#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ht6 s ASN 2 N 0.00 -0.05 0.38 7.83 2.20 -1.26 -5.03 114.94 119.00 3ht6 s ASN 2 Ca 0.00 -0.96 0.06 0.00 -0.94 0.00 0.00 52.86 51.03 3ht6 s ASN 2 Cb 0.00 0.79 0.78 0.00 -2.00 0.00 0.00 41.25 40.82 3ht6 s ASN 2 CO 0.00 -1.53 1.98 -0.29 -2.94 0.00 0.00 177.10 174.33 3ht6 h ILE 3 N 2.01 1.04 -0.14 0.54 6.09 -1.97 -0.00 117.51 125.07 3ht6 h ILE 3 Ca -0.27 -0.24 -0.02 0.00 -1.37 0.00 0.00 64.86 62.96 3ht6 h ILE 3 Cb 1.25 0.28 -0.01 0.00 0.47 0.00 0.00 36.82 38.81 3ht6 h ILE 3 CO 0.34 0.13 -0.01 -0.26 -3.07 0.00 0.00 178.15 175.28 3ht6 h PHE 4 N 0.70 0.28 -0.36 2.19 -1.00 -1.99 -0.85 116.94 115.92 3ht6 h PHE 4 Ca 0.27 -0.05 -0.07 0.00 2.81 0.00 0.00 57.97 60.93 3ht6 h PHE 4 Cb 0.19 -0.07 -0.02 0.00 3.61 0.00 0.00 35.95 39.66 3ht6 h PHE 4 CO -0.00 0.49 -0.09 0.93 -1.61 0.00 0.00 178.31 178.04 3ht6 h GLU 5 N -0.01 0.60 0.11 1.51 5.08 -1.83 -0.45 114.58 119.60 3ht6 h GLU 5 Ca 0.04 -0.17 -0.01 0.00 -1.00 0.00 0.00 59.36 58.22 3ht6 h GLU 5 Cb 0.39 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 29.57 3ht6 h GLU 5 CO 0.01 0.69 -0.05 1.98 -1.00 0.00 0.00 179.01 180.63 3ht6 h MET 6 N 0.56 -0.15 0.00 2.33 4.05 -0.88 -2.33 114.93 118.51 3ht6 h MET 6 Ca 0.10 0.01 -0.08 0.00 -0.28 0.00 0.00 59.70 59.46 3ht6 h MET 6 Cb 0.49 0.03 -0.01 0.00 -0.80 0.00 0.00 31.60 31.31 3ht6 h MET 6 CO 0.03 0.16 -0.38 -0.07 0.23 0.00 0.00 176.91 176.89 3ht6 h LEU 7 N -0.47 0.00 -0.75 3.39 3.38 -1.06 -2.18 115.31 117.62 3ht6 h LEU 7 Ca -0.02 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.90 3ht6 h LEU 7 Cb 0.38 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.10 3ht6 h LEU 7 CO 0.03 0.38 0.27 -0.09 0.09 0.00 0.00 178.44 179.12 3ht6 h ARG 8 N 0.00 1.15 -0.23 1.13 9.65 -0.96 0.14 114.38 125.27 3ht6 h ARG 8 Ca -0.00 -0.22 -0.01 0.00 -1.10 0.00 0.00 59.98 58.65 3ht6 h ARG 8 Cb 0.68 -0.18 -0.01 0.00 -1.39 0.00 0.00 29.97 29.07 3ht6 h ARG 8 CO 0.05 0.95 0.12 0.82 2.80 0.00 0.00 179.97 184.71 3ht6 h ILE 9 N 1.10 1.13 0.00 1.20 2.04 -1.05 -0.86 117.51 121.07 3ht6 h ILE 9 Ca 0.25 -0.35 -0.15 0.00 1.00 0.00 0.00 64.86 65.60 3ht6 h ILE 9 Cb 0.25 0.95 -0.02 0.00 -0.74 0.00 0.00 36.82 37.26 3ht6 h ILE 9 CO -0.02 0.12 -0.74 0.44 0.00 0.00 0.00 178.15 177.96 3ht6 h ASP 10 N 0.24 0.00 0.00 1.72 3.32 -1.09 -3.32 116.42 117.29 3ht6 h ASP 10 Ca 0.08 0.00 -0.10 0.00 0.02 0.00 0.00 57.03 57.03 3ht6 h ASP 10 Cb 0.09 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 39.63 3ht6 h ASP 10 CO -0.01 0.74 -1.95 -0.62 -1.72 0.00 0.00 179.24 175.67 3ht6 n GLU 11 N -3.50 0.76 -0.13 3.56 -0.58 0.47 -5.08 120.64 116.14 3ht6 n GLU 11 Ca -0.00 -0.12 0.02 0.00 -0.42 0.00 0.00 57.16 56.64 3ht6 n GLU 11 Cb 0.76 -1.44 -0.00 0.00 -0.57 0.00 0.00 31.44 30.18 3ht6 n GLU 11 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3ht6 n GLY 12 N 1.60 -1.89 2.75 0.62 0.00 -0.33 -4.40 105.19 103.55 3ht6 n GLY 12 Ca -0.11 -1.34 -0.19 0.00 0.00 0.00 0.00 46.02 44.37 3ht6 n GLY 12 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3ht6 s LEU 13 N 0.00 0.04 -0.03 0.99 2.96 -1.26 -4.23 118.68 117.15 3ht6 s LEU 13 Ca 0.00 0.05 0.02 0.00 -0.22 0.00 0.00 54.13 53.98 3ht6 s LEU 13 Cb 0.00 0.11 0.01 0.00 0.50 0.00 0.00 46.19 46.81 3ht6 s LEU 13 CO 0.00 -0.27 -0.08 -0.13 -1.32 0.00 0.00 176.35 174.55 3ht6 s ARG 14 N 2.24 0.94 0.00 1.98 0.52 -0.59 -5.01 118.95 119.03 3ht6 s ARG 14 Ca 0.04 -0.25 0.23 0.00 -0.52 0.00 0.00 55.73 55.22 3ht6 s ARG 14 Cb -0.13 -0.88 0.06 0.00 0.52 0.00 0.00 34.95 34.52 3ht6 s ARG 14 CO -0.06 0.06 1.11 1.28 0.02 0.00 0.00 175.30 177.70 3ht6 n LEU 15 N 3.49 0.97 -4.59 2.53 4.77 -1.26 0.05 117.00 122.96 3ht6 n LEU 15 Ca -0.20 -0.37 -0.30 0.00 -0.03 0.00 0.00 56.01 55.11 3ht6 n LEU 15 Cb 0.53 -0.08 -0.10 0.00 -2.33 0.00 0.00 43.42 41.45 3ht6 n LEU 15 CO 0.24 0.22 -0.41 -0.54 -1.33 0.00 0.00 177.39 175.58 3ht6 s LYS 16 N -2.92 2.25 0.11 3.23 1.02 -1.26 -0.99 119.74 121.19 3ht6 s LYS 16 Ca 0.11 -0.95 -0.36 0.00 0.02 0.00 0.00 55.97 54.79 3ht6 s LYS 16 Cb 0.17 -2.36 -0.16 0.00 -0.52 0.00 0.00 37.83 34.96 3ht6 s LYS 16 CO 0.77 0.53 1.44 -0.89 -0.92 0.00 0.00 175.35 176.28 3ht6 n ILE 17 N 0.86 0.01 -4.26 2.17 5.41 -0.85 -4.75 119.36 117.95 3ht6 n ILE 17 Ca -0.13 -0.00 -0.14 0.00 1.00 0.00 0.00 62.75 63.47 3ht6 n ILE 17 Cb 0.52 -1.11 -0.10 0.00 -0.71 0.00 0.00 39.64 38.24 3ht6 n ILE 17 CO 0.00 0.00 0.00 -0.72 0.00 0.00 0.00 176.55 175.83 3ht6 s TYR 18 N 0.69 1.31 -0.15 1.39 -0.85 -0.27 -4.96 117.35 114.52 3ht6 s TYR 18 Ca 0.82 -1.16 -0.12 0.00 -0.52 0.00 0.00 57.07 56.10 3ht6 s TYR 18 Cb -0.84 -0.74 -0.05 0.00 0.38 0.00 0.00 41.96 40.71 3ht6 s TYR 18 CO 0.43 -0.35 0.24 0.15 -1.52 0.00 0.00 175.55 174.50 3ht6 s LYS 19 N -4.01 4.05 0.10 -3.49 1.02 -1.26 0.13 119.74 116.28 3ht6 s LYS 19 Ca 0.32 0.01 -0.02 0.00 0.02 0.00 0.00 55.97 56.30 3ht6 s LYS 19 Cb 0.07 -3.36 0.02 0.00 -0.52 0.00 0.00 37.83 34.05 3ht6 s LYS 19 CO 0.09 0.40 0.10 -0.40 -0.92 0.00 0.00 175.35 174.62 3ht6 n ASP 20 N 3.08 -0.76 0.29 2.83 5.68 0.45 -4.79 116.55 123.34 3ht6 n ASP 20 Ca -0.15 -0.70 0.18 0.00 -0.50 0.00 0.00 54.79 53.62 3ht6 n ASP 20 Cb 0.53 -0.08 0.85 0.00 -1.14 0.00 0.00 41.12 41.27 3ht6 n ASP 20 CO 0.00 0.00 0.00 0.71 -1.33 0.00 0.00 177.20 176.58 3ht6 h THR 21 N -1.44 0.13 -0.07 2.12 1.35 -1.99 -1.27 112.91 111.75 3ht6 h THR 21 Ca -0.03 -0.39 0.00 0.00 -0.55 0.00 0.00 66.41 65.44 3ht6 h THR 21 Cb 0.10 1.33 0.00 0.00 -1.73 0.00 0.00 68.15 67.85 