#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hiq s THR 0 N 0.00 5.08 -0.02 4.37 -1.32 -1.26 -4.97 115.64 117.51 3hiq s THR 0 Ca 0.00 1.19 -0.30 0.00 -1.21 0.00 0.00 61.69 61.37 3hiq s THR 0 Cb 0.00 -3.93 -0.03 0.00 -1.51 0.00 0.00 72.50 67.03 3hiq s THR 0 CO 0.00 0.21 1.06 -0.69 -2.21 0.00 0.00 174.62 173.00 3hiq s VAL 1 N 1.23 4.59 -0.00 5.08 1.01 -1.26 -4.78 120.40 126.26 3hiq s VAL 1 Ca 0.30 1.86 -0.13 0.00 0.00 0.00 0.00 61.98 64.02 3hiq s VAL 1 Cb -0.16 -4.20 -0.05 0.00 0.00 0.00 0.00 36.38 31.97 3hiq s VAL 1 CO 0.12 0.09 0.36 -0.63 0.00 0.00 0.00 175.10 175.05 3hiq s ILE 2 N 1.43 5.12 -0.10 2.22 -1.09 -1.26 -4.93 121.20 122.58 3hiq s ILE 2 Ca 0.53 0.67 0.03 0.00 -2.23 0.00 0.00 60.65 59.65 3hiq s ILE 2 Cb -0.23 -3.65 0.01 0.00 -1.58 0.00 0.00 42.46 37.01 3hiq s ILE 2 CO 0.25 0.53 -0.19 -0.63 -1.23 0.00 0.00 174.94 173.68 3hiq s ILE 3 N -1.13 1.71 0.14 2.92 1.01 -1.26 -1.15 121.20 123.44 3hiq s ILE 3 Ca 0.24 -0.79 0.09 0.00 0.00 0.00 0.00 60.65 60.19 3hiq s ILE 3 Cb -0.15 -1.52 -0.04 0.00 0.01 0.00 0.00 42.46 40.76 3hiq s ILE 3 CO 0.13 0.48 -0.22 -0.31 0.00 0.00 0.00 174.94 175.02 3hiq s TYR 4 N 0.69 1.99 0.02 3.97 2.02 -0.18 -4.99 117.35 120.87 3hiq s TYR 4 Ca -0.12 -0.41 -0.00 0.00 -0.37 0.00 0.00 57.07 56.16 3hiq s TYR 4 Cb -0.16 -1.05 -0.02 0.00 -0.40 0.00 0.00 41.96 40.33 3hiq s TYR 4 CO 0.03 0.31 -0.02 -1.21 -1.57 0.00 0.00 175.55 173.09 3hiq s GLU 5 N -2.27 0.32 -0.05 -0.62 2.02 -1.26 -1.08 118.70 115.75 3hiq s GLU 5 Ca 0.12 -0.59 0.01 0.00 0.02 0.00 0.00 54.97 54.53 3hiq s GLU 5 Cb -0.09 0.11 0.02 0.00 0.10 0.00 0.00 34.13 34.28 3hiq s GLU 5 CO 0.06 -0.05 -0.04 -1.17 0.02 0.00 0.00 175.26 174.08 3hiq s LEU 6 N -1.44 1.21 -0.15 1.80 2.96 -0.56 -4.83 118.68 117.69 3hiq s LEU 6 Ca -0.16 -0.13 -0.16 0.00 -0.22 0.00 0.00 54.13 53.46 3hiq s LEU 6 Cb -0.10 -0.47 -0.04 0.00 0.50 0.00 0.00 46.19 46.08 3hiq s LEU 6 CO -0.01 -0.08 0.40 0.21 -1.32 0.00 0.00 176.35 175.56 3hiq s ASN 7 N 1.10 6.56 0.00 3.68 3.84 -1.26 -1.21 114.94 127.65 3hiq s ASN 7 Ca -0.08 0.66 0.27 0.00 0.21 0.00 0.00 52.86 53.93 3hiq s ASN 7 Cb -0.14 -2.24 0.93 0.00 -0.55 0.00 0.00 41.25 39.25 3hiq s ASN 7 CO -0.01 0.02 1.68 0.18 -2.79 0.00 0.00 177.10 176.18 3hiq n LEU 8 N 3.76 1.70 -4.61 3.21 4.77 0.12 -4.25 117.00 121.71 3hiq n LEU 8 Ca -0.09 -0.57 -0.34 0.00 -0.03 0.00 0.00 56.01 54.98 3hiq n LEU 8 Cb 0.52 -0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.50 3hiq n LEU 8 CO 0.42 0.28 -0.32 -1.10 -1.33 0.00 0.00 177.39 175.34 3hiq s GLN 9 N -2.00 3.39 -1.94 3.23 -0.21 -1.26 -4.51 119.66 116.36 3hiq s GLN 9 Ca 0.37 -0.44 0.00 0.00 0.02 0.00 0.00 55.36 55.31 3hiq s GLN 9 Cb 0.21 -2.90 0.00 0.00 1.00 0.00 0.00 33.01 31.32 3hiq s GLN 9 CO 0.33 0.47 0.00 0.41 -2.12 0.00 0.00 175.29 174.38 3hiq n GLY 10 N 2.87 0.67 3.75 3.09 0.00 -1.26 -4.93 105.19 109.38 3hiq n GLY 10 Ca -0.18 -0.03 -0.41 0.00 0.00 0.00 0.00 46.02 45.40 3hiq n GLY 10 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3hiq s THR 11 N -2.89 2.85 0.31 2.61 2.01 -1.26 -5.03 115.64 114.23 3hiq s THR 11 Ca 0.00 0.77 0.09 0.00 0.31 0.00 0.00 61.69 62.86 3hiq s THR 11 Cb 0.00 -3.49 -0.05 0.00 0.01 0.00 0.00 72.50 68.97 3hiq s THR 11 CO 0.00 0.15 0.03 0.42 -0.69 0.00 0.00 174.62 174.53 3hiq s THR 12 N -0.52 3.05 0.18 -0.82 -4.23 -1.26 -5.03 115.64 107.01 3hiq s THR 12 Ca 0.53 -1.90 -0.25 0.00 -1.18 0.00 0.00 61.69 58.89 3hiq s THR 12 Cb -0.39 -2.83 0.06 0.00 1.34 0.00 0.00 72.50 70.67 3hiq s THR 12 CO 0.46 -0.28 1.56 0.11 -0.54 0.00 0.00 174.62 175.93 3hiq h LYS 13 N 1.80 -0.15 -0.88 3.99 1.57 -1.96 -1.01 116.57 119.92 3hiq h LYS 13 Ca -0.43 0.01 0.13 0.00 -1.87 0.00 0.00 60.65 58.49 3hiq h LYS 13 Cb 1.25 0.03 -0.09 0.00 0.08 0.00 0.00 32.23 33.51 3hiq h LYS 13 CO 0.63 -0.10 0.50 0.00 -0.57 0.00 0.00 179.45 179.91 3hiq h ALA 14 N 0.73 1.33 -0.25 3.86 0.00 -1.99 0.44 119.26 123.39 3hiq h ALA 14 Ca 0.21 0.06 -0.15 0.00 0.00 0.00 0.00 54.91 55.02 3hiq h ALA 14 Cb 0.55 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 3hiq h ALA 14 CO -0.78 0.02 -0.46 1.96 0.00 0.00 0.00 179.25 179.98 3hiq h GLN 15 N 0.74 0.65 -0.33 0.00 4.20 -1.64 -0.65 115.11 118.08 3hiq h GLN 15 Ca 0.46 -0.37 -0.12 0.00 0.06 0.00 0.00 58.65 58.69 3hiq h GLN 15 Cb 0.58 0.02 -0.01 0.00 0.30 0.00 0.00 27.48 28.37 3hiq h GLN 15 CO -0.32 0.98 -0.27 -0.92 -0.67 0.00 0.00 178.83 177.63 3hiq h TYR 16 N 0.52 0.90 -0.44 2.96 3.20 0.04 -0.84 116.97 123.31 3hiq h TYR 16 Ca 0.03 -0.26 -0.11 0.00 3.14 0.00 0.00 58.73 61.54 3hiq h TYR 16 Cb 1.00 -0.20 -0.01 0.00 1.54 0.00 0.00 36.73 39.07 3hiq h TYR 16 CO 0.05 1.01 -0.14 0.77 -1.64 0.00 0.00 178.16 178.21 3hiq h SER 17 N 0.53 0.88 -0.66 -2.11 0.02 -0.92 -2.27 113.55 109.03 3hiq h SER 17 Ca 0.06 -0.37 0.05 0.00 -0.84 0.00 0.00 61.79 60.68 3hiq h SER 17 Cb 0.83 -0.24 -0.05 0.00 0.14 0.00 0.00 62.40 63.08 3hiq h SER 17 CO 0.07 1.06 0.38 0.74 -1.14 0.00 0.00 176.83 177.94 3hiq h THR 18 N 0.70 1.01 -0.10 -2.27 2.02 -1.07 -0.88 112.91 112.32 3hiq h THR 18 Ca 0.11 -0.25 0.01 0.00 0.77 0.00 0.00 66.41 67.05 3hiq h THR 18 Cb 0.69 0.23 -0.01 0.00 -1.74 0.00 0.00 68.15 67.31 3hiq h THR 18 CO 0.05 0.13 0.03 0.15 0.37 0.00 0.00 175.52 176.25 3hiq h PHE 19 N 0.72 0.06 -0.54 3.16 3.57 -0.99 -1.16 116.94 121.76 3hiq h PHE 19 Ca 0.28 0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.71 3hiq h PHE 19 Cb 0.13 -0.01 -0.02 0.00 2.79 0.00 0.00 35.95 38.84 3hiq h PHE 19 CO -0.07 0.03 0.00 -0.07 -2.23 0.00 0.00 178.31 175.97 3hiq h LEU 20 N 0.08 0.89 -1.14 0.59 3.38 -1.16 -2.04 115.31 115.91 3hiq h LEU 20 Ca 0.04 -0.23 -0.04 0.00 0.09 0.00 0.00 57.88 57.74 3hiq h LEU 20 Cb 0.03 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.52 3hiq h LEU 20 CO -0.05 0.95 0.11 0.50 0.09 0.00 0.00 178.44 180.03 3hiq h LYS 21 N 0.85 0.71 -0.66 1.13 3.64 -0.99 -2.22 116.57 119.03 3hiq h LYS 21 Ca 0.16 -0.14 -0.01 0.00 -1.27 0.00 0.00 60.65 59.40 3hiq h LYS 21 Cb 0.50 -0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 32.18 3hiq h LYS 21 CO 0.02 0.65 0.38 1.96 -2.27 0.00 0.00 179.45 180.19 3hiq h GLN 22 N 0.69 0.90 0.24 1.90 4.20 -0.50 0.21 115.11 122.74 3hiq h GLN 22 Ca 0.15 -0.09 0.01 0.00 0.06 0.00 0.00 58.65 58.78 3hiq h GLN 22 Cb 0.27 -0.18 -0.03 0.00 0.30 0.00 0.00 27.48 27.84 3hiq h GLN 22 CO -0.00 0.66 -0.30 -0.07 -0.67 0.00 0.00 178.83 178.45 3hiq h LEU 23 N 0.89 -0.82 0.14 1.46 4.07 -1.22 -0.04 115.31 119.79 3hiq h LEU 23 Ca 0.23 0.08 0.01 0.00 0.08 0.00 0.00 57.88 58.28 3hiq h LEU 23 Cb 0.00 0.29 -0.02 