 0.00 179.24 178.42 3hl2 h LEU 449 N 0.50 0.77 0.41 1.55 3.38 -1.15 0.15 115.31 120.92 3hl2 h LEU 449 Ca 0.13 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 57.95 3hl2 h LEU 449 Cb 0.28 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 3hl2 h LEU 449 CO -0.00 0.69 -0.26 0.15 0.09 0.00 0.00 178.44 179.11 3hl2 h PHE 450 N 0.80 -0.69 -0.22 1.13 3.57 -1.13 0.13 116.94 120.53 3hl2 h PHE 450 Ca 0.20 -0.01 0.02 0.00 3.53 0.00 0.00 57.97 61.72 3hl2 h PHE 450 Cb 0.13 0.25 -0.02 0.00 2.79 0.00 0.00 35.95 39.09 3hl2 h PHE 450 CO 0.00 -0.40 0.07 0.82 -2.23 0.00 0.00 178.31 176.57 3hl2 h ILE 451 N -0.65 0.93 -0.80 1.41 1.08 -0.90 0.38 117.51 118.96 3hl2 h ILE 451 Ca -0.04 -0.06 0.04 0.00 -0.39 0.00 0.00 64.86 64.41 3hl2 h ILE 451 Cb 0.54 0.75 -0.05 0.00 -3.07 0.00 0.00 36.82 34.99 3hl2 h ILE 451 CO 0.04 0.03 0.50 0.50 -0.69 0.00 0.00 178.15 178.53 3hl2 h LYS 452 N 0.17 0.93 0.06 2.37 3.64 -0.59 -0.77 116.57 122.37 3hl2 h LYS 452 Ca 0.10 -0.06 -0.24 0.00 -1.27 0.00 0.00 60.65 59.18 3hl2 h LYS 452 Cb 0.07 -0.21 -0.00 0.00 -0.41 0.00 0.00 32.23 31.68 3hl2 h LYS 452 CO -0.11 0.61 -1.07 0.00 -2.27 0.00 0.00 179.45 176.61 3hl2 h ARG 453 N 0.96 0.28 -0.55 1.90 3.08 -0.21 -3.02 114.38 116.81 3hl2 h ARG 453 Ca 0.33 -0.38 -0.07 0.00 0.07 0.00 0.00 59.98 59.93 3hl2 h ARG 453 Cb 0.07 0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.23 3hl2 h ARG 453 CO -0.13 1.12 0.09 1.25 -1.07 0.00 0.00 179.97 181.22 3hl2 h LEU 454 N 0.12 0.88 -0.46 3.04 5.85 0.02 -2.20 115.31 122.56 3hl2 h LEU 454 Ca -0.09 -0.26 0.04 0.00 0.84 0.00 0.00 57.88 58.40 3hl2 h LEU 454 Cb 1.76 -0.23 -0.04 0.00 0.37 0.00 0.00 40.66 42.52 3hl2 h LEU 454 CO 0.17 0.92 0.23 -0.78 -0.34 0.00 0.00 178.44 178.64 3hl2 h ASP 455 N 0.81 0.33 -0.80 1.25 1.82 -1.17 -1.48 116.42 117.17 3hl2 h ASP 455 Ca 0.17 0.03 -0.02 0.00 -0.39 0.00 0.00 57.03 56.81 3hl2 h ASP 455 Cb 0.42 -0.04 -0.04 0.00 0.68 0.00 0.00 39.33 40.36 3hl2 h ASP 455 CO 0.01 0.23 0.41 0.03 -1.61 0.00 0.00 179.24 178.31 3hl2 h ARG 456 N 0.45 1.14 -0.61 0.28 3.08 -1.37 -1.29 114.38 116.08 3hl2 h ARG 456 Ca 0.20 -0.16 -0.05 0.00 0.07 0.00 0.00 59.98 60.05 3hl2 h ARG 456 Cb 0.11 -0.21 -0.03 0.00 0.08 0.00 0.00 29.97 29.92 3hl2 h ARG 456 CO -0.14 0.87 0.19 0.00 -1.07 0.00 0.00 179.97 179.81 3hl2 h LEU 458 N 0.87 0.08 -1.00 0.00 3.38 -1.00 -1.21 115.31 116.42 3hl2 h LEU 458 Ca 0.20 -0.10 0.16 0.00 0.09 0.00 0.00 57.88 58.22 3hl2 h LEU 458 Cb 0.29 -0.02 -0.10 0.00 0.09 0.00 0.00 40.66 40.93 3hl2 h LEU 458 CO -0.01 0.16 0.62 0.11 0.09 0.00 0.00 178.44 179.41 3hl2 h LYS 459 N -0.01 0.85 0.15 1.13 1.57 -1.00 -1.57 116.57 117.68 3hl2 h LYS 459 Ca 0.02 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.74 3hl2 h LYS 459 Cb 0.10 -0.19 0.00 0.00 0.08 0.00 0.00 32.23 32.22 3hl2 h LYS 459 CO -0.00 0.56 -0.07 0.00 -0.57 0.00 0.00 179.45 179.37 3hl2 h ALA 460 N 1.59 -0.20 -0.12 3.86 0.00 -0.51 -2.78 119.26 121.10 3hl2 h ALA 460 Ca 0.54 -0.06 0.03 0.00 0.00 0.00 0.00 54.91 55.42 3hl2 h ALA 460 Cb 0.69 0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.56 3hl2 h ALA 460 CO -0.33 -0.59 0.10 0.28 0.00 0.00 0.00 179.25 178.71 3hl2 h VAL 461 N -0.24 0.81 -0.02 0.00 2.07 -0.29 -2.65 116.25 115.93 3hl2 h VAL 461 Ca -0.02 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.50 3hl2 h VAL 461 Cb 0.19 0.93 -0.00 0.00 -1.52 0.00 0.00 31.29 30.89 3hl2 h VAL 461 CO 0.03 0.00 0.00 0.03 0.02 0.00 0.00 177.57 177.66 3hl2 h ARG 462 N 0.00 0.03 -0.72 1.57 2.47 -1.08 -3.29 114.38 113.36 3hl2 h ARG 462 Ca 0.06 -0.01 0.07 0.00 -1.26 0.00 0.00 59.98 58.84 3hl2 h ARG 462 Cb 0.25 -0.00 -0.09 0.00 -1.65 0.00 0.00 29.97 28.47 3hl2 h ARG 462 CO -0.00 0.27 -0.50 0.87 0.56 0.00 0.00 179.97 181.17 3hl2 h LYS 463 N -0.22 -0.09 -0.03 0.04 6.56 -1.40 -3.52 116.57 117.90 3hl2 h LYS 463 Ca 0.01 0.01 0.00 0.00 -1.06 0.00 0.00 60.65 59.60 3hl2 h LYS 463 Cb 0.26 0.02 0.00 0.00 -0.57 0.00 0.00 32.23 31.94 3hl2 h LYS 463 CO 0.00 -0.06 0.00 -0.85 -2.06 0.00 0.00 179.45 176.48