3ht6 h THR 21 CO 0.02 0.03 0.00 -0.62 -0.25 0.00 0.00 175.52 174.71 3ht6 n GLU 22 N -3.21 2.10 -0.53 4.72 -0.58 -1.26 -4.95 120.64 116.94 3ht6 n GLU 22 Ca -0.01 -1.61 0.00 0.00 -0.42 0.00 0.00 57.16 55.12 3ht6 n GLU 22 Cb 0.23 -1.47 0.00 0.00 -0.57 0.00 0.00 31.44 29.63 3ht6 n GLU 22 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 3ht6 n GLY 23 N 1.30 0.72 3.82 0.62 0.00 -0.48 -5.07 105.19 106.10 3ht6 n GLY 23 Ca 0.16 -0.10 -0.37 0.00 0.00 0.00 0.00 46.02 45.71 3ht6 n GLY 23 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3ht6 s TYR 24 N -2.00 3.57 0.22 1.61 4.12 -1.26 -4.69 117.35 118.92 3ht6 s TYR 24 Ca 0.00 0.62 -0.32 0.00 0.02 0.00 0.00 57.07 57.39 3ht6 s TYR 24 Cb 0.00 -2.13 -0.12 0.00 -1.52 0.00 0.00 41.96 38.19 3ht6 s TYR 24 CO 0.00 0.55 1.70 0.66 0.02 0.00 0.00 175.55 178.48 3ht6 n TYR 25 N 2.51 2.77 -3.89 2.71 4.02 -1.20 -0.41 117.16 123.67 3ht6 n TYR 25 Ca -0.16 0.08 -0.09 0.00 -0.01 0.00 0.00 57.90 57.72 3ht6 n TYR 25 Cb 0.53 -2.66 -0.07 0.00 -0.02 0.00 0.00 39.34 37.12 3ht6 n TYR 25 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 176.86 176.84 3ht6 s THR 26 N 0.95 0.10 0.16 -0.72 2.01 0.12 -1.05 115.64 117.22 3ht6 s THR 26 Ca 0.73 -1.23 -0.13 0.00 0.31 0.00 0.00 61.69 61.37 3ht6 s THR 26 Cb -0.51 -1.56 0.01 0.00 0.01 0.00 0.00 72.50 70.46 3ht6 s THR 26 CO 0.35 -0.46 0.37 -0.51 -0.69 0.00 0.00 174.62 173.68 3ht6 s ILE 27 N -3.91 0.06 0.00 1.82 2.07 -0.50 -1.11 121.20 119.63 3ht6 s ILE 27 Ca 0.10 -1.03 0.00 0.00 -1.41 0.00 0.00 60.65 58.31 3ht6 s ILE 27 Cb 0.04 -1.59 0.00 0.00 0.13 0.00 0.00 42.46 41.04 3ht6 s ILE 27 CO -0.06 -0.28 0.00 0.61 -1.91 0.00 0.00 174.94 173.30 3ht6 n GLY 28 N -0.24 1.41 2.98 1.50 0.00 0.11 -1.25 105.19 109.70 3ht6 n GLY 28 Ca -0.10 -0.51 -0.39 0.00 0.00 0.00 0.00 46.02 45.01 3ht6 n GLY 28 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 3ht6 n ILE 29 N 0.00 4.24 -2.41 -0.61 5.41 -1.26 -1.55 119.36 123.18 3ht6 n ILE 29 Ca 0.00 -5.56 -0.14 0.00 1.00 0.00 0.00 62.75 58.05 3ht6 n ILE 29 Cb 0.00 -2.23 0.00 0.00 -0.71 0.00 0.00 39.64 36.70 3ht6 n ILE 29 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 3ht6 n GLY 30 N 1.66 -0.19 3.53 7.39 0.00 -1.24 -4.87 105.19 111.48 3ht6 n GLY 30 Ca 0.26 -0.26 -0.42 0.00 0.00 0.00 0.00 46.02 45.60 3ht6 n GLY 30 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3ht6 s HIS 31 N -2.78 2.48 0.12 1.61 5.04 -0.38 -4.93 115.29 116.44 3ht6 s HIS 31 Ca 0.06 -0.05 -0.31 0.00 -1.54 0.00 0.00 55.06 53.22 3ht6 s HIS 31 Cb -0.03 -4.48 -0.09 0.00 0.04 0.00 0.00 32.58 28.03 3ht6 s HIS 31 CO 0.07 -1.81 1.59 -1.17 -2.34 0.00 0.00 174.74 171.08 3ht6 s LEU 32 N 5.05 4.37 -0.19 8.88 2.96 -1.26 -1.41 118.68 137.07 3ht6 s LEU 32 Ca 0.34 2.53 -0.11 0.00 -0.22 0.00 0.00 54.13 56.67 3ht6 s LEU 32 Cb -0.10 -3.58 -0.20 0.00 0.50 0.00 0.00 46.19 42.81 3ht6 s LEU 32 CO 0.17 -0.84 0.11 0.18 -1.32 0.00 0.00 176.35 174.65 3ht6 n LEU 33 N 4.72 2.36 -3.57 -0.68 4.77 -0.21 -4.96 117.00 119.43 3ht6 n LEU 33 Ca 0.15 0.24 -0.07 0.00 -0.03 0.00 0.00 56.01 56.29 3ht6 n LEU 33 Cb 0.40 -0.99 -0.03 0.00 -2.33 0.00 0.00 43.42 40.46 3ht6 n LEU 33 CO 0.62 0.65 0.87 0.28 -1.33 0.00 0.00 177.39 178.48 3ht6 s THR 34 N -2.49 0.00 -1.98 -5.08 -1.32 -1.19 -4.89 115.64 98.70 3ht6 s THR 34 Ca -0.29 0.00 0.26 0.00 -1.21 0.00 0.00 61.69 60.45 3ht6 s THR 34 Cb 0.08 -1.00 0.29 0.00 -1.51 0.00 0.00 72.50 70.36 3ht6 s THR 34 CO 0.65 0.00 1.54 0.29 -2.21 0.00 0.00 174.62 174.88 3ht6 n LYS 35 N 0.20 1.10 -2.04 7.08 5.02 -1.26 -3.24 118.16 125.02 3ht6 n LYS 35 Ca -0.05 -0.70 -0.41 0.00 -2.02 0.00 0.00 58.31 55.13 3ht6 n LYS 35 Cb 0.59 -1.49 -0.02 0.00 -0.02 0.00 0.00 35.03 34.09 3ht6 n LYS 35 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 3ht6 s SER 36 N -2.38 6.68 0.00 4.39 0.15 -1.26 -4.92 113.70 116.37 3ht6 s SER 36 Ca 0.27 2.65 0.17 0.00 0.70 0.00 0.00 55.95 59.73 3ht6 s SER 36 Cb 0.19 -2.63 1.01 0.00 -1.71 0.00 0.00 66.02 62.89 3ht6 s SER 36 CO 0.48 -0.67 1.48 -0.81 1.20 0.00 0.00 173.24 174.92 3ht6 n PRO 37 N 2.18 0.72 -2.85 5.44 -0.04 -1.26 -4.72 135.00 134.48 3ht6 n PRO 37 Ca 0.06 0.00 -0.43 0.00 -0.04 0.00 0.00 63.50 63.09 3ht6 n PRO 37 Cb 0.41 -1.37 -0.04 0.00 -0.04 0.00 0.00 33.50 32.45 3ht6 n PRO 37 CO 0.00 0.00 0.00 0.34 -0.04 0.00 0.00 175.50 175.80 3ht6 s ASP 38 N -1.81 6.49 0.35 3.54 -1.08 -1.26 -4.92 116.67 117.98 3ht6 s ASP 38 Ca 0.25 0.10 0.04 0.00 -0.52 0.00 0.00 52.55 52.42 3ht6 s ASP 38 Cb 0.12 -2.44 0.68 0.00 -1.46 0.00 0.00 42.92 39.82 3ht6 s ASP 38 CO 0.20 -1.02 1.97 0.25 0.52 0.00 0.00 175.17 177.09 3ht6 h LEU 39 N 10.47 0.71 -0.96 -1.34 5.85 -2.00 -2.00 115.31 126.03 3ht6 h LEU 39 Ca -0.24 -0.00 -0.05 0.00 0.84 0.00 0.00 57.88 58.42 3ht6 h LEU 39 Cb 1.08 -0.16 -0.03 0.00 0.37 0.00 0.00 40.66 41.92 3ht6 h LEU 39 CO 1.01 0.48 0.16 0.78 -0.34 0.00 0.00 178.44 180.53 3ht6 h ASN 40 N 0.82 0.86 -0.71 1.25 2.35 -1.98 -0.38 115.58 117.79 3ht6 h ASN 40 Ca 0.29 -0.15 -0.04 0.00 -0.55 0.00 0.00 56.30 55.85 3ht6 h ASN 40 Cb 0.12 -0.22 -0.03 0.00 0.05 0.00 0.00 38.32 38.24 3ht6 h ASN 40 CO -0.09 0.83 0.29 0.00 -1.65 0.00 0.00 177.43 176.81 3ht6 h ALA 41 N 1.29 0.92 -0.50 -0.83 0.00 -1.78 -1.33 119.26 117.03 3ht6 h ALA 41 Ca 0.19 -0.18 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 3ht6 h ALA 41 Cb 0.30 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 3ht6 h ALA 41 CO -0.00 0.54 0.29 0.00 0.00 0.00 0.00 179.25 180.07 3ht6 h ALA 42 N 1.14 0.64 -0.52 0.00 