0.00 1.08 0.00 0.00 40.66 42.01 3hiq h LEU 23 CO -0.04 -0.41 -0.18 0.03 -1.08 0.00 0.00 178.44 176.75 3hiq h ARG 24 N -0.59 -0.36 -0.39 1.13 3.08 -0.93 -2.07 114.38 114.26 3hiq h ARG 24 Ca 0.00 0.02 0.07 0.00 0.07 0.00 0.00 59.98 60.15 3hiq h ARG 24 Cb 0.56 0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.67 3hiq h ARG 24 CO -0.10 -0.24 0.27 -0.44 -1.07 0.00 0.00 179.97 178.39 3hiq h ASP 25 N -0.37 0.20 -0.20 7.04 3.32 -0.55 -1.10 116.42 124.75 3hiq h ASP 25 Ca 0.02 0.00 -0.04 0.00 0.02 0.00 0.00 57.03 57.03 3hiq h ASP 25 Cb 0.37 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 39.86 3hiq h ASP 25 CO -0.08 0.13 0.03 -0.78 -1.72 0.00 0.00 179.24 176.82 3hiq h ASP 26 N 0.23 0.41 -0.01 6.45 3.58 -0.28 -3.25 116.42 123.56 3hiq h ASP 26 Ca 0.18 -0.06 0.00 0.00 0.42 0.00 0.00 57.03 57.56 3hiq h ASP 26 Cb 0.40 -0.11 0.00 0.00 1.72 0.00 0.00 39.33 41.35 3hiq h ASP 26 CO -0.03 0.46 -0.07 2.30 -2.88 0.00 0.00 179.24 179.02 3hiq n ILE 27 N -4.33 0.00 -2.31 2.25 -5.35 -0.81 -5.04 119.36 103.78 3hiq n ILE 27 Ca 0.01 -0.47 -0.32 0.00 -0.27 0.00 0.00 62.75 61.71 3hiq n ILE 27 Cb 0.21 1.17 -0.02 0.00 -1.74 0.00 0.00 39.64 39.25 3hiq n ILE 27 CO 0.00 0.00 0.00 -1.59 -1.76 0.00 0.00 176.55 173.20 3hiq s LYS 28 N -0.97 3.84 0.03 6.28 -2.85 -0.48 -1.59 119.74 123.99 3hiq s LYS 28 Ca 0.10 0.84 -0.30 0.00 -1.00 0.00 0.00 55.97 55.61 3hiq s LYS 28 Cb 0.08 -2.15 -0.04 0.00 -2.06 0.00 0.00 37.83 33.66 3hiq s LYS 28 CO 0.16 -0.32 0.98 0.34 0.10 0.00 0.00 175.35 176.61 3hiq s ASP 29 N -3.38 7.39 0.22 0.03 -1.08 -0.07 -4.49 116.67 115.29 3hiq s ASP 29 Ca 0.57 1.71 0.22 0.00 -0.52 0.00 0.00 52.55 54.52 3hiq s ASP 29 Cb -0.10 -2.57 0.93 0.00 -1.46 0.00 0.00 42.92 39.71 3hiq s ASP 29 CO 0.37 -0.22 1.67 -0.81 0.52 0.00 0.00 175.17 176.70 3hiq n PRO 30 N 3.63 0.16 0.00 4.34 -0.04 -1.26 -3.63 135.00 138.20 3hiq n PRO 30 Ca 0.05 0.41 0.00 0.00 -0.04 0.00 0.00 63.50 63.92 3hiq n PRO 30 Cb 0.50 -1.82 0.00 0.00 -0.04 0.00 0.00 33.50 32.14 3hiq n PRO 30 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3hiq n ASN 31 N -2.13 3.92 -4.72 3.54 3.02 -1.26 -5.06 115.26 112.58 3hiq n ASN 31 Ca 0.02 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.15 3hiq n ASN 31 Cb 0.21 0.70 -0.03 0.00 -0.61 0.00 0.00 39.78 40.05 3hiq n ASN 31 CO 0.00 0.00 0.00 -0.22 -2.62 0.00 0.00 177.26 174.42 3hiq s LEU 32 N -2.56 4.37 0.09 3.41 2.96 -1.24 -5.04 118.68 120.67 3hiq s LEU 32 Ca 0.00 2.28 0.03 0.00 -0.22 0.00 0.00 54.13 56.22 3hiq s LEU 32 Cb 0.00 -3.59 -0.03 0.00 0.50 0.00 0.00 46.19 43.07 3hiq s LEU 32 CO 0.00 -0.62 -0.09 -1.00 -1.32 0.00 0.00 176.35 173.33 3hiq s HIS 33 N 1.04 0.93 -0.01 5.38 3.76 -1.26 -3.80 115.29 121.32 3hiq s HIS 33 Ca 0.63 -0.69 0.03 0.00 -0.15 0.00 0.00 55.06 54.88 3hiq s HIS 33 Cb -0.36 -0.52 -0.03 0.00 1.11 0.00 0.00 32.58 32.78 3hiq s HIS 33 CO 0.30 -0.06 -0.07 0.71 -0.85 0.00 0.00 174.74 174.78 3hiq s TYR 34 N -2.53 2.90 -1.94 1.40 2.02 -1.26 -4.70 117.35 113.23 3hiq s TYR 34 Ca 0.04 -0.03 0.00 0.00 -0.37 0.00 0.00 57.07 56.71 3hiq s TYR 34 Cb -0.02 -1.63 0.00 0.00 -0.40 0.00 0.00 41.96 39.91 3hiq s TYR 34 CO -0.01 0.36 0.00 0.41 -1.57 0.00 0.00 175.55 174.74 3hiq n GLY 35 N 1.70 0.78 2.37 0.71 0.00 -0.35 -1.69 105.19 108.72 3hiq n GLY 35 Ca -0.16 -0.04 -0.17 0.00 0.00 0.00 0.00 46.02 45.64 3hiq n GLY 35 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hiq n GLY 36 N -0.75 0.09 3.99 -0.02 0.00 -1.26 -0.42 105.19 106.82 3hiq n GLY 36 Ca -0.22 -0.16 -0.19 0.00 0.00 0.00 0.00 46.02 45.45 3hiq n GLY 36 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3hiq s THR 37 N -2.82 3.89 -2.30 2.61 -4.23 -0.68 -4.61 115.64 107.49 3hiq s THR 37 Ca 0.00 -0.92 0.21 0.00 -1.18 0.00 0.00 61.69 59.80 3hiq s THR 37 Cb 0.00 -3.36 0.46 0.00 1.34 0.00 0.00 72.50 70.94 3hiq s THR 37 CO 0.00 -0.15 1.45 -0.46 -0.54 0.00 0.00 174.62 174.91 3hiq n ASN 38 N -1.74 2.93 -4.74 3.99 6.94 -1.26 -4.45 115.26 116.92 3hiq n ASN 38 Ca 0.01 -1.93 -0.35 0.00 -0.02 0.00 0.00 54.58 52.30 3hiq n ASN 38 Cb 0.58 -0.25 0.06 0.00 -2.36 0.00 0.00 39.78 37.81 3hiq n ASN 38 CO 0.00 0.00 0.00 -0.76 -1.03 0.00 0.00 177.26 175.47 3hiq s LEU 39 N -1.37 3.47 0.52 -4.53 1.43 -1.26 -5.01 118.68 111.93 3hiq s LEU 39 Ca 0.37 2.30 -0.17 0.00 -1.03 0.00 0.00 54.13 55.60 3hiq s LEU 39 Cb 0.21 -4.59 -0.07 0.00 0.03 0.00 0.00 46.19 41.77 3hiq s LEU 39 CO 0.29 -1.87 1.01 -2.16 0.23 0.00 0.00 176.35 173.84 3hiq s PRO 40 N -3.72 3.79 -0.04 1.29 0.04 -1.26 -4.58 135.00 130.52 3hiq s PRO 40 Ca 0.74 1.09 0.03 0.00 0.04 0.00 0.00 61.00 62.90 3hiq s PRO 40 Cb -0.28 -2.11 0.00 0.00 0.04 0.00 0.00 34.50 32.16 3hiq s PRO 40 CO 0.40 -0.41 -0.12 0.08 0.04 0.00 0.00 177.00 176.99 3hiq s VAL 41 N -2.46 1.04 0.44 -0.36 1.01 -1.25 -1.60 120.40 117.21 3hiq s VAL 41 Ca 0.61 -0.48 -0.26 0.00 0.00 0.00 0.00 61.98 61.86 3hiq s VAL 41 Cb -0.12 -0.92 -0.09 0.00 0.00 0.00 0.00 36.38 35.25 3hiq s VAL 41 CO 0.30 0.32 1.44 -0.63 0.00 0.00 0.00 175.10 176.52 3hiq s ILE 42 N 0.30 2.07 0.23 2.22 1.01 -0.63 -0.89 121.20 125.51 3hiq s ILE 42 Ca -0.06 0.06 -0.27 0.00 0.00 0.00 0.00 60.65 60.38 3hiq s ILE 42 Cb -0.11 -3.04 -0.09 0.00 0.01 0.00 0.00 42.46 39.23 3hiq s ILE 42 CO 0.02 0.01 0.87 -0.75 0.00 0.00 0.00 174.94 175.09 3hiq s LYS 43 N -2.38 4.67 -0.10 2.79 2.20 -0.62 -4.14 119.74 122.16 3hiq s LYS 43 Ca 0.59 1.31 0.03 0.00 -0.36 0.00 0.00 55.97 57.54 3hiq s LYS 43 Cb -0.44 -3.17 0.01 0.00 -1.51 0.00 0.00 37.83 32.72 3hiq s LYS 43 CO 0.58 0.49 -0.21 0.50 -0.36 0.00 0.00 175.35 176.35 3hiq s ARG 44 N -1.37 2.77 0.65 4.03 3.52 -1.26 -1.90 118.95 125.39 3hiq s ARG 44 Ca 0.41 -0.78 -0.14 0.00 -0.13 0.00 0.00 55.73 55.09 3hiq s ARG 44 Cb -0.23 -2.16 -0.01 0.00 -1.56 0.00 0.00 34.95 30.99 3hiq s ARG 44 CO 0.28 0.09 1.08 -2.14 -0.81 0.00 0.00 175.30 173.80 3hiq s PRO 45 N 0.56 3.00 -0.12 5.12 0.02 -1.26 -5.12 135.00 137.19 3hiq s PRO 45 Ca -0.14 1.21 -0.18 0.00 0.02 0.00 0.00 61.00 61.91 3hiq s PRO 45 Cb -0.17 -1.99 -0.26 0.00 0.02 0.00 0.00 34.50 32.10 3hiq s PRO 45 CO 0.05 -1.07 0.56 -0.24 -0.33 0.00 0.00 177.00 175.96 3hiq h VAL 46 N -0.03 1.13 -3.23 3.83 3.04 -1.75 -3.49 116.25 115.76 3hiq h VAL 46 Ca -0.46 -2.37 0.00 0.00 -1.01 0.00 0.00 66.70 62.86 3hiq h VAL 46 Cb 1.23 2.76 0.00 0.00 -2.01 0.00 0.00 31.29 33.26 3hiq h VAL 46 CO 0.56 0.64 0.00 0.61 -1.01 0.00 0.00 177.57 178.37 3hiq n GLY 47 N 1.68 3.98 3.80 3.17 0.00 -1.26 -4.85 105.19 111.71 3hiq n GLY 47 Ca -0.23 -2.06 -0.31 0.00 0.00 0.00 0.00 46.02 43.42 3hiq n GLY 47 