0.00 -0.92 -1.24 119.26 118.35 3ht6 h ALA 42 Ca 0.24 -0.08 -0.05 0.00 0.00 0.00 0.00 54.91 55.02 3ht6 h ALA 42 Cb 0.20 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 3ht6 h ALA 42 CO -0.02 0.14 0.10 0.87 0.00 0.00 0.00 179.25 180.33 3ht6 h LYS 43 N 0.66 0.81 -0.38 0.00 1.57 -0.85 -0.86 116.57 117.51 3ht6 h LYS 43 Ca 0.18 -0.17 -0.06 0.00 -1.87 0.00 0.00 60.65 58.72 3ht6 h LYS 43 Cb 0.02 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.20 3ht6 h LYS 43 CO -0.03 0.75 -0.00 1.03 -0.57 0.00 0.00 179.45 180.62 3ht6 h SER 44 N 0.77 0.67 -0.94 0.86 0.87 -1.01 -1.22 113.55 113.55 3ht6 h SER 44 Ca 0.17 -0.31 0.04 0.00 -1.23 0.00 0.00 61.79 60.45 3ht6 h SER 44 Cb 0.33 -0.18 -0.06 0.00 -0.44 0.00 0.00 62.40 62.05 3ht6 h SER 44 CO 0.00 0.82 0.61 -0.33 -0.53 0.00 0.00 176.83 177.40 3ht6 h GLU 45 N 0.51 1.14 -0.07 2.24 4.39 -0.82 -0.41 114.58 121.56 3ht6 h GLU 45 Ca 0.11 -0.07 -0.00 0.00 0.34 0.00 0.00 59.36 59.74 3ht6 h GLU 45 Cb 0.48 -0.26 -0.00 0.00 -0.10 0.00 0.00 28.75 28.87 3ht6 h GLU 45 CO 0.02 0.76 0.03 1.25 -1.16 0.00 0.00 179.01 179.91 3ht6 h LEU 46 N 1.18 0.08 -0.91 1.33 5.85 -0.89 -0.19 115.31 121.76 3ht6 h LEU 46 Ca 0.37 -0.10 0.01 0.00 0.84 0.00 0.00 57.88 59.00 3ht6 h LEU 46 Cb 0.01 -0.02 -0.05 0.00 0.37 0.00 0.00 40.66 40.97 3ht6 h LEU 46 CO -0.12 0.17 0.60 0.44 -0.34 0.00 0.00 178.44 179.19 3ht6 h ASP 47 N -0.00 1.05 -0.72 1.25 3.32 -0.88 -0.95 116.42 119.48 3ht6 h ASP 47 Ca 0.02 -0.03 0.01 0.00 0.02 0.00 0.00 57.03 57.05 3ht6 h ASP 47 Cb 0.10 -0.26 -0.04 0.00 0.22 0.00 0.00 39.33 39.35 3ht6 h ASP 47 CO -0.00 0.76 0.47 0.50 -1.72 0.00 0.00 179.24 179.25 3ht6 h LYS 48 N 1.23 0.96 -0.15 3.56 3.64 -0.87 0.12 116.57 125.06 3ht6 h LYS 48 Ca 0.33 -0.06 -0.16 0.00 -1.27 0.00 0.00 60.65 59.49 3ht6 h LYS 48 Cb -0.14 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 31.46 3ht6 h LYS 48 CO -0.07 0.64 -0.57 0.00 -2.27 0.00 0.00 179.45 177.18 3ht6 h ALA 49 N 1.26 0.74 0.01 5.00 0.00 -0.26 -3.29 119.26 122.72 3ht6 h ALA 49 Ca 0.26 -0.52 -0.32 0.00 0.00 0.00 0.00 54.91 54.34 3ht6 h ALA 49 Cb -0.10 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 17.55 3ht6 h ALA 49 CO -0.06 0.70 -1.91 -0.89 0.00 0.00 0.00 179.25 177.09 3ht6 n ILE 50 N -3.94 1.56 -0.43 0.00 2.08 -0.43 -5.00 119.36 113.20 3ht6 n ILE 50 Ca -0.03 -0.80 0.00 0.00 0.56 0.00 0.00 62.75 62.48 3ht6 n ILE 50 Cb 0.61 -0.92 0.00 0.00 -0.75 0.00 0.00 39.64 38.58 3ht6 n ILE 50 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 3ht6 n GLY 51 N 1.64 0.74 3.51 7.39 0.00 0.42 -5.07 105.19 113.82 3ht6 n GLY 51 Ca -0.22 -0.42 -0.09 0.00 0.00 0.00 0.00 46.02 45.29 3ht6 n GLY 51 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 3ht6 s ARG 52 N -0.83 1.38 -0.52 1.61 1.70 -1.16 -5.05 118.95 116.08 3ht6 s ARG 52 Ca 0.00 -1.01 -0.28 0.00 -0.47 0.00 0.00 55.73 53.97 3ht6 s ARG 52 Cb 0.00 0.48 0.01 0.00 -0.57 0.00 0.00 34.95 34.87 3ht6 s ARG 52 CO 0.00 -0.57 1.49 -0.80 -1.08 0.00 0.00 175.30 174.34 3ht6 s ASN 53 N -2.92 6.05 0.06 -2.89 -0.87 -1.26 -4.36 114.94 108.75 3ht6 s ASN 53 Ca 0.14 0.48 0.22 0.00 -1.57 0.00 0.00 52.86 52.13 3ht6 s ASN 53 Cb -0.00 -2.54 -0.10 0.00 -0.02 0.00 0.00 41.25 38.58 3ht6 s ASN 53 CO 0.01 -1.73 0.85 0.00 -2.57 0.00 0.00 177.10 173.66 3ht6 n ASN 55 N -2.18 -1.36 -0.02 0.00 3.02 -1.26 -1.92 115.26 111.54 3ht6 n ASN 55 Ca -0.00 -1.07 -0.00 0.00 -0.03 0.00 0.00 54.58 53.48 3ht6 n ASN 55 Cb 0.50 -2.60 -0.00 0.00 -0.61 0.00 0.00 39.78 37.07 3ht6 n ASN 55 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3ht6 n GLY 56 N -1.79 0.42 2.93 7.41 0.00 -1.26 -5.01 105.19 107.88 3ht6 n GLY 56 Ca -0.14 -0.05 -0.18 0.00 0.00 0.00 0.00 46.02 45.66 3ht6 n GLY 56 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3ht6 s VAL 57 N -1.83 0.49 0.36 1.61 1.01 -0.81 -2.01 120.40 119.23 3ht6 s VAL 57 Ca 0.00 -0.18 0.04 0.00 0.00 0.00 0.00 61.98 61.83 3ht6 s VAL 57 Cb 0.00 -0.47 -0.05 0.00 0.00 0.00 0.00 36.38 35.86 3ht6 s VAL 57 CO 0.00 0.18 0.07 0.27 0.00 0.00 0.00 175.10 175.61 3ht6 s ILE 58 N 0.37 1.11 0.47 2.22 -4.36 -0.16 -4.75 121.20 116.10 3ht6 s ILE 58 Ca -0.04 -2.00 0.03 0.00 -0.26 0.00 0.00 60.65 58.38 3ht6 s ILE 58 Cb -0.08 -2.66 0.01 0.00 1.25 0.00 0.00 42.46 40.98 3ht6 s ILE 58 CO -0.00 0.00 0.66 0.42 0.24 0.00 0.00 174.94 176.26 3ht6 s THR 59 N -3.20 3.26 0.18 8.37 -4.23 -1.26 -4.79 115.64 113.97 3ht6 s THR 59 Ca 0.31 -0.75 -0.12 0.00 -1.18 0.00 0.00 61.69 59.95 3ht6 s THR 59 Cb 0.07 -3.17 0.09 0.00 1.34 0.00 0.00 72.50 70.83 3ht6 s THR 59 CO 0.15 -0.10 1.81 0.50 -0.54 0.00 0.00 174.62 176.44 3ht6 h LYS 60 N 0.40 0.84 -0.79 3.99 3.64 -1.99 0.62 116.57 123.27 3ht6 h LYS 60 Ca -0.43 -0.08 -0.01 0.00 -1.27 0.00 0.00 60.65 58.85 3ht6 h LYS 60 Cb 1.28 -0.17 -0.04 0.00 -0.41 0.00 0.00 32.23 32.89 3ht6 h LYS 60 CO 0.52 0.61 0.44 -0.44 -2.27 0.00 0.00 179.45 178.31 3ht6 h ASP 61 N 0.83 0.98 -0.67 4.20 3.45 -1.99 0.61 116.42 123.84 3ht6 h ASP 61 Ca 0.22 -0.09 -0.08 0.00 0.43 0.00 0.00 57.03 57.50 3ht6 h ASP 61 Cb -0.00 -0.25 -0.03 0.00 -0.56 0.00 0.00 39.33 38.49 3ht6 h ASP 61 CO -0.04 0.79 0.09 -0.33 -1.57 0.00 0.00 179.24 178.18 3ht6 h GLU 62 N 1.10 1.12 -0.74 3.56 5.08 -1.78 -0.66 114.58 122.25 3ht6 h GLU 62 Ca 0.28 -0.31 -0.00 0.00 -1.00 0.00 0.00 59.36 58.33 3ht6 h GLU 62 Cb 0.02 -0.12 -0.04 0.00 0.50 0.00 0.00 28.75 29.10 3ht6 h GLU 62 CO -0.05 1.03 0.46 0.00 -1.00 0.00 0.00 179.01 179.46 3ht6 h ALA 63 N 1.04 0.94 -0.14 3.43 0.00 -0.22 -1.88 119.26 122.44 3ht6 h ALA 63 Ca 0.20 -0.08 -0.11 0.00 0.00 0.00 0.00 54.91 54.92 3ht6 h ALA 63 Cb 0.47 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 3ht6 h ALA 63 CO 0.02 0.40 -0.41 0.93 0.00 0.00 0.00 179.25 180.18 3ht6 h GLU 64 N 1.01 0.31 -0.18 0.00 5.08 -0.63 -1.29 114.58 118.89 3ht6 h GLU 64 Ca 0.27 -0.15 -0.02 0.00 -1.00 0.00 0.00 59.36 58.45 3ht6 h GLU 64 Cb -0.06 -0.00 -0.01 0.00 0.50 0.00 0.00 28.75 29.18 3ht6 h GLU 64 CO -0.05 0.68 0.02 -0.22 -1.00 0.00 0.00 179.01 178.43 3ht6 h LYS 65 N 0.26 0.31 -0.98 2.33 3.64 -0.73 -1.03 116.57 120.37 3ht6 h LYS 65 Ca 0.02 -0.09 0.03 0.00 -1.27 0.00 0.00 60.65 59.34 3ht6 h LYS 65 Cb 0.84 -0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 32.58 3ht6 h LYS 65 CO 0.07 0.49 0.64 -0.07 -2.27 0.00 0.00 179.45 178.31 3ht6 h LEU 66 N 0.08 1.09 -0.32 5.20 3.38 -1.20 -2.17 115.31 121.37 3ht6 h LEU 66 Ca 0.05 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.01 3ht6 h LEU 66 Cb 0.34 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 3ht6 h LEU 66 CO 0.01 0.76 0.19 0.15 0.09 0.00 0.00 178.44 179.64 3ht6 h PHE 67 N 1.27 0.42 -0.52 1.13 3.57 -0.90 0.54 116.94 122.44 3ht6 h PHE 67 Ca 0.38 0.00 -0.01 0.00 3.53 0.00 0.00 57.97 61.87 3ht6 h PHE 67 Cb -0.05 -0.14 -0.02 0.00 2.79 0.00 0.00 35.95 38.53 3ht6 h PHE 67 CO -0.00 0.30 0.29 -0.97 -2.23 0.00 0.00 178.31 175.70 3ht6 h ASN 68 N 0.41 0.65 -0.63 0.41 -0.73 -0.97 -0.32 115.58 114.41 3ht6 h ASN 68 Ca 0.11 -0.09 0.01 0.00 1.87 0.00 0.00 56.30 58.21 3ht6 h ASN 68 Cb 0.00 -0.17 -0.03 0.00 0.27 0.00 0.00 38.32 38.39 3ht6 h ASN 68 CO -0.02 0.55 0.41 1.56 -0.37 0.00 0.00 177.43 179.55 3ht6 h GLN 69 N 0.70 0.80 -0.27 6.67 4.20 -1.02 -1.99 115.11 124.20 3ht6 h GLN 69 Ca 0.18 -0.05 -0.04 0.00 0.06 0.00 0.00 58.65 58.80 3ht6 h GLN 69 Cb 0.04 -0.18 -0.01 0.00 0.30 0.00 0.00 27.48 27.63 3ht6 h GLN 69 CO -0.03 0.53 0.00 -0.44 -0.67 0.00 0.00 178.83 178.22 3ht6 h ASP 70 N 0.82 0.47 -0.14 1.46 3.32 -0.38 -0.86 116.42 121.10 3ht6 h ASP 70 Ca 0.24 -0.30 -0.00 0.00 0.02 0.00 0.00 57.03 56.98 3ht6 h ASP 70 Cb -0.06 -0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.36 3ht6 h ASP 70 CO -0.07 0.66 0.08 0.58 -1.72 0.00 0.00 179.24 178.77 3ht6 h VAL 71 N 0.26 1.10 -0.37 -1.35 2.07 -1.06 -1.44 116.25 115.46 3ht6 h VAL 71 Ca 0.08 -0.28 0.04 0.00 0.82 0.00 0.00 66.70 67.36 3ht6 h VAL 71 Cb 0.42 1.03 -0.04 0.00 -1.52 0.00 0.00 31.29 31.18 3ht6 h VAL 71 CO 0.01 0.09 0.13 -0.78 0.02 0.00 0.00 177.57 177.05 3ht6 h ASP 72 N 0.12 0.15 -0.12 0.57 3.58 -1.31 -1.77 116.42 117.63 3ht6 h ASP 72 Ca 0.05 0.04 -0.06 0.00 0.42 0.00 0.00 57.03 57.48 3ht6 h ASP 72 Cb 0.08 0.02 -0.02 0.00 1.72 0.00 0.00 39.33 41.14 3ht6 h ASP 72 CO -0.01 0.12 -0.09 0.00 -2.88 0.00 0.00 179.24 176.38 3ht6 h ALA 73 N 1.23 1.34 -0.13 -0.78 0.00 -1.04 -0.62 119.26 119.27 3ht6 h ALA 73 Ca 0.17 -0.24 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 3ht6 h ALA 73 Cb 0.14 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 3ht6 h ALA 73 CO -0.17 0.45 0.05 0.00 0.00 0.00 0.00 179.25 179.58 3ht6 h ALA 74 N 1.49 0.17 -0.13 0.00 0.00 -0.75 0.05 119.26 120.09 3ht6 h ALA 74 Ca 0.08 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.89 3ht6 h ALA 74 Cb 0.42 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 3ht6 h ALA 74 CO 0.02 -0.24 0.07 0.28 0.00 0.00 0.00 179.25 179.38 3ht6 h VAL 75 N 0.04 1.01 -0.33 0.00 2.07 -1.01 -1.88 116.25 116.16 3ht6 h VAL 75 Ca 0.04 -0.05 -0.02 0.00 0.82 0.00 0.00 66.70 67.49 3ht6 h VAL 75 Cb 0.18 0.84 -0.02 0.00 -1.52 0.00 0.00 31.29 30.78 3ht6 h VAL 75 CO -0.00 0.03 0.11 0.03 0.02 0.00 0.00 177.57 177.75 3ht6 h ARG 76 N 0.16 0.47 -0.43 1.57 2.47 -0.95 -1.76 114.38 115.91 3ht6 h ARG 76 Ca 0.05 -0.06 -0.05 0.00 -1.26 0.00 0.00 59.98 58.66 3ht6 h ARG 76 Cb -0.00 -0.09 -0.02 0.00 -1.65 0.00 0.00 29.97 28.21 3ht6 h ARG 76 CO -0.02 0.42 0.08 0.78 0.56 0.00 0.00 179.97 181.78 3ht6 h GLY 77 N 0.66 0.76 0.46 0.04 0.00 -0.69 -2.37 103.07 101.93 3ht6 h GLY 77 Ca 0.11 -0.50 0.06 0.00 0.00 0.00 0.00 47.33 47.01 3ht6 h GLY 77 CO -0.01 0.46 0.00 -2.22 0.00 0.00 0.00 176.54 174.78 3ht6 h ILE 78 N 0.57 0.75 0.00 2.60 2.04 -0.52 -1.88 117.51 121.07 3ht6 h ILE 78 Ca 0.13 -0.03 -0.03 0.00 1.00 0.00 0.00 64.86 65.92 3ht6 h ILE 78 Cb 0.36 0.64 -0.00 0.00 -0.74 0.00 0.00 36.82 37.07 3ht6 h ILE 78 CO 0.01 0.02 -0.17 -0.07 0.00 0.00 0.00 178.15 177.94 3ht6 h LEU 79 N 0.10 0.00 -0.22 1.44 3.38 -1.25 -1.23 115.31 117.54 3ht6 h LEU 79 Ca 0.17 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.14 3ht6 h LEU 79 Cb 0.23 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.98 3ht6 h LEU 79 CO -0.28 0.17 -0.27 0.54 0.09 0.00 0.00 178.44 178.69 3ht6 n ARG 80 N -3.95 0.45 -3.36 1.13 1.74 -0.87 -4.81 116.66 106.99 3ht6 n ARG 80 Ca -0.02 -0.22 -0.42 0.00 -0.77 0.00 0.00 57.85 56.41 3ht6 n ARG 80 Cb 0.25 -1.50 -0.09 0.00 -1.02 0.00 0.00 32.46 30.11 3ht6 n ARG 80 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 3ht6 s ASN 81 N -2.70 6.18 0.59 0.55 3.84 -0.47 -4.96 114.94 117.97 3ht6 s ASN 81 Ca 0.20 -0.61 0.29 0.00 0.21 0.00 0.00 52.86 52.95 3ht6 s ASN 81 Cb 0.19 -2.21 1.78 0.00 -0.55 0.00 0.00 41.25 40.46 3ht6 s ASN 81 CO 0.57 -0.50 2.22 0.00 -2.79 0.00 0.00 177.10 176.59 3ht6 h ALA 82 N 8.65 1.60 0.00 1.71 0.00 -1.87 -0.23 119.26 129.12 3ht6 h ALA 82 Ca -0.27 -0.00 -0.13 0.00 0.00 0.00 0.00 54.91 54.51 3ht6 h ALA 82 Cb 1.12 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.89 