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 3hiq s PRO 48 N 1.24 2.51 0.75 1.61 0.02 -1.26 -5.02 135.00 134.85 3hiq s PRO 48 Ca 0.00 0.87 -0.12 0.00 0.02 0.00 0.00 61.00 61.77 3hiq s PRO 48 Cb 0.00 -1.95 0.04 0.00 0.02 0.00 0.00 34.50 32.61 3hiq s PRO 48 CO 0.00 -1.38 1.10 -1.25 -0.33 0.00 0.00 177.00 175.14 3hiq s PRO 49 N -5.06 2.47 0.20 5.54 0.04 -1.26 -5.03 135.00 131.90 3hiq s PRO 49 Ca 0.59 0.50 0.03 0.00 0.04 0.00 0.00 61.00 62.17 3hiq s PRO 49 Cb -0.15 -1.97 0.14 0.00 0.04 0.00 0.00 34.50 32.56 3hiq s PRO 49 CO 0.55 -1.32 1.48 -0.22 0.04 0.00 0.00 177.00 177.53 3hiq h LYS 50 N -0.86 0.24 -5.47 4.56 3.64 -1.96 -3.46 116.57 113.25 3hiq h LYS 50 Ca -0.46 -0.20 -0.51 0.00 -1.27 0.00 0.00 60.65 58.21 3hiq h LYS 50 Cb 1.27 0.04 -0.14 0.00 -0.41 0.00 0.00 32.23 32.99 3hiq h LYS 50 CO 0.62 0.86 -0.65 -0.06 -2.27 0.00 0.00 179.45 177.95 3hiq s PHE 51 N -3.55 2.04 0.26 1.91 0.40 -1.26 -1.43 117.98 116.35 3hiq s PHE 51 Ca -0.04 -0.75 0.05 0.00 -0.60 0.00 0.00 56.93 55.59 3hiq s PHE 51 Cb 0.11 -1.25 -0.06 0.00 0.51 0.00 0.00 43.02 42.34 3hiq s PHE 51 CO 0.81 0.24 -0.02 -0.48 0.70 0.00 0.00 175.22 176.48 3hiq s LEU 52 N -3.49 2.30 -0.04 -0.37 0.05 -0.01 -4.68 118.68 112.44 3hiq s LEU 52 Ca 0.32 -1.22 -0.03 0.00 0.05 0.00 0.00 54.13 53.25 3hiq s LEU 52 Cb 0.06 -0.42 -0.04 0.00 -2.05 0.00 0.00 46.19 43.74 3hiq s LEU 52 CO 0.14 -0.46 0.12 -0.60 -0.55 0.00 0.00 176.35 175.00 3hiq s ARG 53 N -3.81 3.28 -0.09 1.48 3.52 -0.30 -1.37 118.95 121.65 3hiq s ARG 53 Ca 0.30 -0.34 0.03 0.00 -0.13 0.00 0.00 55.73 55.58 3hiq s ARG 53 Cb 0.05 -3.01 0.01 0.00 -1.56 0.00 0.00 34.95 30.44 3hiq s ARG 53 CO 0.11 0.69 -0.18 0.08 -0.81 0.00 0.00 175.30 175.18 3hiq s VAL 54 N -1.18 1.66 -0.18 7.11 1.01 -0.68 -1.01 120.40 127.13 3hiq s VAL 54 Ca 0.22 -0.77 -0.08 0.00 0.00 0.00 0.00 61.98 61.35 3hiq s VAL 54 Cb -0.12 -1.47 -0.04 0.00 0.00 0.00 0.00 36.38 34.75 3hiq s VAL 54 CO 0.13 0.47 0.07 0.20 0.00 0.00 0.00 175.10 175.97 3hiq s ASN 55 N 0.59 5.72 -0.24 3.32 0.01 -0.24 -0.12 114.94 123.98 3hiq s ASN 55 Ca -0.15 0.12 -0.06 0.00 -0.71 0.00 0.00 52.86 52.06 3hiq s ASN 55 Cb -0.17 -1.97 -0.02 0.00 0.41 0.00 0.00 41.25 39.50 3hiq s ASN 55 CO 0.05 0.19 0.02 -0.76 -1.51 0.00 0.00 177.10 175.08 3hiq s LEU 56 N 0.29 3.21 0.08 0.60 1.43 0.21 -1.49 118.68 123.01 3hiq s LEU 56 Ca 0.04 -0.32 -0.13 0.00 -1.03 0.00 0.00 54.13 52.70 3hiq s LEU 56 Cb -0.12 -1.84 -0.06 0.00 0.03 0.00 0.00 46.19 44.20 3hiq s LEU 56 CO -0.00 -0.04 0.45 -0.54 0.23 0.00 0.00 176.35 176.45 3hiq s LYS 57 N 1.55 3.88 0.35 1.70 1.02 -0.35 -1.74 119.74 126.14 3hiq s LYS 57 Ca 0.06 0.34 -0.10 0.00 0.02 0.00 0.00 55.97 56.30 3hiq s LYS 57 Cb -0.15 -3.04 0.02 0.00 -0.52 0.00 0.00 37.83 34.15 3hiq s LYS 57 CO 0.00 0.57 0.61 0.00 -0.92 0.00 0.00 175.35 175.62 3hiq s ALA 58 N -1.33 -0.03 0.08 5.17 0.00 -0.88 0.14 121.76 124.91 3hiq s ALA 58 Ca 0.32 -1.09 -0.34 0.00 0.00 0.00 0.00 51.96 50.85 3hiq s ALA 58 Cb -0.15 0.94 -0.18 0.00 0.00 0.00 0.00 23.12 23.73 3hiq s ALA 58 CO 0.17 -0.89 1.60 1.03 0.00 0.00 0.00 175.76 177.67 3hiq h SER 59 N 2.07 -1.03 0.60 0.00 0.87 -1.98 -3.07 113.55 111.01 3hiq h SER 59 Ca -0.29 0.06 -0.05 0.00 -1.23 0.00 0.00 61.79 60.27 3hiq h SER 59 Cb 1.25 0.31 -0.01 0.00 -0.44 0.00 0.00 62.40 63.50 3hiq h SER 59 CO 0.38 -0.63 -0.26 0.71 -0.53 0.00 0.00 176.83 176.51 3hiq h THR 60 N -1.00 0.79 0.00 2.23 1.35 -1.99 -3.48 112.91 110.81 3hiq h THR 60 Ca -0.08 -1.05 0.00 0.00 -0.55 0.00 0.00 66.41 64.73 3hiq h THR 60 Cb 0.81 1.64 0.00 0.00 -1.73 0.00 0.00 68.15 68.88 3hiq h THR 60 CO 0.08 0.25 0.00 0.61 -0.25 0.00 0.00 175.52 176.21 3hiq n GLY 61 N -0.25 -1.39 3.48 5.82 0.00 -1.16 -4.98 105.19 106.72 3hiq n GLY 61 Ca -0.01 -0.98 -0.33 0.00 0.00 0.00 0.00 46.02 44.69 3hiq n GLY 61 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3hiq s THR 62 N -2.73 3.54 -0.18 2.61 2.01 -1.26 -2.08 115.64 117.56 3hiq s THR 62 Ca 0.00 -0.50 -0.07 0.00 0.31 0.00 0.00 61.69 61.43 3hiq s THR 62 Cb 0.00 -2.50 -0.04 0.00 0.01 0.00 0.00 72.50 69.97 3hiq s THR 62 CO 0.00 0.53 0.04 -0.69 -0.69 0.00 0.00 174.62 173.81 3hiq s VAL 63 N 0.00 4.58 0.21 3.82 1.01 -0.71 -4.65 120.40 124.66 3hiq s VAL 63 Ca -0.01 -0.11 0.10 0.00 0.00 0.00 0.00 61.98 61.96 3hiq s VAL 63 Cb -0.14 -3.05 -0.04 0.00 0.00 0.00 0.00 36.38 33.14 3hiq s VAL 63 CO 0.03 0.47 -0.16 -0.44 0.00 0.00 0.00 175.10 175.00 3hiq s SER 64 N 0.38 3.87 0.11 3.32 0.01 -0.18 -0.62 113.70 120.58 3hiq s SER 64 Ca 0.01 -0.76 0.10 0.00 1.31 0.00 0.00 55.95 56.62 3hiq s SER 64 Cb -0.13 -0.49 -0.04 0.00 0.21 0.00 0.00 66.02 65.57 3hiq s SER 64 CO 0.01 0.09 -0.26 -0.76 0.41 0.00 0.00 173.24 172.72 3hiq s LEU 65 N -2.95 2.28 -0.27 2.44 1.43 0.83 0.63 118.68 123.07 3hiq s LEU 65 Ca 0.25 -0.70 -0.11 0.00 -1.03 0.00 0.00 54.13 52.54 3hiq s LEU 65 Cb -0.08 -1.22 -0.05 0.00 0.03 0.00 0.00 46.19 44.88 3hiq s LEU 65 CO 0.14 0.19 0.18 0.00 0.23 0.00 0.00 176.35 177.09 3hiq s ALA 66 N -1.00 3.55 -0.14 4.21 0.00 0.57 -1.68 121.76 127.28 3hiq s ALA 66 Ca 0.13 -1.03 0.02 0.00 0.00 0.00 0.00 51.96 51.08 3hiq s ALA 66 Cb -0.10 -2.43 0.01 0.00 0.00 0.00 0.00 23.12 20.60 3hiq s ALA 66 CO 0.05 -0.44 -0.20 0.08 0.00 0.00 0.00 175.76 175.25 3hiq s VAL 67 N 1.55 1.93 -0.01 0.00 1.01 -0.47 0.45 120.40 124.86 3hiq s VAL 67 Ca 0.07 -0.90 -0.30 0.00 0.00 0.00 0.00 61.98 60.85 3hiq s VAL 67 Cb -0.15 -1.73 -0.05 0.00 0.00 0.00 0.00 36.38 34.45 3hiq s VAL 67 CO 0.09 0.52 1.28 -1.58 0.00 0.00 0.00 175.10 175.41 3hiq s GLN 68 N 0.94 4.34 0.22 2.72 0.74 0.14 -0.83 119.66 127.94 3hiq s GLN 68 Ca -0.05 1.81 0.04 0.00 0.05 0.00 0.00 55.36 57.21 3hiq s GLN 68 Cb -0.15 -3.51 0.20 0.00 1.10 0.00 0.00 33.01 30.65 3hiq s GLN 68 CO -0.04 -0.46 1.52 0.00 -0.55 0.00 0.00 175.29 175.77 3hiq h ARG 69 N 7.44 0.23 0.00 1.67 3.08 -1.57 0.18 114.38 125.41 3hiq h ARG 69 Ca -0.37 -0.18 0.00 0.00 0.07 0.00 0.00 59.98 59.50 3hiq h ARG 69 Cb 1.18 0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.26 3hiq h ARG 69 CO 0.87 0.81 0.00 0.66 -1.07 0.00 0.00 179.97 181.24 3hiq h SER 70 N 0.17 0.00 0.00 7.04 4.64 -1.92 -3.33 113.55 120.15 3hiq h SER 70 Ca -0.01 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 3hiq h SER 70 Cb 1.