3ht6 h ALA 82 CO 0.76 -0.08 -0.73 0.87 0.00 0.00 0.00 179.25 180.08 3ht6 h LYS 83 N 0.00 0.00 0.00 0.00 1.57 -1.92 -3.39 116.57 112.83 3ht6 h LYS 83 Ca 0.02 0.00 -0.38 0.00 -1.87 0.00 0.00 60.65 58.42 3ht6 h LYS 83 Cb 0.13 0.00 -0.07 0.00 0.08 0.00 0.00 32.23 32.37 3ht6 h LYS 83 CO -0.00 0.51 -2.42 1.28 -0.57 0.00 0.00 179.45 178.25 3ht6 n LEU 84 N -3.17 1.98 -0.05 2.94 4.77 -0.47 -4.60 117.00 118.41 3ht6 n LEU 84 Ca -0.00 -0.08 -0.08 0.00 -0.03 0.00 0.00 56.01 55.82 3ht6 n LEU 84 Cb 0.78 -0.45 -0.02 0.00 -2.33 0.00 0.00 43.42 41.40 3ht6 n LEU 84 CO 0.42 0.79 0.82 0.50 -1.33 0.00 0.00 177.39 178.58 3ht6 h LYS 85 N 0.00 -0.02 -0.97 3.23 3.64 -1.09 -0.05 116.57 121.31 3ht6 h LYS 85 Ca -0.56 0.00 0.05 0.00 -1.27 0.00 0.00 60.65 58.87 3ht6 h LYS 85 Cb 2.02 0.00 -0.06 0.00 -0.41 0.00 0.00 32.23 33.78 3ht6 h LYS 85 CO -0.04 -0.01 0.63 -1.00 -2.27 0.00 0.00 179.45 176.76 3ht6 h PRO 86 N -0.02 1.15 -0.16 1.90 0.13 -1.82 0.14 132.00 133.32 3ht6 h PRO 86 Ca 0.11 -0.07 -0.06 0.00 -0.87 0.00 0.00 66.00 65.11 3ht6 h PRO 86 Cb 0.18 -0.26 -0.00 0.00 0.13 0.00 0.00 31.00 31.05 3ht6 h PRO 86 CO -0.23 0.76 -0.15 0.28 -0.23 0.00 0.00 178.00 178.43 3ht6 h VAL 87 N 1.18 1.34 -0.21 1.56 2.07 -1.72 -2.25 116.25 118.22 3ht6 h VAL 87 Ca 0.40 -1.30 0.03 0.00 0.82 0.00 0.00 66.70 66.65 3ht6 h VAL 87 Cb 0.08 1.84 -0.03 0.00 -1.52 0.00 0.00 31.29 31.66 3ht6 h VAL 87 CO -0.14 0.38 0.03 0.22 0.02 0.00 0.00 177.57 178.08 3ht6 h TYR 88 N 0.02 0.04 0.00 1.57 3.20 -0.63 -1.97 116.97 119.20 3ht6 h TYR 88 Ca 0.03 0.01 0.00 0.00 3.14 0.00 0.00 58.73 61.91 3ht6 h TYR 88 Cb 0.68 0.01 0.00 0.00 1.54 0.00 0.00 36.73 38.96 3ht6 h TYR 88 CO 0.08 0.00 0.00 -0.44 -1.64 0.00 0.00 178.16 176.16 3ht6 h ASP 89 N 0.10 0.00 1.50 -2.11 3.32 -0.72 -2.08 116.42 116.43 3ht6 h ASP 89 Ca 0.10 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.15 3ht6 h ASP 89 Cb 0.10 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.65 3ht6 h ASP 89 CO -0.14 0.00 0.00 0.77 -1.72 0.00 0.00 179.24 178.15 3ht6 h SER 90 N 0.00 0.00 -3.59 6.45 4.64 -0.73 -3.47 113.55 116.85 3ht6 h SER 90 Ca 0.00 0.00 -0.50 0.00 -0.47 0.00 0.00 61.79 60.82 3ht6 h SER 90 Cb 0.38 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.46 3ht6 h SER 90 CO 0.00 0.00 0.05 -0.76 -0.87 0.00 0.00 176.83 175.25 3ht6 s LEU 91 N -5.96 3.94 0.95 5.97 1.43 -0.78 -5.07 118.68 119.16 3ht6 s LEU 91 Ca 0.05 1.07 -0.12 0.00 -1.03 0.00 0.00 54.13 54.09 3ht6 s LEU 91 Cb 0.07 -3.91 0.16 0.00 0.03 0.00 0.00 46.19 42.54 3ht6 s LEU 91 CO 0.60 -0.30 1.10 1.51 0.23 0.00 0.00 176.35 179.48 3ht6 s ASP 92 N -2.94 3.05 0.29 2.29 1.47 -1.26 -4.80 116.67 114.77 3ht6 s ASP 92 Ca 0.50 1.27 0.01 0.00 1.18 0.00 0.00 52.55 55.51 3ht6 s ASP 92 Cb -0.10 -1.94 0.43 0.00 -0.34 0.00 0.00 42.92 40.97 3ht6 s ASP 92 CO 0.28 -2.88 1.79 0.00 0.68 0.00 0.00 175.17 175.04 3ht6 h ALA 93 N -1.71 1.19 -0.02 2.11 0.00 -1.97 -0.63 119.26 118.22 3ht6 h ALA 93 Ca -0.52 -0.26 -0.00 0.00 0.00 0.00 0.00 54.91 54.12 3ht6 h ALA 93 Cb 1.31 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.94 3ht6 h ALA 93 CO 0.57 0.53 -0.00 0.28 0.00 0.00 0.00 179.25 180.62 3ht6 h VAL 94 N 0.60 1.28 -0.26 0.00 2.07 -1.93 -2.41 116.25 115.59 3ht6 h VAL 94 Ca 0.12 -0.83 -0.02 0.00 0.82 0.00 0.00 66.70 66.78 3ht6 h VAL 94 Cb 0.46 1.80 -0.01 0.00 -1.52 0.00 0.00 31.29 32.01 3ht6 h VAL 94 CO 0.02 0.22 0.07 0.03 0.02 0.00 0.00 177.57 177.93 3ht6 h ARG 95 N -0.30 0.37 -0.54 1.57 3.08 -1.76 -1.08 114.38 115.72 3ht6 h ARG 95 Ca 0.01 -0.05 0.04 0.00 0.07 0.00 0.00 59.98 60.04 3ht6 h ARG 95 Cb 0.36 -0.07 -0.03 0.00 0.08 0.00 0.00 29.97 30.31 3ht6 h ARG 95 CO 0.00 0.35 0.36 0.00 -1.07 0.00 0.00 179.97 179.61 3ht6 h ARG 96 N 0.37 0.58 -0.77 0.04 3.08 -0.94 -1.45 114.38 115.30 3ht6 h ARG 96 Ca 0.09 -0.04 -0.04 0.00 0.07 0.00 0.00 59.98 60.07 3ht6 h ARG 96 Cb 0.14 -0.13 -0.03 0.00 0.08 0.00 0.00 29.97 30.03 3ht6 h ARG 96 CO -0.00 0.39 0.33 0.00 -1.07 0.00 0.00 179.97 179.61 3ht6 h ALA 98 N 1.17 1.13 -0.20 0.00 0.00 -1.11 -0.48 119.26 119.76 3ht6 h ALA 98 Ca 0.26 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.06 3ht6 h ALA 98 Cb 0.19 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 3ht6 h ALA 98 CO -0.02 0.61 0.13 0.00 0.00 0.00 0.00 179.25 179.96 3ht6 h ALA 99 N 1.27 0.25 -0.83 0.00 0.00 -0.94 -0.51 119.26 118.50 3ht6 h ALA 99 Ca 0.31 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 55.19 3ht6 h ALA 99 Cb -0.01 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.67 3ht6 h ALA 99 CO -0.05 -0.28 0.42 0.82 0.00 0.00 0.00 179.25 180.16 3ht6 h ILE 100 N 0.26 1.25 0.38 0.00 2.04 -0.87 -1.67 117.51 118.89 3ht6 h ILE 100 Ca 0.07 -0.67 -0.01 0.00 1.00 0.00 0.00 64.86 65.25 3ht6 h ILE 100 Cb -0.02 0.17 -0.00 0.00 -0.74 0.00 0.00 36.82 36.22 3ht6 h ILE 100 CO -0.02 0.29 -0.21 -1.13 0.00 0.00 0.00 178.15 177.08 3ht6 h ASN 101 N 1.17 -0.51 -0.38 1.72 -0.73 -0.83 -0.01 115.58 116.01 3ht6 h ASN 101 Ca 0.29 0.03 0.08 0.00 1.87 0.00 0.00 56.30 58.56 3ht6 h ASN 101 Cb 0.08 0.15 -0.07 0.00 0.27 0.00 0.00 38.32 38.74 3ht6 h ASN 101 CO -0.04 -0.34 -0.12 -0.61 -0.37 0.00 0.00 177.43 175.95 3ht6 h GLN 102 N -0.55 -0.03 -0.43 6.67 4.15 -0.89 -1.69 115.11 122.34 3ht6 h GLN 102 Ca -0.04 0.00 -0.08 0.00 0.77 0.00 0.00 58.65 59.30 3ht6 h GLN 102 Cb 0.44 0.01 -0.02 0.00 0.21 0.00 0.00 27.48 28.12 3ht6 h GLN 102 CO 0.06 -0.02 -0.06 -0.39 -1.93 0.00 0.00 178.83 176.49 3ht6 h VAL 103 N -0.03 1.24 -0.98 2.39 -1.51 -1.15 -1.13 116.25 115.09 3ht6 h VAL 103 Ca 0.18 -1.06 0.06 0.00 -1.23 0.00 0.00 66.70 64.65 3ht6 h VAL 103 Cb 0.31 0.98 -0.06 0.00 -2.13 0.00 0.00 31.29 30.39 3ht6 h VAL 103 CO -0.41 0.36 0.63 0.15 -1.23 0.00 0.00 177.57 177.08 3ht6 h PHE 104 N 0.67 1.17 0.05 5.19 3.57 -0.51 0.26 116.94 127.34 3ht6 h PHE 104 Ca 0.12 0.03 -0.08 0.00 3.53 0.00 0.00 57.97 61.57 3ht6 h PHE 104 Cb 0.50 -0.39 0.01 0.00 2.79 0.00 0.00 35.95 38.87 3ht6 h PHE 104 CO 0.02 0.62 -0.35 0.37 -2.23 0.00 0.00 178.31 176.75 3ht6 h GLN 105 N 1.16 0.15 0.00 1.11 4.15 -0.71 -3.39 115.11 117.58 3ht6 h GLN 105 Ca 0.41 -0.23 0.00 0.00 0.77 0.00 0.00 58.65 59.61 3ht6 h GLN 105 Cb 0.13 0.08 0.00 0.00 0.21 0.00 0.00 27.48 27.90 3ht6 h GLN 105 CO -0.15 1.07 -1.20 -1.33 -1.93 0.00 0.00 178.83 175.29 3ht6 n MET 106 N -4.41 1.27 -0.27 1.69 0.00 -0.48 -5.11 117.12 109.80 3ht6 n MET 106 Ca -0.11 -0.07 0.03 0.00 0.00 0.00 0.00 57.70 57.55 3ht6 n MET 106 Cb 0.61 -1.29 -0.01 0.00 0.00 0.00 0.00 33.22 32.53 3ht6 n MET 106 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 3ht6 n GLY 107 N 1.48 -2.23 0.26 3.03 0.00 0.92 -2.63 105.19 106.02 3ht6 n GLY 107 Ca 0.00 -1.41 0.06 0.00 0.00 0.00 0.00 46.02 44.67 3ht6 n GLY 107 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3ht6 h GLU 108 N -0.26 0.12 -0.38 1.61 5.08 -1.95 -1.68 114.58 117.12 3ht6 h GLU 108 Ca -0.02 -0.01 -0.10 0.00 -1.00 0.00 0.00 59.36 58.22 3ht6 h GLU 108 Cb 0.26 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.47 3ht6 h GLU 108 CO 0.01 0.13 -0.18 1.79 -1.00 0.00 0.00 179.01 179.76 3ht6 h THR 109 N 0.12 1.26 -0.49 1.13 1.35 -1.97 -1.24 112.91 113.07 3ht6 h THR 109 Ca 0.03 -1.26 -0.08 0.00 -0.55 0.00 0.00 66.41 64.55 3ht6 h THR 109 Cb 0.09 1.17 -0.02 0.00 -1.73 0.00 0.00 68.15 67.66 3ht6 h THR 109 CO 0.00 0.42 -0.02 1.23 -0.25 0.00 0.00 175.52 176.90 3ht6 h GLY 110 N 0.98 0.96 2.00 5.82 0.00 -1.15 -3.00 103.07 108.67 3ht6 h GLY 110 Ca 0.10 -0.72 0.00 0.00 0.00 0.00 0.00 47.33 46.71 3ht6 h GLY 110 CO 0.05 0.66 0.00 -2.08 0.00 0.00 0.00 176.54 175.17 3ht6 h VAL 111 N 0.75 0.00 -0.21 4.60 2.07 -1.10 -2.85 116.25 119.51 3ht6 h VAL 111 Ca 0.14 -0.52 0.06 0.00 0.82 0.00 0.00 66.70 67.20 3ht6 h VAL 111 Cb 0.55 1.46 -0.01 0.00 -1.52 0.00 0.00 31.29 31.77 3ht6 h VAL 111 CO 0.03 0.00 0.16 0.00 0.02 0.00 0.00 177.57 177.78 3ht6 h ALA 112 N 2.08 2.14 0.00 1.67 0.00 -1.08 -0.48 119.26 123.59 3ht6 h ALA 112 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3ht6 h ALA 112 Cb 0.56 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.36 3ht6 h ALA 112 CO 0.00 -0.26 0.00 0.41 0.00 0.00 0.00 179.25 179.40 3ht6 n GLY 113 N -1.55 -1.10 1.57 0.00 0.00 -1.07 -3.80 105.19 99.23 3ht6 n GLY 113 Ca 0.02 -0.16 0.03 0.00 0.00 0.00 0.00 46.02 45.91 3ht6 n GLY 113 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3ht6 n PHE 114 N -1.16 1.78 -0.26 1.61 3.01 -0.19 -4.70 117.46 117.55 3ht6 n PHE 114 Ca 0.17 -0.97 0.06 0.00 1.01 0.00 0.00 57.45 57.73 3ht6 n PHE 114 Cb 0.17 -0.50 0.17 0.00 -0.01 0.00 0.00 39.48 39.31 3ht6 n PHE 114 CO 0.00 0.00 0.00 1.15 1.01 0.00 0.00 176.76 178.92 3ht6 h THR 115 N 2.74 0.33 -0.56 4.37 2.02 -1.72 0.70 112.91 120.79 3ht6 h THR 115 Ca 0.09 -0.04 -0.11 0.00 0.77 0.00 0.00 66.41 67.12 3ht6 h THR 115 Cb 1.90 0.21 -0.02 0.00 -1.74 0.00 0.00 68.15 68.50 3ht6 h THR 115 CO 0.48 0.02 -0.09 0.78 0.37 0.00 0.00 175.52 177.08 3ht6 h ASN 116 N 0.11 1.05 -0.30 4.18 2.35 -1.93 -1.28 115.58 119.75 3ht6 h ASN 116 Ca 0.43 -0.34 -0.02 0.00 -0.55 0.00 0.00 56.30 55.82 3ht6 h ASN 116 Cb 0.77 -0.28 -0.01 0.00 0.05 0.00 0.00 38.32 38.84 3ht6 h ASN 116 CO -0.67 1.14 0.11 0.28 -1.65 0.00 0.00 177.43 176.64 3ht6 h SER 117 N 0.93 0.42 -0.77 5.81 0.02 -1.63 -2.61 113.55 115.73 3ht6 h SER 117 Ca 0.15 -0.18 0.03 0.00 -0.84 0.00 0.00 61.79 60.95 3ht6 h SER 117 Cb 0.66 -0.11 -0.05 0.00 0.14 0.00 0.00 62.40 63.04 3ht6 h SER 117 CO 0.05 0.49 0.49 -0.07 -1.14 0.00 0.00 176.83 176.65 3ht6 h LEU 118 N 0.33 0.81 -0.22 5.07 4.07 -0.68 0.49 115.31 125.17 3ht6 h LEU 118 Ca 0.10 -0.00 0.04 0.00 0.08 0.00 0.00 57.88 58.10 3ht6 h LEU 118 Cb 0.21 -0.18 -0.04 0.00 1.08 0.00 0.00 40.66 41.73 3ht6 h LEU 118 CO -0.01 0.56 -0.02 -0.09 -1.08 0.00 0.00 178.44 177.80 3ht6 h ARG 119 N 0.96 0.04 -0.84 1.13 2.43 -1.16 0.42 114.38 117.36 3ht6 h ARG 119 Ca 0.31 -0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.46 3ht6 h ARG 119 Cb 0.01 -0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 29.52 3ht6 h ARG 119 CO -0.11 0.03 0.45 0.52 -1.51 0.00 0.00 179.97 179.34 3ht6 h MET 120 N 0.04 1.18 -0.55 0.20 2.86 -0.99 -1.00 114.93 116.66 3ht6 h MET 120 Ca 0.11 -0.14 0.00 0.00 -2.06 0.00 0.00 59.70 57.61 3ht6 h MET 120 Cb 0.15 -0.23 -0.03 0.00 0.06 0.00 0.00 31.60 31.55 3ht6 h MET 120 CO -0.20 0.87 0.35 -0.07 1.06 0.00 0.00 176.91 178.91 3ht6 h LEU 121 N 1.18 0.65 -1.22 1.22 3.38 -0.54 -1.33 115.31 118.66 3ht6 h LEU 121 Ca 0.29 -0.04 -0.03 0.00 0.09 0.00 0.00 57.88 58.19 3ht6 h LEU 121 Cb 0.04 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.60 3ht6 h LEU 121 CO -0.05 0.50 0.20 -0.61 0.09 0.00 0.00 178.44 178.57 3ht6 h GLN 122 N 0.74 0.74 0.00 1.13 4.15 -0.40 -0.90 115.11 120.57 3ht6 h GLN 122 Ca 0.20 -0.11 0.00 0.00 0.77 0.00 0.00 58.65 59.51 3ht6 h GLN 122 Cb -0.04 -0.13 0.00 0.00 0.21 0.00 0.00 27.48 27.52 3ht6 h GLN 122 CO -0.04 0.62 0.00 1.04 -1.93 0.00 0.00 178.83 178.52 3ht6 n GLN 123 N -4.34 0.19 -3.13 1.69 6.02 -0.43 -4.90 117.38 