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.27 3hiq h SER 70 CO 0.10 0.00 0.00 -0.46 -0.87 0.00 0.00 176.83 175.60 3hiq n ASN 71 N -2.62 0.00 -1.22 4.97 6.94 -1.22 -4.72 115.26 117.40 3hiq n ASN 71 Ca 0.01 -1.00 -0.14 0.00 -0.02 0.00 0.00 54.58 53.43 3hiq n ASN 71 Cb 0.21 0.00 -0.05 0.00 -2.36 0.00 0.00 39.78 37.59 3hiq n ASN 71 CO 0.00 0.00 0.00 0.18 -1.03 0.00 0.00 177.26 176.41 3hiq n LEU 72 N 0.00 -1.19 -4.70 -4.53 4.77 0.61 -4.98 117.00 106.98 3hiq n LEU 72 Ca 0.00 0.25 -0.42 0.00 -0.03 0.00 0.00 56.01 55.81 3hiq n LEU 72 Cb 0.36 -2.10 -0.03 0.00 -2.33 0.00 0.00 43.42 39.32 3hiq n LEU 72 CO 0.00 -0.58 0.72 0.00 -1.33 0.00 0.00 177.39 176.20 3hiq s ALA 73 N -2.57 3.24 -0.09 -1.18 0.00 -1.20 -4.55 121.76 115.41 3hiq s ALA 73 Ca 0.00 0.50 -0.30 0.00 0.00 0.00 0.00 51.96 52.16 3hiq s ALA 73 Cb 0.00 -3.37 -0.03 0.00 0.00 0.00 0.00 23.12 19.72 3hiq s ALA 73 CO 0.00 -0.35 1.26 0.08 0.00 0.00 0.00 175.76 176.75 3hiq s VAL 74 N 1.31 4.19 -0.19 0.00 1.01 -1.26 0.29 120.40 125.75 3hiq s VAL 74 Ca 0.51 1.49 0.17 0.00 0.00 0.00 0.00 61.98 64.16 3hiq s VAL 74 Cb -0.20 -3.96 -0.25 0.00 0.00 0.00 0.00 36.38 31.97 3hiq s VAL 74 CO 0.25 -0.05 0.09 0.00 0.00 0.00 0.00 175.10 175.39 3hiq n ALA 75 N 5.78 1.50 -3.61 5.51 0.00 0.17 -4.95 120.51 124.91 3hiq n ALA 75 Ca 0.12 -1.31 -0.05 0.00 0.00 0.00 0.00 53.44 52.21 3hiq n ALA 75 Cb 0.45 -0.21 -0.02 0.00 0.00 0.00 0.00 19.45 19.68 3hiq n ALA 75 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3hiq s ALA 76 N -2.50 -1.84 0.06 0.00 0.00 -1.23 -1.97 121.76 114.29 3hiq s ALA 76 Ca -0.10 0.75 0.03 0.00 0.00 0.00 0.00 51.96 52.63 3hiq s ALA 76 Cb 0.06 0.43 -0.03 0.00 0.00 0.00 0.00 23.12 23.58 3hiq s ALA 76 CO 0.82 -0.83 -0.09 1.52 0.00 0.00 0.00 175.76 177.18 3hiq s TYR 77 N -3.03 0.81 -0.07 0.00 1.13 -0.58 -0.31 117.35 115.30 3hiq s TYR 77 Ca 0.09 -0.59 0.04 0.00 -1.41 0.00 0.00 57.07 55.20 3hiq s TYR 77 Cb -0.01 -0.47 -0.02 0.00 -1.10 0.00 0.00 41.96 40.36 3hiq s TYR 77 CO -0.04 -0.07 -0.18 -1.17 -2.51 0.00 0.00 175.55 171.58 3hiq s LEU 78 N -1.95 2.48 -0.15 -3.49 2.96 0.20 -1.61 118.68 117.12 3hiq s LEU 78 Ca -0.04 -0.34 -0.29 0.00 -0.22 0.00 0.00 54.13 53.25 3hiq s LEU 78 Cb -0.07 -1.50 0.08 0.00 0.50 0.00 0.00 46.19 45.21 3hiq s LEU 78 CO -0.00 0.27 0.78 0.00 -1.32 0.00 0.00 176.35 176.08 3hiq s ALA 79 N -0.31 -1.82 0.34 5.97 0.00 -0.78 -1.01 121.76 124.14 3hiq s ALA 79 Ca 0.02 1.62 -0.28 0.00 0.00 0.00 0.00 51.96 53.32 3hiq s ALA 79 Cb -0.13 -0.59 -0.10 0.00 0.00 0.00 0.00 23.12 22.31 3hiq s ALA 79 CO 0.02 -0.34 1.21 0.15 0.00 0.00 0.00 175.76 176.81 3hiq s LYS 80 N -0.60 4.34 0.00 0.00 1.02 -1.26 -1.28 119.74 121.97 3hiq s LYS 80 Ca -0.05 2.00 0.00 0.00 0.02 0.00 0.00 55.97 57.94 3hiq s LYS 80 Cb -0.02 -2.99 0.00 0.00 -0.52 0.00 0.00 37.83 34.30 3hiq s LYS 80 CO 0.04 -0.12 0.00 0.27 -0.92 0.00 0.00 175.35 174.62 3hiq n ASN 81 N 0.69 0.00 -0.34 2.83 0.23 0.13 -0.81 115.26 117.99 3hiq n ASN 81 Ca 0.01 -0.95 0.11 0.00 -0.53 0.00 0.00 54.58 53.22 3hiq n ASN 81 Cb 0.44 0.00 0.28 0.00 -2.08 0.00 0.00 39.78 38.42 3hiq n ASN 81 CO 0.00 0.00 0.00 -1.13 -0.93 0.00 0.00 177.26 175.20 3hiq h ASN 82 N 0.00 0.73 -0.24 0.53 -1.24 -1.77 0.16 115.58 113.76 3hiq h ASN 82 Ca 0.00 0.09 0.00 0.00 0.71 0.00 0.00 56.30 57.10 3hiq h ASN 82 Cb 0.00 -0.04 0.00 0.00 0.73 0.00 0.00 38.32 39.01 3hiq h ASN 82 CO 0.00 0.28 0.00 0.59 -1.29 0.00 0.00 177.43 177.01 3hiq n ASN 83 N -4.78 2.23 -1.40 1.15 3.02 -1.26 -4.82 115.26 109.39 3hiq n ASN 83 Ca 0.21 -2.20 -0.17 0.00 -0.03 0.00 0.00 54.58 52.39 3hiq n ASN 83 Cb 0.51 -0.41 -0.06 0.00 -0.61 0.00 0.00 39.78 39.21 3hiq n ASN 83 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 3hiq n LYS 84 N 0.26 -1.19 -3.85 3.52 4.76 0.58 -4.98 118.16 117.25 3hiq n LYS 84 Ca 0.10 1.03 -0.37 0.00 -2.87 0.00 0.00 58.31 56.20 3hiq n LYS 84 Cb 0.45 -5.28 -0.06 0.00 -1.84 0.00 0.00 35.03 28.30 3hiq n LYS 84 CO 0.00 0.00 0.00 -0.65 -1.37 0.00 0.00 177.40 175.38 3hiq s GLN 85 N -3.69 3.53 0.18 1.97 -0.21 -1.26 -4.74 119.66 115.43 3hiq s GLN 85 Ca 0.00 -0.12 -0.30 0.00 0.02 0.00 0.00 55.36 54.96 3hiq s GLN 85 Cb 0.00 -3.21 -0.08 0.00 1.00 0.00 0.00 33.01 30.72 3hiq s GLN 85 CO 0.00 0.73 1.26 -0.06 -2.12 0.00 0.00 175.29 175.10 3hiq s PHE 86 N -0.90 3.35 0.01 0.91 0.08 -1.26 0.21 117.98 120.37 3hiq s PHE 86 Ca 0.15 1.30 0.03 0.00 0.12 0.00 0.00 56.93 58.53 3hiq s PHE 86 Cb -0.12 -3.52 -0.01 0.00 -0.57 0.00 0.00 43.02 38.80 3hiq s PHE 86 CO 0.04 -1.56 -0.11 0.50 -0.10 0.00 0.00 175.22 173.99 3hiq s ARG 87 N 0.01 0.80 -0.14 0.44 3.52 -0.40 -4.77 118.95 118.41 3hiq s ARG 87 Ca 0.56 -0.48 -0.06 0.00 -0.13 0.00 0.00 55.73 55.62 3hiq s ARG 87 Cb -0.34 -0.76 -0.04 0.00 -1.56 0.00 0.00 34.95 32.25 3hiq s ARG 87 CO 0.36 0.20 0.06 0.00 -0.81 0.00 0.00 175.30 175.12 3hiq s ALA 88 N -0.47 3.48 -0.08 6.12 0.00 -0.15 -1.87 121.76 128.79 3hiq s ALA 88 Ca 0.02 -0.74 0.03 0.00 0.00 0.00 0.00 51.96 51.28 3hiq s ALA 88 Cb -0.05 -1.80 0.01 0.00 0.00 0.00 0.00 23.12 21.27 3hiq s ALA 88 CO 0.00 0.40 -0.17 0.71 0.00 0.00 0.00 175.76 176.70 3hiq s TYR 89 N -0.32 1.88 0.12 0.00 1.51 -0.63 -0.25 117.35 119.66 3hiq s TYR 89 Ca 0.09 -0.72 0.09 0.00 -1.01 0.00 0.00 57.07 55.52 3hiq s TYR 89 Cb -0.12 -1.31 -0.04 0.00 -0.11 0.00 0.00 41.96 40.38 3hiq s TYR 89 CO 0.02 -0.32 -0.19 1.52 -1.11 0.00 0.00 175.55 175.47 3hiq s TYR 90 N 0.48 2.52 0.49 2.71 1.13 -0.71 -1.53 117.35 122.45 3hiq s TYR 90 Ca -0.15 -0.27 -0.24 0.00 -1.41 0.00 0.00 57.07 55.00 3hiq s TYR 90 Cb -0.16 -1.34 -0.07 0.00 -1.10 0.00 0.00 41.96 39.29 3hiq s TYR 90 CO 0.05 0.38 1.38 -0.06 -2.51 0.00 0.00 175.55 174.80 3hiq s PHE 91 N -1.14 2.40 0.04 -3.49 0.08 -0.83 -0.38 117.98 114.65 3hiq s PHE 91 Ca 0.18 1.33 -0.33 0.00 0.12 0.00 0.00 56.93 58.23 3hiq s PHE 91 Cb -0.11 -3.84 -0.11 0.00 -0.57 0.00 0.00 43.02 38.39 3hiq s PHE 91 CO 0.10 -2.85 1.83 1.17 -0.10 0.00 0.00 175.22 175.37 3hiq n LYS 92 N -0.58 2.45 -0.33 0.44 4.81 -0.52 -2.11 118.16 122.33 3hiq n LYS 92 Ca 0.08 0.89 0.00 0.00 -0.87 0.00 0.00 58.31 58.41 3hiq n LYS 92 Cb 0.44 -2.76 0.00 0.00 0.02 0.00 0.00 35.03 32.73 3hiq n LYS 92 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3hiq n GLY 93 N 4.20 1.43 3.72 3.14 0.00 -1.26 -4.32 105.19 112.10 3hiq n GLY 93 Ca 0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 3hiq n GLY 93 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 3hiq s PHE 94 N -3.00 3.38 -1.12 1.61 2.19 -0.90 -4.87 117.98 115.27 3hiq s PHE 94 Ca 0.00 1.25 -0.23 0.00 0.33 0.00 0.00 56.93 58.28 3hiq s PHE 94 Cb 0.00 -3.49 -0.10 0.00 -1.31 0.00 0.00 43.02 38.12 3hiq s PHE 94 CO 0.00 -1.55 1.93 1.04 1.83 0.00 0.00 175.22 178.47 3hiq n GLN 95 N 3.47 1.61 -3.70 10.12 1.13 -1.26 -4.82 117.38 123.93 3hiq n GLN 95 Ca 0.08 -2.38 -0.18 0.00 -1.94 0.00 0.00 57.00 52.58 3hiq