112.48 3ht6 n GLN 123 Ca 0.04 0.09 -0.23 0.00 -0.01 0.00 0.00 57.00 56.89 3ht6 n GLN 123 Cb 0.16 -1.50 0.04 0.00 1.02 0.00 0.00 30.24 29.96 3ht6 n GLN 123 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.06 177.68 3ht6 n LYS 124 N -1.37 -5.06 -2.88 -1.09 5.02 -0.34 -4.92 118.16 107.52 3ht6 n LYS 124 Ca 0.08 0.86 -0.44 0.00 -2.02 0.00 0.00 58.31 56.79 3ht6 n LYS 124 Cb 0.21 -5.73 0.00 0.00 -0.02 0.00 0.00 35.03 29.50 3ht6 n LYS 124 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 3ht6 n ARG 125 N -4.11 3.63 -0.16 1.97 1.74 -0.58 -4.89 116.66 114.25 3ht6 n ARG 125 Ca -0.09 -3.99 -0.10 0.00 -0.77 0.00 0.00 57.85 52.90 3ht6 n ARG 125 Cb 0.61 -2.84 -0.00 0.00 -1.02 0.00 0.00 32.46 29.21 3ht6 n ARG 125 CO 0.00 0.00 0.00 -1.49 -1.52 0.00 0.00 177.63 174.62 3ht6 h TRP 126 N 6.43 0.90 -0.36 -1.55 -0.00 -1.89 0.90 115.95 120.40 3ht6 h TRP 126 Ca 0.29 -0.16 -0.13 0.00 -0.00 0.00 0.00 58.89 58.90 3ht6 h TRP 126 Cb 0.77 -0.24 -0.01 0.00 -0.00 0.00 0.00 29.16 29.69 3ht6 h TRP 126 CO 1.06 0.86 -0.28 -0.44 -0.00 0.00 0.00 178.44 179.64 3ht6 h ASP 127 N 0.68 0.86 -0.52 -3.49 5.19 -1.90 -1.17 116.42 116.08 3ht6 h ASP 127 Ca 0.13 -0.45 -0.01 0.00 -0.62 0.00 0.00 57.03 56.08 3ht6 h ASP 127 Cb 0.50 -0.24 -0.02 0.00 0.18 0.00 0.00 39.33 39.74 3ht6 h ASP 127 CO 0.02 1.13 0.27 -0.33 -3.12 0.00 0.00 179.24 177.21 3ht6 h GLU 128 N 0.61 0.73 -0.20 3.56 5.08 -1.93 -1.19 114.58 121.24 3ht6 h GLU 128 Ca 0.07 -0.10 0.03 0.00 -1.00 0.00 0.00 59.36 58.36 3ht6 h GLU 128 Cb 0.86 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.94 3ht6 h GLU 128 CO 0.07 0.59 0.01 0.00 -1.00 0.00 0.00 179.01 178.68 3ht6 h ALA 129 N 1.11 0.18 -0.81 3.43 0.00 -0.75 -0.95 119.26 121.47 3ht6 h ALA 129 Ca 0.18 0.05 0.03 0.00 0.00 0.00 0.00 54.91 55.18 3ht6 h ALA 129 Cb 0.08 0.08 -0.05 0.00 0.00 0.00 0.00 17.79 17.90 3ht6 h ALA 129 CO -0.03 -0.42 0.52 0.00 0.00 0.00 0.00 179.25 179.32 3ht6 h ALA 130 N 1.17 1.07 -0.48 0.00 0.00 -0.91 0.17 119.26 120.28 3ht6 h ALA 130 Ca 0.09 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.93 3ht6 h ALA 130 Cb 0.11 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 3ht6 h ALA 130 CO -0.15 0.33 0.14 0.28 0.00 0.00 0.00 179.25 179.85 3ht6 h VAL 131 N 1.01 1.23 -0.36 0.00 2.07 -0.95 -2.93 116.25 116.32 3ht6 h VAL 131 Ca 0.33 -0.79 -0.11 0.00 0.82 0.00 0.00 66.70 66.96 3ht6 h VAL 131 Cb 0.02 0.83 -0.01 0.00 -1.52 0.00 0.00 31.29 30.61 3ht6 h VAL 131 CO -0.12 0.28 -0.21 -1.13 0.02 0.00 0.00 177.57 176.42 3ht6 h ASN 132 N 0.65 0.70 -0.16 0.57 -0.73 -0.46 -2.85 115.58 113.30 3ht6 h ASN 132 Ca 0.15 -0.24 -0.02 0.00 1.87 0.00 0.00 56.30 58.06 3ht6 h ASN 132 Cb 0.29 -0.19 -0.01 0.00 0.27 0.00 0.00 38.32 38.68 3ht6 h ASN 132 CO -0.00 0.90 0.05 -0.07 -0.37 0.00 0.00 177.43 177.94 3ht6 h LEU 133 N 0.62 0.30 -0.05 0.34 3.38 -0.52 -2.36 115.31 117.01 3ht6 h LEU 133 Ca 0.09 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.03 3ht6 h LEU 133 Cb 0.69 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.36 3ht6 h LEU 133 CO 0.05 0.32 0.00 0.00 0.09 0.00 0.00 178.44 178.90 3ht6 n ALA 134 N -2.49 2.24 -1.99 1.53 0.00 -1.08 -4.17 120.51 114.55 3ht6 n ALA 134 Ca 0.00 -0.01 -0.42 0.00 0.00 0.00 0.00 53.44 53.01 3ht6 n ALA 134 Cb 0.16 -1.47 0.00 0.00 0.00 0.00 0.00 19.45 18.15 3ht6 n ALA 134 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 3ht6 n LYS 135 N -2.29 3.26 -3.56 0.00 5.02 -0.89 -4.67 118.16 115.03 3ht6 n LYS 135 Ca 0.05 -3.02 -0.16 0.00 -2.02 0.00 0.00 58.31 53.17 3ht6 n LYS 135 Cb 0.42 -3.10 -0.06 0.00 -0.02 0.00 0.00 35.03 32.27 3ht6 n LYS 135 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 3ht6 s SER 136 N 2.06 -0.54 0.21 4.39 1.04 -1.26 -5.02 113.70 114.58 3ht6 s SER 136 Ca 0.44 0.46 -0.09 0.00 0.48 0.00 0.00 55.95 57.24 3ht6 s SER 136 Cb 0.12 0.50 0.29 0.00 0.10 0.00 0.00 66.02 67.03 3ht6 s SER 136 CO -0.05 -0.64 1.77 -0.09 0.98 0.00 0.00 173.24 175.21 3ht6 h ARG 137 N 3.00 0.50 -0.55 4.02 2.43 -1.93 -2.01 114.38 119.84 3ht6 h ARG 137 Ca -0.29 -0.03 0.09 0.00 -0.81 0.00 0.00 59.98 58.94 3ht6 h ARG 137 Cb 1.17 -0.11 -0.11 0.00 -0.42 0.00 0.00 29.97 30.50 3ht6 h ARG 137 CO 0.40 0.33 -0.39 2.35 -1.51 0.00 0.00 179.97 181.15 3ht6 h TRP 138 N 0.51 -1.11 -0.33 2.20 7.01 -1.95 0.09 115.95 122.37 3ht6 h TRP 138 Ca 0.32 0.08 -0.03 0.00 2.11 0.00 0.00 58.89 61.37 3ht6 h TRP 138 Cb 0.34 0.57 -0.01 0.00 -2.10 0.00 0.00 29.16 27.95 3ht6 h TRP 138 CO -0.13 -0.41 0.11 -0.92 -2.79 0.00 0.00 178.44 174.30 3ht6 h TYR 139 N -0.22 0.53 -0.15 2.65 3.20 -1.75 -1.72 116.97 119.51 3ht6 h TYR 139 Ca 0.20 -0.05 -0.07 0.00 3.14 0.00 0.00 58.73 61.95 3ht6 h TYR 139 Cb 0.56 -0.15 -0.01 0.00 1.54 0.00 0.00 36.73 38.66 3ht6 h TYR 139 CO -0.66 0.53 -0.21 -0.91 -1.64 0.00 0.00 178.16 175.26 3ht6 h ASN 140 N 0.38 0.25 0.39 -2.11 4.21 -0.61 -1.02 115.58 117.08 3ht6 h ASN 140 Ca 0.11 -0.07 -0.32 0.00 1.21 0.00 0.00 56.30 57.23 3ht6 h ASN 140 Cb 0.24 -0.07 -0.00 0.00 -1.12 0.00 0.00 38.32 37.37 3ht6 h ASN 140 CO -0.00 0.48 -1.58 1.56 -1.29 0.00 0.00 177.43 176.59 3ht6 h GLN 141 N 0.24 0.28 -2.11 0.81 1.08 -0.91 -3.39 115.11 111.11 3ht6 h GLN 141 Ca 0.04 -0.48 -0.58 0.00 -1.45 0.00 0.00 58.65 56.18 3ht6 h GLN 141 Cb 0.51 0.18 -0.41 0.00 -0.05 0.00 0.00 27.48 27.72 3ht6 h GLN 141 CO 0.03 1.15 -0.81 0.25 -0.95 0.00 0.00 178.83 178.51 3ht6 n THR 142 N -3.48 1.13 -0.07 -0.54 -2.24 -0.66 -4.98 114.28 103.44 3ht6 n THR 142 Ca -0.18 -4.74 -0.06 0.00 -2.27 0.00 0.00 64.05 56.79 3ht6 n THR 142 Cb 1.05 -2.00 0.12 0.00 -2.10 0.00 0.00 70.33 67.40 3ht6 n THR 142 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 3ht6 h PRO 143 N 4.06 0.72 -0.31 -0.78 0.13 -1.39 -0.29 132.00 134.14 3ht6 h PRO 143 Ca 0.15 -0.27 -0.17 0.00 -0.87 0.00 0.00 66.00 64.83 3ht6 h PRO 143 Cb 0.75 -0.04 -0.00 0.00 0.13 0.00 0.00 31.00 31.83 3ht6 h PRO 143 CO 0.68 0.87 -0.49 -0.44 -0.23 0.00 0.00 178.00 178.39 3ht6 h ASP 144 N 0.64 0.94 -0.16 1.44 3.32 -1.94 0.66 116.42 121.32 3ht6 h ASP 144 Ca 0.09 -0.48 -0.05 0.00 0.02 0.00 0.00 57.03 56.62 3ht6 h ASP 144 Cb 0.69 -0.27 -0.00 0.00 0.22 0.00 0.00 39.33 39.97 3ht6 h ASP 144 CO 0.05 1.26 -0.11 -0.09 -1.72 0.00 0.00 179.24 178.64 3ht6 h ARG 145 N 0.67 0.35 -0.88 3.56 2.43 -1.95 -2.93 114.38 115.63 3ht6 h ARG 145 Ca 0.03 -0.17 0.03 0.00 -0.81 0.00 0.00 59.98 59.07 3ht6 h ARG 145 Cb 1.08 -0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 30.58 3ht6 h ARG 145 CO 0.11 0.69 0.58 0.00 -1.51 0.00 0.00 179.97 179.84 3ht6 h ALA 146 N 0.65 1.44 -0.81 2.80 0.00 -0.97 -1.26 119.26 121.10 3ht6 h ALA 146 Ca 0.03 -0.04 0.04 0.00 0.00 0.00 0.00 54.91 54.94 3ht6 h ALA 146 Cb 0.61 -0.31 -0.05 0.00 0.00 0.00 0.00 17.79 18.03 3ht6 h ALA 146 CO 0.03 0.47 0.51 -0.22 0.00 0.00 0.00 179.25 180.04 3ht6 h LYS 147 N 1.10 0.94 -0.25 0.00 3.64 -0.78 0.18 116.57 121.40 3ht6 h LYS 147 Ca 0.35 -0.06 -0.04 0.00 -1.27 0.00 0.00 60.65 59.64 3ht6 h LYS 147 Cb 0.02 -0.21 -0.01 0.00 -0.41 0.00 0.00 32.23 31.61 3ht6 h LYS 147 CO -0.10 0.62 0.02 0.00 -2.27 0.00 0.00 179.45 177.71 3ht6 h ARG 148 N 0.97 0.43 -0.51 1.90 3.08 -1.11 -0.61 114.38 118.54 3ht6 h ARG 148 Ca 0.34 -0.13 -0.05 0.00 0.07 0.00 0.00 59.98 60.21 3ht6 h ARG 148 Cb 0.08 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.07 3ht6 h ARG 148 CO -0.14 0.59 0.13 0.28 -1.07 0.00 0.00 179.97 179.75 3ht6 h VAL 149 N 0.22 1.24 -0.51 2.04 2.07 -0.82 -1.96 116.25 118.53 3ht6 h VAL 149 Ca 0.07 -0.84 -0.03 0.00 0.82 0.00 0.00 66.70 66.72 3ht6 h VAL 149 Cb 0.38 0.82 -0.02 0.00 -1.52 0.00 0.00 31.29 30.95 3ht6 h VAL 149 CO 0.01 0.31 0.21 0.40 0.02 0.00 0.00 177.57 178.51 3ht6 h ILE 150 N 0.70 1.21 -0.95 4.57 2.04 -0.60 -0.50 117.51 123.98 3ht6 h ILE 150 Ca 0.16 -0.65 0.09 0.00 1.00 0.00 0.00 64.86 65.45 3ht6 h ILE 150 Cb 0.33 0.69 -0.07 0.00 -0.74 0.00 0.00 36.82 37.03 3ht6 h ILE 150 CO 0.00 0.25 0.61 0.74 0.00 0.00 0.00 178.15 179.75 3ht6 h THR 151 N 0.68 1.01 -0.33 -0.27 2.02 -0.89 0.15 112.91 115.30 3ht6 h THR 151 Ca 0.17 -0.35 -0.03 0.00 0.77 0.00 0.00 66.41 66.97 3ht6 h THR 151 Cb 0.19 -0.10 -0.01 0.00 -1.74 0.00 0.00 68.15 66.49 3ht6 h THR 151 CO -0.01 0.19 0.08 0.74 0.37 0.00 0.00 175.52 176.88 3ht6 h THR 152 N 1.02 1.22 -0.74 3.16 2.02 -0.75 -0.85 112.91 118.00 3ht6 h THR 152 Ca 0.43 -0.73 -0.01 0.00 0.77 0.00 0.00 66.41 66.87 3ht6 h THR 152 Cb 0.31 1.08 -0.04 0.00 -1.74 0.00 0.00 68.15 67.76 3ht6 h THR 152 CO -0.19 0.25 0.44 -0.26 0.37 0.00 0.00 175.52 176.13 3ht6 h PHE 153 N 0.37 0.97 -0.28 3.16 0.05 -0.38 -1.03 116.94 119.80 3ht6 h PHE 153 Ca 0.10 -0.00 -0.18 0.00 3.82 0.00 0.00 57.97 61.71 3ht6 h PHE 153 Cb 0.29 -0.32 0.00 0.00 2.00 0.00 0.00 35.95 37.92 3ht6 h PHE 153 CO 0.01 0.65 -0.52 -0.09 -0.18 0.00 0.00 178.31 178.18 3ht6 h ARG 154 N 1.02 0.85 0.00 1.51 2.43 -0.37 -3.38 114.38 116.44 3ht6 h ARG 154 Ca 0.26 -0.54 -0.06 0.00 -0.81 0.00 0.00 59.98 58.84 3ht6 h ARG 154 Cb -0.03 0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 29.57 3ht6 h ARG 154 CO -0.05 1.17 -1.67 0.25 -1.51 0.00 0.00 179.97 178.16 3ht6 n THR 155 N -4.05 0.23 -1.76 0.20 -2.24 -0.35 -4.78 114.28 101.54 3ht6 n THR 155 Ca -0.05 -0.36 -0.18 0.00 -2.27 0.00 0.00 64.05 61.20 3ht6 n THR 155 Cb 0.61 -0.04 -0.06 0.00 -2.10 0.00 0.00 70.33 68.74 3ht6 n THR 155 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3ht6 n GLY 156 N 1.89 1.13 3.64 3.38 0.00 -0.39 -5.00 105.19 109.83 3ht6 n GLY 156 Ca -0.07 -0.16 -0.28 0.00 0.00 0.00 0.00 46.02 45.51 3ht6 n GLY 156 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3ht6 s THR 157 N -2.73 2.03 -0.32 2.61 -4.23 -1.26 -4.77 115.64 106.98 3ht6 s THR 157 Ca 0.00 -1.96 0.12 0.00 -1.18 0.00 0.00 61.69 58.67 3ht6 s THR 157 Cb 0.00 -2.99 0.75 0.00 1.34 0.00 0.00 72.50 71.60 3ht6 s THR 157 CO 0.00 0.00 1.64 0.79 -0.54 0.00 0.00 174.62 176.51 3ht6 n TRP 158 N -1.01 1.92 -0.26 3.99 7.02 -1.26 -4.53 117.44 123.31 3ht6 n TRP 158 Ca -0.05 -0.68 0.14 0.00 -1.02 0.00 0.00 57.50 55.90 3ht6 n TRP 158 Cb 0.67 -0.49 0.41 0.00 -2.42 0.00 0.00 31.31 29.48 3ht6 n TRP 158 CO 0.00 0.00 0.00 -0.44 -2.02 0.00 0.00 177.69 175.23 3ht6 h ASP 159 N 3.59 0.59 0.77 -0.99 5.19 -1.96 -0.51 116.42 123.11 3ht6 h ASP 159 Ca 0.01 0.04 0.00 0.00 -0.62 0.00 0.00 57.03 56.46 3ht6 h ASP 159 Cb 1.87 -0.07 0.00 0.00 0.18 0.00 0.00 39.33 41.31 3ht6 h ASP 159 CO 0.46 0.28 0.00 0.00 -3.12 0.00 0.00 179.24 176.86 3ht6 n ALA 160 N -2.45 1.85 -0.44 3.45 0.00 -1.26 -3.11 120.51 118.54 3ht6 n ALA 160 Ca 0.18 -0.01 0.08 0.00 0.00 0.00 0.00 53.44 53.69 3ht6 n ALA 160 Cb 0.53 -1.35 0.24 0.00 0.00 0.00 0.00 19.45 18.87 3ht6 n ALA 160 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 3ht6 n TYR 161 N -1.83 0.83 -1.81 0.00 4.02 -0.20 -4.94 117.16 113.23 3ht6 n TYR 161 Ca 0.04 -0.59 0.00 0.00 -0.01 0.00 0.00 57.90 57.34 3ht6 n TYR 161 Cb 0.25 -0.12 0.00 0.00 -0.02 0.00 0.00 39.34 39.45 3ht6 n TYR 161 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 176.86 177.02