n GLN 95 Cb 0.45 -3.60 -0.17 0.00 0.11 0.00 0.00 30.24 27.03 3hiq n GLN 95 CO 0.00 0.00 0.00 -1.50 -1.44 0.00 0.00 177.06 174.12 3hiq s ILE 96 N 9.99 -0.12 0.66 5.09 2.07 -1.26 -5.16 121.20 132.47 3hiq s ILE 96 Ca 0.66 0.35 -0.11 0.00 -1.41 0.00 0.00 60.65 60.15 3hiq s ILE 96 Cb 0.02 -0.16 -0.00 0.00 0.13 0.00 0.00 42.46 42.45 3hiq s ILE 96 CO 0.13 0.15 1.05 0.42 -1.91 0.00 0.00 174.94 174.78 3hiq s THR 97 N 1.86 3.91 0.16 4.00 -4.23 -1.26 -4.93 115.64 115.15 3hiq s THR 97 Ca 0.00 0.54 0.27 0.00 -1.18 0.00 0.00 61.69 61.32 3hiq s THR 97 Cb -0.12 -3.60 0.28 0.00 1.34 0.00 0.00 72.50 70.40 3hiq s THR 97 CO -0.04 -0.77 1.90 0.00 -0.54 0.00 0.00 174.62 175.17 3hiq h THR 98 N -0.48 0.41 -0.33 3.99 1.03 -2.01 -1.62 112.91 113.91 3hiq h THR 98 Ca -0.45 -0.90 -0.13 0.00 -0.01 0.00 0.00 66.41 64.92 3hiq h THR 98 Cb 1.23 1.65 -0.01 0.00 -1.07 0.00 0.00 68.15 69.95 3hiq h THR 98 CO 0.63 0.15 -0.33 0.78 -0.01 0.00 0.00 175.52 176.74 3hiq h ASN 99 N 0.00 0.76 -0.29 0.00 4.21 -1.99 -0.35 115.58 117.92 3hiq h ASN 99 Ca -0.00 -0.32 -0.04 0.00 1.21 0.00 0.00 56.30 57.15 3hiq h ASN 99 Cb 0.64 -0.21 -0.01 0.00 -1.12 0.00 0.00 38.32 37.62 3hiq h ASN 99 CO 0.02 1.03 0.01 1.56 -1.29 0.00 0.00 177.43 178.76 3hiq h GLN 100 N 0.61 0.51 -0.27 0.81 4.20 -1.85 -2.10 115.11 117.02 3hiq h GLN 100 Ca 0.06 -0.16 0.05 0.00 0.06 0.00 0.00 58.65 58.67 3hiq h GLN 100 Cb 0.86 -0.05 -0.05 0.00 0.30 0.00 0.00 27.48 28.54 3hiq h GLN 100 CO 0.07 0.65 -0.04 -0.07 -0.67 0.00 0.00 178.83 178.77 3hiq h LEU 101 N 0.30 -0.20 -0.60 1.46 4.07 -1.15 0.18 115.31 119.37 3hiq h LEU 101 Ca 0.08 0.07 0.07 0.00 0.08 0.00 0.00 57.88 58.18 3hiq h LEU 101 Cb 0.41 0.15 -0.06 0.00 1.08 0.00 0.00 40.66 42.25 3hiq h LEU 101 CO 0.01 -0.07 0.29 0.78 -1.08 0.00 0.00 178.44 178.38 3hiq h ASN 102 N 0.03 0.39 -0.60 -0.43 2.35 -1.03 0.75 115.58 117.04 3hiq h ASN 102 Ca 0.13 0.04 -0.08 0.00 -0.55 0.00 0.00 56.30 55.85 3hiq h ASN 102 Cb 0.19 -0.02 -0.02 0.00 0.05 0.00 0.00 38.32 38.52 3hiq h ASN 102 CO -0.26 0.25 0.07 -1.13 -1.65 0.00 0.00 177.43 174.71 3hiq h ASN 103 N 0.54 0.98 -0.02 5.81 -0.00 -0.85 -2.97 115.58 119.07 3hiq h ASN 103 Ca 0.28 -0.28 -0.01 0.00 -0.00 0.00 0.00 56.30 56.30 3hiq h ASN 103 Cb 0.23 -0.26 -0.00 0.00 -0.00 0.00 0.00 38.32 38.29 3hiq h ASN 103 CO -0.21 1.01 -0.01 -0.07 -0.00 0.00 0.00 177.43 178.14 3hiq h LEU 104 N 0.92 0.04 -7.00 0.34 3.38 -0.33 -3.41 115.31 109.25 3hiq h LEU 104 Ca 0.18 -0.46 -0.66 0.00 0.09 0.00 0.00 57.88 57.03 3hiq h LEU 104 Cb 0.47 -0.01 -0.39 0.00 0.09 0.00 0.00 40.66 40.82 3hiq h LEU 104 CO 0.02 0.49 -0.33 0.49 0.09 0.00 0.00 178.44 179.20 3hiq n PHE 105 N -4.83 3.65 0.24 1.13 3.72 0.26 -4.90 117.46 116.72 3hiq n PHE 105 Ca -0.08 -4.14 0.16 0.00 -0.05 0.00 0.00 57.45 53.34 3hiq n PHE 105 Cb 0.25 -0.84 0.85 0.00 -0.94 0.00 0.00 39.48 38.80 3hiq n PHE 105 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 3hiq h PRO 106 N 5.39 0.00 0.00 -1.08 0.13 -1.75 0.18 132.00 134.87 3hiq h PRO 106 Ca 0.17 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.28 3hiq h PRO 106 Cb 0.75 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.88 3hiq h PRO 106 CO 0.82 0.00 -0.07 0.93 -0.23 0.00 0.00 178.00 179.45 3hiq h GLU 107 N 0.00 0.00 -1.56 0.86 3.07 -1.90 -3.34 114.58 111.71 3hiq h GLU 107 Ca 0.00 0.00 -0.51 0.00 -0.50 0.00 0.00 59.36 58.35 3hiq h GLU 107 Cb 0.02 0.00 -0.41 0.00 -0.84 0.00 0.00 28.75 27.52 3hiq h GLU 107 CO 0.00 0.07 -0.90 0.00 -1.40 0.00 0.00 179.01 176.78 3hiq n ALA 108 N -2.14 4.17 -1.76 3.43 0.00 0.62 -4.71 120.51 120.12 3hiq n ALA 108 Ca 0.00 -3.94 -0.40 0.00 0.00 0.00 0.00 53.44 49.11 3hiq n ALA 108 Cb 0.35 -0.73 -0.04 0.00 0.00 0.00 0.00 19.45 19.02 3hiq n ALA 108 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 3hiq s THR 109 N -4.30 3.44 0.00 0.00 2.01 -1.24 -4.62 115.64 110.93 3hiq s THR 109 Ca 0.41 1.37 0.00 0.00 0.31 0.00 0.00 61.69 63.78 3hiq s THR 109 Cb 0.39 -3.84 0.00 0.00 0.01 0.00 0.00 72.50 69.06 3hiq s THR 109 CO -0.10 0.27 0.00 0.61 -0.69 0.00 0.00 174.62 174.70 3hiq n GLY 110 N 0.98 -2.29 0.23 4.40 0.00 -1.26 -4.34 105.19 102.92 3hiq n GLY 110 Ca 0.00 -1.46 0.16 0.00 0.00 0.00 0.00 46.02 44.72 3hiq n GLY 110 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 3hiq h VAL 111 N 0.00 0.00 -0.89 1.61 -1.51 -1.89 -1.53 116.25 112.03 3hiq h VAL 111 Ca 0.00 -0.34 0.19 0.00 -1.23 0.00 0.00 66.70 65.32 3hiq h VAL 111 Cb 0.00 1.22 -0.07 0.00 -2.13 0.00 0.00 31.29 30.31 3hiq h VAL 111 CO 0.00 0.00 0.59 0.28 -1.23 0.00 0.00 177.57 177.21 3hiq h SER 112 N 0.00 0.45 -0.12 4.19 0.02 -1.95 -2.94 113.55 113.22 3hiq h SER 112 Ca 0.00 0.04 -0.03 0.00 -0.84 0.00 0.00 61.79 60.96 3hiq h SER 112 Cb 0.38 -0.04 -0.02 0.00 0.14 0.00 0.00 62.40 62.86 3hiq h SER 112 CO 0.00 0.19 -0.14 0.59 -1.14 0.00 0.00 176.83 176.34 3hiq n ASN 113 N -4.53 2.51 -3.76 3.07 3.02 -0.58 -4.96 115.26 110.04 3hiq n ASN 113 Ca 0.19 -3.40 -0.21 0.00 -0.03 0.00 0.00 54.58 51.12 3hiq n ASN 113 Cb 0.65 -0.52 -0.17 0.00 -0.61 0.00 0.00 39.78 39.13 3hiq n ASN 113 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 3hiq s GLN 114 N -3.03 0.40 -0.13 3.52 -0.21 -1.11 -0.98 119.66 118.13 3hiq s GLN 114 Ca 0.38 0.16 -0.00 0.00 0.02 0.00 0.00 55.36 55.91 3hiq s GLN 114 Cb 0.34 -0.77 0.02 0.00 1.00 0.00 0.00 33.01 33.60 3hiq s GLN 114 CO 0.01 -0.27 -0.10 -1.14 -2.12 0.00 0.00 175.29 171.67 3hiq s GLN 115 N 1.81 1.84 -0.02 2.91 0.74 0.66 -4.87 119.66 122.73 3hiq s GLN 115 Ca 0.02 -0.38 -0.30 0.00 0.05 0.00 0.00 55.36 54.75 3hiq s GLN 115 Cb -0.12 -1.80 -0.04 0.00 1.10 0.00 0.00 33.01 32.14 3hiq s GLN 115 CO -0.04 -0.25 1.29 -2.00 -0.55 0.00 0.00 175.29 173.73 3hiq s GLU 116 N 1.62 4.33 0.74 1.67 2.12 -1.26 -1.73 118.70 126.19 3hiq s GLU 116 Ca 0.05 1.81 -0.13 0.00 0.36 0.00 0.00 54.97 57.06 3hiq s GLU 116 Cb -0.13 -3.54 0.04 0.00 0.26 0.00 0.00 34.13 30.77 3hiq s GLU 116 CO -0.09 -0.48 1.13 -0.51 -0.54 0.00 0.00 175.26 174.76 3hiq s LEU 117 N 2.17 3.20 0.00 2.70 1.43 0.49 -4.91 118.68 123.76 3hiq s LEU 117 Ca 0.60 2.05 0.32 0.00 -1.03 0.00 0.00 54.13 56.07 3hiq s LEU 117 Cb -0.28 -4.55 1.88 0.00 0.03 0.00 0.00 46.19 43.27 3hiq s LEU 117 CO 0.25 -2.07 2.22 0.61 0.23 0.00 0.00 176.35 177.58 3hiq n GLY 118 N -0.42 -1.01 3.04 -3.19 0.00 -1.26 -3.49 105.19 98.86 3hiq n GLY 118 Ca 0.11 -0.20 -0.11 0.00 0.00 0.00 0.00 46.02 45.82 3hiq n GLY 118 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 3hiq s TYR 119 N -2.03 0.52 0.50 1.61 1.13 -1.26 -4.93 117.35 112.89 3hiq s TYR 119 Ca 0.47 -0.55 -0.06 0.00 -1.41 0.00 0.00 57.07 55.53 3hiq s TYR 119 Cb 0.22 -0.33 0.11 0.00 -1.10 0.00 0.00 41.96 40.86 3hiq s TYR 119 CO 0.37 -0.13 0.68 0.41 -2.51 0.00 0.00 175.55 174.37 3hiq n GLY 120 N 1.41 -0.52 0.17 5.49 0.00 -1.26 -1.44 105.19 109.03 3hiq n GLY 120 Ca -0.23 -1.82 0.12 0.00 0.00 0.00 0.00 46.02 44.10 3hiq n GLY 120 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 3hiq h GLU 121 N 0.00 0.00 -7.14 1.61 4.11 -1.91 -3.37 114.58 107.88 3hiq h GLU 121 Ca -0.22 0.00 -0.55 0.00 0.07 0.00 0.00 59.36 58.66 3hiq h GLU 121 Cb 0.68 0.00 0.16 0.00 0.50 0.00 0.00 28.75 30.09 3hiq h GLU 121 CO 0.18 0.00 0.46 -1.54 0.07 0.00 0.00 179.01 178.19 3hiq s SER 122 N -5.61 4.37 0.34 3.06 1.04 -1.26 -4.78 113.70 110.85 3hiq s SER 122 Ca 0.06 2.53 0.04 0.00 0.48 0.00 0.00 55.95 59.05 3hiq s SER 122 Cb 0.08 -2.61 0.66 0.00 0.10 0.00 0.00 66.02 64.25 3hiq s SER 122 CO 0.69 -2.16 1.95 1.88 0.98 0.00 0.00 173.24 176.58 3hiq h TYR 123 N 0.15 0.87 0.00 5.02 0.05 -1.99 -1.19 116.97 119.88 3hiq h TYR 123 Ca -0.50 0.02 -0.08 0.00 0.05 0.00 0.00 58.73 58.22 3hiq h TYR 123 Cb 1.32 -0.29 -0.01 0.00 1.01 0.00 0.00 36.73 38.76 3hiq h TYR 123 CO 0.43 0.47 -0.40 -1.35 -1.05 0.00 0.00 178.16 176.26 3hiq h PRO 124 N 0.86 0.00 -0.06 4.88 0.11 -1.96 0.30 132.00 136.13 3hiq h PRO 124 Ca 0.33 0.00 -0.13 0.00 0.11 0.00 0.00 66.00 66.31 3hiq h PRO 124 Cb 0.20 0.00 0.01 0.00 0.11 0.00 0.00 31.00 31.32 3hiq h PRO 124 CO -0.11 0.40 -0.46 1.96 -0.21 0.00 0.00 178.00 179.58 3hiq h GLN 125 N 0.00 0.41 -0.01 1.05 1.08 -1.60 -1.95 115.11 114.09 3hiq h GLN 125 Ca -0.00 -0.37 -0.00 0.00 -1.45 0.00 0.00 58.65 56.82 3hiq h GLN 125 Cb 0.82 0.09 -0.00 0.00 -0.05 0.00 0.00 27.48 28.33 3hiq h GLN 125 CO 0.05 1.01 -0.01 0.82 -0.95 0.00 0.00 178.83 179.76 3hiq h ILE 126 N -0.06 1.35 -0.81 2.54 2.04 -1.07 -2.33 117.51 119.18 3hiq h ILE 126 Ca -0.04 -1.05 0.14 0.00 1.00 0.00 0.00 64.86 64.91 3hiq h ILE 126 Cb 1.13 2.03 -0.06 0.00 -0.74 0.00 0.00 36.82 39.18 3hiq h ILE 126 CO 0.09 0.28 0.53 1.56 0.00 0.00 0.00 178.15 180.61 3hiq h GLN 127 N -0.40 0.55 -0.29 2.37 4.20 -0.49 0.11 115.11 121.16 3hiq h GLN 127 Ca 0.00 -0.03 -0.08 0.00 0.06 0.00 0.00 58.65 58.60 3hiq h GLN 127 Cb 0.45 -0.12 -0.01 0.00 0.30 0.00 0.00 27.48 28.10 3hiq h GLN 127 CO 0.00 0.36 -0.12 -0.97 -0.67 0.00 0.00 178.83 177.44 3hiq h ASN 128 N 0.56 0.60 0.27 1.46 -1.24 -1.27 -1.00 115.58 114.96 3hiq h ASN 128 Ca 0.40 -0.39 -0.05 0.00 0.71 0.00 0.00 56.30 56.96 3hiq h ASN 128 Cb 0.74 -0.17 -0.01 0.00 0.73 0.00 0.00 38.32 39.62 3hiq h ASN 128 CO -0.15 0.86 -0.25 0.00 -1.29 0.00 0.00 177.43 176.60 3hiq h ALA 129 N 0.76 1.55 0.00 1.57 0.00 -0.56 -3.12 119.26 119.45 3hiq h ALA 129 Ca 0.07 -0.23 -0.18 0.00 0.00 0.00 0.00 54.91 54.57 3hiq h ALA 129 Cb 0.62 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.34 3hiq h ALA 129 CO 0.04 0.31 -1.12 0.00 0.00 0.00 0.00 179.25 178.48 3hiq h ALA 130 N 1.75 0.61 0.00 0.00 0.00 -0.69 -3.35 119.26 117.58 3hiq h ALA 130 Ca -0.00 -0.87 0.00 0.00 0.00 0.00 0.00 54.91 54.04 3hiq h ALA 130 Cb 0.45 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.35 3hiq h ALA 130 CO 0.03 1.04 0.00 0.41 0.00 0.00 0.00 179.25 180.74 3hiq n GLY 131 N 1.37 0.72 3.02 0.00 0.00 -0.40 -4.85 105.19 105.04 3hiq n GLY 131 Ca -0.05 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.85 3hiq n GLY 131 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hiq s VAL 132 N -2.72 0.05 0.61 1.61 0.11 -1.18 -5.06 120.40 113.82 3hiq s VAL 132 Ca 0.00 -0.39 -0.08 0.00 -2.93 0.00 0.00 61.98 58.58 3hiq s VAL 132 Cb 0.00 -0.26 0.00 0.00 -1.53 0.00 0.00 36.38 34.59 3hiq s VAL 132 CO 0.00 -0.22 0.96 0.42 -3.33 0.00 0.00 175.10 172.93 3hiq s THR 133 N -0.69 3.84 0.15 5.04 -4.23 -1.26 -4.50 115.64 113.98 3hiq s THR 133 Ca -0.08 0.24 -0.19 0.00 -1.18 0.00 0.00 61.69 60.48 3hiq s THR 133 Cb -0.05 -3.54 0.04 0.00 1.34 0.00 0.00 72.50 70.29 3hiq s THR 133 CO 0.00 -0.61 1.67 0.03 -0.54 0.00 0.00 174.62 175.17 3hiq h ARG 134 N -0.28 -0.05 -0.77 3.99 3.08 -1.97 -1.56 114.38 116.82 3hiq h ARG 134 Ca -0.45 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 59.60 3hiq h ARG 134 Cb 1.24 0.01 -0.04 0.00 0.08 0.00 0.00 29.97 31.27 3hiq h ARG 134 CO 0.62 -0.03 0.48 1.96 -1.07 0.00 0.00 179.97 181.92 3hiq h GLN 135 N -0.05 1.03 -0.57 0.04 7.50 -1.95 -1.05 115.11 120.05 3hiq h GLN 135 Ca 0.14 -0.08 -0.04 0.00 0.50 0.00 0.00 58.65 59.17 3hiq h GLN 135 Cb 0.27 -0.22 -0.03 0.00 0.05 0.00 0.00 27.48 27.56 3hiq h GLN 135 CO -0.33 0.71 0.18 1.96 -1.50 0.00 0.00 178.83 179.86 3hiq h GLN 136 N 1.05 0.86 0.00 1.46 4.20 -1.88 -1.43 115.11 119.37 3hiq h GLN 136 Ca 0.28 -0.16 0.00 0.00 0.06 0.00 0.00 58.65 58.83 3hiq h GLN 136 Cb -0.07 -0.14 0.00 0.00 0.30 0.00 0.00 27.48 27.58 3hiq h GLN 136 CO -0.05 0.74 0.00 0.00 -0.67 0.00 0.00 178.83 178.85 3hiq h ALA 137 N 1.36 1.00 -1.99 3.87 0.00 -0.14 -3.47 119.26 119.89 3hiq h ALA 137 Ca 0.19 0.00 0.23 0.00 0.00 0.00 0.00 54.91 55.33 3hiq h ALA 137 Cb 0.24 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 17.95 3hiq h ALA 137 CO -0.01 0.00 -0.47 0.41 0.00 0.00 0.00 179.25 179.19 3hiq n GLY 138 N 0.88 -2.12 3.14 0.00 0.00 -1.16 -5.00 105.19 100.94 3hiq n GLY 138 Ca 0.04 -1.28 -0.13 0.00 0.00 0.00 0.00 46.02 44.65 3hiq n GLY 138 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hiq s LEU 139 N -5.91 2.38 0.00 0.99 1.43 0.17 -4.90 118.68 112.83 3hiq s LEU 139 Ca 0.00 -0.77 0.00 0.00 -1.03 0.00 0.00 54.13 52.33 3hiq s LEU 139 Cb 0.00 -0.23 0.00 0.00 0.03 0.00 0.00 46.19 45.99 3hiq s LEU 139 CO 0.00 -0.28 0.00 0.61 0.23 0.00 0.00 176.35 176.91 3hiq n GLY 140 N 0.73 2.39 0.10 -3.19 0.00 -1.26 -0.91 105.19 103.06 3hiq n GLY 140 Ca -0.17 -0.93 -0.12 0.00 0.00 0.00 0.00 46.02 44.80 3hiq n GLY 140 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 3hiq h ILE 141 N 0.85 1.24 -0.40 -0.61 1.08 -1.92 0.04 117.51 117.78 3hiq h ILE 141 Ca 0.00 -0.76 -0.15 0.00 -0.39 0.00 0.00 64.86 63.55 3hiq h ILE 141 Cb 0.00 1.48 -0.01 0.00 -3.07 0.00 0.00 36.82 35.22 3hiq h ILE 141 CO 0.00 0.22 -0.35 0.11 -0.69 0.00 0.00 178.15 177.44 3hiq h LYS 142 N -0.01 0.95 -0.20 2.37 1.57 -1.94 0.37 116.57 119.68 3hiq h LYS 142 Ca 0.04 -0.48 0.06 0.00 -1.87 0.00 0.00 60.65 58.40 3hiq h LYS 142 Cb 0.33 0.01 -0.06 0.00 0.08 0.00 0.00 32.23 32.59 3hiq h LYS 142 CO 0.00 1.14 -0.23 0.87 -0.57 0.00 0.00 179.45 180.66 3hiq h LYS 143 N 0.78 -0.25 0.14 3.15 1.57 -1.89 0.14 116.57 120.21 3hiq h LYS 143 Ca 0.07 0.02 0.02 0.00 -1.87 0.00 0.00 60.65 58.88 3hiq h LYS 143 Cb 0.94 0.06 -0.03 0.00 0.08 0.00 0.00 32.23 33.28 3hiq h LYS 143 CO 0.09 -0.16 -0.26 1.25 -0.57 0.00 0.00 179.45 179.80 3hiq h LEU 144 N -0.26 -0.72 -0.82 2.94 5.85 -0.38 -2.01 115.31 119.91 3hiq h LEU 144 Ca 0.12 0.08 0.03 0.00 0.84 0.00 0.00 57.88 58.95 3hiq h LEU 144 Cb 0.44 0.27 -0.05 0.00 0.37 0.00 0.00 40.66 41.70 3hiq h LEU 144 CO -0.35 -0.35 0.53 0.00 -0.34 0.00 0.00 178.44 177.93 3hiq h ALA 145 N 0.25 1.07 -0.57 1.25 0.00 -0.08 -1.66 119.26 119.53 3hiq h ALA 145 Ca 0.02 -0.04 -0.10 0.00 0.00 0.00 0.00 54.91 54.80 3hiq h ALA 145 Cb 0.49 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 3hiq h ALA 145 CO -0.13 0.37 -0.03 1.49 0.00 0.00 0.00 179.25 180.94 3hiq h GLU 146 N 1.04 1.03 0.00 0.00 4.57 -0.60 -1.78 114.58 118.84 3hiq h GLU 146 Ca 0.32 -0.34 -0.03 0.00 -1.18 0.00 0.00 59.36 58.13 3hiq h GLU 146 Cb -0.02 -0.08 -0.00 0.00 -0.16 0.00 0.00 28.75 28.48 3hiq h GLU 146 CO -0.10 1.03 -0.13 0.66 -1.18 0.00 0.00 179.01 179.29 3hiq h SER 147 N 0.91 0.00 0.71 1.04 4.64 -0.92 -2.63 113.55 117.30 3hiq h SER 147 Ca 0.16 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.35 3hiq h SER 147 Cb 0.59 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.66 3hiq h SER 147 CO 0.04 0.13 -0.60 -0.03 -0.87 0.00 0.00 176.83 175.50 3hiq h MET 148 N 0.00 0.00 -0.49 4.77 1.85 -0.43 -2.91 114.93 117.72 3hiq h MET 148 Ca -0.00 0.00 0.14 0.00 -0.61 0.00 0.00 59.70 59.23 3hiq h MET 148 Cb 0.25 0.00 -0.02 0.00 0.43 0.00 0.00 31.60 32.26 3hiq h MET 148 CO 0.02 0.60 0.45 1.79 -0.40 0.00 0.00 176.91 179.36 3hiq h THR 149 N 0.00 0.48 -0.02 -0.77 1.35 -1.13 0.49 112.91 113.32 3hiq h THR 149 Ca -0.01 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.85 3hiq h THR 149 Cb 1.12 0.66 0.00 0.00 -1.73 0.00 0.00 68.15 68.20 3hiq h THR 149 CO 0.08 0.00 0.00 0.29 -0.25 0.00 0.00 175.52 175.64 3hiq n LYS 150 N -3.93 1.38 0.00 4.72 4.76 -1.10 -3.68 118.16 120.31 3hiq n LYS 150 Ca 0.09 -0.55 0.00 0.00 -2.87 0.00 0.00 58.31 54.98 3hiq n LYS 150 Cb 0.65 -1.47 0.00 0.00 -1.84 0.00 0.00 35.03 32.37 3hiq n LYS 150 CO 0.00 0.00 0.00 1.33 -1.37 0.00 0.00 177.40 177.36 3hiq n VAL 151 N -0.32 0.00 -2.71 -0.18 0.24 -0.12 -4.58 118.33 110.67 3hiq n VAL 151 Ca 0.21 -0.16 -0.42 0.00 -2.04 0.00 0.00 64.34 61.93 3hiq n VAL 151 Cb 0.24 0.64 -0.03 0.00 -1.47 0.00 0.00 33.84 33.22 3hiq n VAL 151 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 3hiq s ASN 152 N -1.18 6.37 -0.84 -1.34 3.84 -0.02 -3.98 114.94 117.79 3hiq s ASN 152 Ca 0.00 -1.23 -0.03 0.00 0.21 0.00 0.00 52.86 51.81 3hiq s ASN 152 Cb 0.00 -2.50 0.00 0.00 -0.55 0.00 0.00 41.25 38.21 3hiq s ASN 152 CO 0.00 -1.48 0.36 0.61 -2.79 0.00 0.00 177.10 173.80 3hiq n GLY 153 N 5.86 0.04 3.23 1.21 0.00 0.01 -4.88 105.19 110.65 3hiq n GLY 153 Ca 0.15 -0.28 -0.13 0.00 0.00 0.00 0.00 46.02 45.76 3hiq n GLY 153 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3hiq s VAL 154 N -2.90 0.34 0.39 1.61 -7.23 -1.16 -4.53 120.40 106.91 3hiq s VAL 154 Ca 0.18 -1.97 -0.27 0.00 -1.81 0.00 0.00 61.98 58.10 3hiq s VAL 154 Cb -0.08 -2.33 -0.10 0.00 0.56 0.00 0.00 36.38 34.44 3hiq s VAL 154 CO 0.22 -0.24 1.39 0.00 -0.31 0.00 0.00 175.10 176.17 3hiq s ALA 155 N -3.90 3.41 -0.04 1.32 0.00 -1.26 -2.97 121.76 118.32 3hiq s ALA 155 Ca 0.31 1.41 -0.30 0.00 0.00 0.00 0.00 51.96 53.38 3hiq s ALA 155 Cb 0.07 -3.55 -0.04 0.00 0.00 0.00 0.00 23.12 19.60 3hiq s ALA 155 CO 0.08 -0.94 1.33 0.50 0.00 0.00 0.00 175.76 176.72 3hiq s ARG 156 N -2.14 4.30 -0.27 0.00 3.52 -1.26 -4.89 118.95 118.21 3hiq s ARG 156 Ca 0.55 1.84 -0.01 0.00 -0.13 0.00 0.00 55.73 57.98 3hiq s ARG 156 Cb -0.43 -3.61 0.04 0.00 -1.56 0.00 0.00 34.95 29.39 3hiq s ARG 156 CO 0.56 -0.56 -0.04 0.08 -0.81 0.00 0.00 175.30 174.53 3hiq s VAL 157 N 2.54 2.86 0.25 7.11 1.01 -1.26 -5.03 120.40 127.88 3hiq s VAL 157 Ca 0.61 -1.23 -0.04 0.00 0.00 0.00 0.00 61.98 61.31 3hiq s VAL 157 Cb -0.28 -2.55 0.27 0.00 0.00 0.00 0.00 36.38 33.82 3hiq s VAL 157 CO 0.24 0.05 1.65 -0.08 0.00 0.00 0.00 175.10 176.96 3hiq h GLU 158 N 7.99 0.18 -0.48 2.72 4.81 -1.94 0.18 114.58 128.03 3hiq h GLU 158 Ca -0.27 -0.01 -0.10 0.00 -0.13 0.00 0.00 59.36 58.85 3hiq h GLU 158 Cb 1.08 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 30.40 3hiq h GLU 158 CO 0.55 0.12 -0.11 1.57 -0.73 0.00 0.00 179.01 180.41 3hiq h LYS 159 N 0.18 0.89 0.33 1.92 2.10 -1.92 0.29 116.57 120.36 3hiq h LYS 159 Ca 0.45 -0.31 -0.01 0.00 -2.00 0.00 0.00 60.65 58.77 3hiq h LYS 159 Cb 0.81 -0.07 -0.00 0.00 -0.90 0.00 0.00 32.23 32.07 3hiq h LYS 159 CO -0.61 0.95 -0.18 -0.44 -2.00 0.00 0.00 179.45 177.17 3hiq h ASP 160 N 0.80 -0.44 -0.49 7.07 3.32 -1.38 -1.80 116.42 123.50 3hiq h ASP 160 Ca 0.13 0.02 0.07 0.00 0.02 0.00 0.00 57.03 57.27 3hiq h ASP 160 Cb 0.63 0.12 -0.06 0.00 0.22 0.00 0.00 39.33 40.24 3hiq h ASP 160 CO 0.04 -0.30 0.17 -0.08 -1.72 0.00 0.00 179.24 177.36 3hiq h GLU 161 N -0.48 0.34 -0.43 3.56 4.81 -0.24 -1.78 114.58 120.35 3hiq h GLU 161 Ca -0.04 -0.02 -0.03 0.00 -0.13 0.00 0.00 59.36 59.14 3hiq h GLU 161 Cb 0.38 -0.08 -0.02 0.00 0.63 0.00 0.00 28.75 29.66 3hiq h GLU 161 CO 0.05 0.22 0.15 0.00 -0.73 0.00 0.00 179.01 178.71 3hiq h ALA 162 N 1.33 1.45 -0.26 2.92 0.00 -0.30 0.48 119.26 124.88 3hiq h ALA 162 Ca 0.24 -0.14 -0.11 0.00 0.00 0.00 0.00 54.91 54.90 3hiq h ALA 162 Cb 0.25 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.85 3hiq h ALA 162 CO -0.24 0.42 -0.27 1.25 0.00 0.00 0.00 179.25 180.40 3hiq h LEU 163 N 0.62 0.68 -0.28 0.00 5.85 -0.66 0.11 115.31 121.62 3hiq h LEU 163 Ca 0.15 -0.48 0.03 0.00 0.84 0.00 0.00 57.88 58.42 3hiq h LEU 163 Cb 0.17 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 40.97 3hiq h LEU 163 CO -0.01 1.02 0.09 0.15 -0.34 0.00 0.00 178.44 179.35 3hiq h PHE 164 N 0.35 0.15 -0.85 1.25 3.57 -0.76 -1.97 116.94 118.70 3hiq h PHE 164 Ca 0.04 0.02 -0.03 0.00 3.53 0.00 0.00 57.97 61.52 3hiq h PHE 164 Cb 0.84 -0.03 -0.04 0.00 2.79 0.00 0.00 35.95 39.51 3hiq h PHE 164 CO 0.08 0.06 0.41 -0.07 -2.23 0.00 0.00 178.31 176.56 3hiq h LEU 165 N 0.21 1.11 -0.21 0.59 3.38 -0.72 -0.52 115.31 119.16 3hiq h LEU 165 Ca 0.13 -0.13 0.04 0.00 0.09 0.00 0.00 57.88 58.00 3hiq h LEU 165 Cb 0.11 -0.29 -0.04 0.00 0.09 0.00 0.00 40.66 40.53 3hiq h LEU 165 CO -0.14 0.93 -0.04 0.25 0.09 0.00 0.00 178.44 179.54 3hiq h LEU 166 N 1.21 -0.16 -0.10 1.67 6.46 -0.48 -1.64 115.31 122.28 3hiq h LEU 166 Ca 0.29 0.06 -0.14 0.00 -0.12 0.00 0.00 57.88 57.97 3hiq h LEU 166 Cb 0.12 0.11 0.01 0.00 -0.73 0.00 0.00 40.66 40.17 3hiq h LEU 166 CO -0.04 -0.05 -0.50 0.40 -0.62 0.00 0.00 178.44 177.63 3hiq h ILE 167 N 0.02 1.37 -0.19 4.05 2.04 -1.02 -3.32 117.51 120.45 3hiq h ILE 167 Ca 0.10 -1.83 -0.13 0.00 1.00 0.00 0.00 64.86 64.00 3hiq h ILE 167 Cb 0.14 2.21 -0.01 0.00 -0.74 0.00 0.00 36.82 38.42 3hiq h ILE 167 CO -0.20 0.55 -0.41 1.62 0.00 0.00 0.00 178.15 179.71 3hiq h VAL 168 N 0.11 1.31 0.00 1.67 3.04 -0.97 0.38 116.25 121.79 3hiq h VAL 168 Ca -0.03 -1.57 -0.03 0.00 -1.01 0.00 0.00 66.70 64.05 3hiq h VAL 168 Cb 1.15 1.61 -0.00 0.00 -2.01 0.00 0.00 31.29 32.03 3hiq h VAL 168 CO 0.10 0.49 -0.13 -0.37 -1.01 0.00 0.00 177.57 176.65 3hiq h VAL 169 N 0.38 0.67 0.20 1.51 -1.51 -1.41 -0.46 116.25 115.62 3hiq h VAL 169 Ca 0.03 -0.53 -0.35 0.00 -1.23 0.00 0.00 66.70 64.62 3hiq h VAL 169 Cb 0.89 1.33 0.01 0.00 -2.13 0.00 0.00 31.29 31.39 3hiq h VAL 169 CO 0.08 0.12 -1.73 1.56 -1.23 0.00 0.00 177.57 176.37 3hiq h GLN 170 N 0.00 0.41 0.00 5.19 4.20 -1.42 0.52 115.11 124.02 3hiq h GLN 170 Ca -0.00 -0.71 -0.06 0.00 0.06 0.00 0.00 58.65 57.94 3hiq h GLN 170 Cb 0.32 0.26 -0.01 0.00 0.30 0.00 0.00 27.48 28.35 3hiq h GLN 170 CO 0.02 1.34 -0.29 0.52 -0.67 0.00 0.00 178.83 179.74 3hiq h MET 171 N 0.11 0.00 0.00 1.46 2.86 -0.40 0.33 114.93 119.29 3hiq h MET 171 Ca -0.34 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.30 3hiq h MET 171 Cb 2.11 0.00 0.00 0.00 0.06 0.00 0.00 31.60 33.77 3hiq h MET 171 CO 0.19 0.29 -0.08 0.28 1.06 0.00 0.00 176.91 178.65 3hiq n VAL 172 N -3.96 0.20 0.48 -2.22 0.31 -0.23 -4.53 118.33 108.37 3hiq n VAL 172 Ca -0.02 0.28 -0.20 0.00 -0.01 0.00 0.00 64.34 64.39 3hiq n VAL 172 Cb 0.36 -1.39 -0.10 0.00 -0.91 0.00 0.00 33.84 31.80 3hiq n VAL 172 CO 0.00 0.00 0.00 1.23 -1.32 0.00 0.00 176.83 176.74 3hiq h GLY 173 N -0.08 -1.26 1.49 2.92 0.00 -1.41 -1.90 103.07 102.83 3hiq h GLY 173 Ca 0.00 0.47 -0.10 0.00 0.00 0.00 0.00 47.33 47.70 3hiq h GLY 173 CO 0.00 -0.46 -0.22 0.83 0.00 0.00 0.00 176.54 176.69 3hiq h GLU 174 N -1.22 0.59 0.00 4.80 4.39 -0.86 -2.27 114.58 120.02 3hiq h GLU 174 Ca -0.12 -0.22 -0.07 0.00 0.34 0.00 0.00 59.36 59.29 3hiq h GLU 174 Cb 0.93 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 29.53 3hiq h GLU 174 CO 0.20 0.77 -0.31 0.00 -1.16 0.00 0.00 179.01 178.52 3hiq h ALA 175 N 1.23 1.37 0.00 3.43 0.00 -0.95 0.21 119.26 124.56 3hiq h ALA 175 Ca 0.08 -0.28 -0.21 0.00 0.00 0.00 0.00 54.91 54.49 3hiq h ALA 175 Cb 0.67 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.41 3hiq h ALA 175 CO 0.05 0.39 -0.92 0.00 0.00 0.00 0.00 179.25 178.77 3hiq h ALA 176 N 1.69 0.43 -0.45 0.00 0.00 -0.79 -3.15 119.26 116.99 3hiq h ALA 176 Ca -0.00 -0.72 -0.09 0.00 0.00 0.00 0.00 54.91 54.10 3hiq h ALA 176 Cb 0.59 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.32 3hiq h ALA 176 CO 0.04 0.86 -0.10 0.00 0.00 0.00 0.00 179.25 180.06 3hiq h ARG 177 N 0.18 0.80 -3.93 0.00 3.08 -1.06 -3.24 114.38 110.21 3hiq h ARG 177 Ca -0.06 -0.26 -0.55 0.00 0.07 0.00 0.00 59.98 59.18 3hiq h ARG 177 Cb 1.55 -0.07 -0.39 0.00 0.08 0.00 0.00 29.97 31.14 3hiq h ARG 177 CO 0.15 0.87 -0.78 -0.06 -1.07 0.00 0.00 179.97 179.08 3hiq s PHE 178 N -4.82 1.55 0.59 3.04 0.40 0.03 0.88 117.98 119.64 3hiq s PHE 178 Ca -0.09 -1.12 0.29 0.00 -0.60 0.00 0.00 56.93 55.41 3hiq s PHE 178 Cb 0.14 -1.24 1.77 0.00 0.51 0.00 0.00 43.02 44.20 3hiq s PHE 178 CO 0.82 -0.64 2.20 0.87 0.70 0.00 0.00 175.22 179.17 3hiq h LYS 179 N 8.14 0.00 -0.84 0.44 1.57 -1.13 -1.37 116.57 123.39 3hiq h LYS 179 Ca -0.19 0.00 0.18 0.00 -1.87 0.00 0.00 60.65 58.77 3hiq h LYS 179 Cb 1.10 0.00 -0.11 0.00 0.08 0.00 0.00 32.23 33.31 3hiq h LYS 179 CO 0.37 0.00 0.36 -0.92 -0.57 0.00 0.00 179.45 178.69 3hiq h TYR 180 N 0.00 0.61 0.16 -1.35 5.03 -0.93 0.23 116.97 120.72 3hiq h TYR 180 Ca 0.03 0.04 -0.26 0.00 2.58 0.00 0.00 58.73 61.12 3hiq h TYR 180 Cb 0.17 -0.14 0.02 0.00 1.55 0.00 0.00 36.73 38.32 3hiq h TYR 180 CO 0.00 0.03 -1.23 0.82 -1.32 0.00 0.00 178.16 176.46 3hiq h ILE 181 N 0.46 1.25 -0.15 1.81 2.04 -1.55 -2.40 117.51 118.97 3hiq h ILE 181 Ca 0.49 -2.52 0.05 0.00 1.00 0.00 0.00 64.86 63.87 3hiq h ILE 181 Cb 0.82 2.97 -0.05 0.00 -0.74 0.00 0.00 36.82 39.82 3hiq h ILE 181 CO -0.46 0.75 -0.16 -0.08 0.00 0.00 0.00 178.15 178.20 3hiq h GLU 182 N -0.20 -0.19 -0.88 2.37 4.81 -1.35 -2.19 114.58 116.95 3hiq h GLU 182 Ca -0.24 0.01 0.01 0.00 -0.13 0.00 0.00 59.36 59.01 3hiq h GLU 182 Cb 1.83 0.04 -0.04 0.00 0.63 0.00 0.00 28.75 31.21 3hiq h GLU 182 CO 0.15 -0.13 0.58 -0.91 -0.73 0.00 0.00 179.01 177.98 3hiq h ASN 183 N -0.20 1.01 -0.79 1.04 2.35 -0.63 0.20 115.58 118.57 3hiq h ASN 183 Ca 0.10 -0.03 0.03 0.00 -0.55 0.00 0.00 56.30 55.85 3hiq h ASN 183 Cb 0.35 -0.25 -0.05 0.00 0.05 0.00 0.00 38.32 38.42 3hiq h ASN 183 CO -0.27 0.73 0.51 -0.07 -1.65 0.00 0.00 177.43 176.68 3hiq h LEU 184 N 1.19 0.85 -0.02 1.61 3.38 -1.14 0.35 115.31 121.52 3hiq h LEU 184 Ca 0.32 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.28 3hiq h LEU 184 Cb -0.13 -0.19 -0.00 0.00 0.09 0.00 0.00 40.66 40.43 3hiq h LEU 184 CO -0.07 0.59 0.00 0.58 0.09 0.00 0.00 178.44 179.63 3hiq h VAL 185 N 1.00 1.21 -0.84 1.22 2.07 -0.61 -2.60 116.25 117.69 3hiq h VAL 185 Ca 0.31 -0.63 0.10 0.00 0.82 0.00 0.00 66.70 67.30 3hiq h VAL 185 Cb -0.02 1.60 -0.06 0.00 -1.52 0.00 0.00 31.29 31.29 3hiq h VAL 185 CO -0.10 0.17 0.55 -0.07 0.02 0.00 0.00 177.57 178.13 3hiq h LEU 186 N -0.23 0.72 -0.72 2.57 3.38 -0.43 -1.76 115.31 118.84 3hiq h LEU 186 Ca 0.01 0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.00 3hiq h LEU 186 Cb 0.27 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.89 3hiq h LEU 186 CO 0.00 0.42 -0.02 0.59 0.09 0.00 0.00 178.44 179.52 3hiq n ASN 187 N -4.52 1.15 -1.49 -0.43 3.02 0.12 -3.32 115.26 109.78 3hiq n ASN 187 Ca 0.14 -1.32 0.00 0.00 -0.03 0.00 0.00 54.58 53.38 3hiq n ASN 187 Cb 0.33 0.01 0.09 0.00 -0.61 0.00 0.00 39.78 39.59 3hiq n ASN 187 CO 0.00 0.00 0.00 0.59 -2.62 0.00 0.00 177.26 175.23 3hiq n ASN 188 N -0.15 1.88 0.19 6.41 3.02 -0.73 -4.96 115.26 120.91 3hiq n ASN 188 Ca 0.19 -2.88 -0.13 0.00 -0.03 0.00 0.00 54.58 51.73 3hiq n ASN 188 Cb 0.31 -0.41 -0.07 0.00 -0.61 0.00 0.00 39.78 38.99 3hiq n ASN 188 CO 0.00 0.00 0.00 0.15 -2.62 0.00 0.00 177.26 174.79 3hiq h PHE 189 N 1.42 -0.47 -0.45 3.10 3.57 -1.38 -3.31 116.94 119.42 3hiq h PHE 189 Ca -0.06 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.43 3hiq h PHE 189 Cb 1.45 0.16 0.00 0.00 2.79 0.00 0.00 35.95 40.35 3hiq h PHE 189 CO 0.52 -0.14 0.00 -0.25 -2.23 0.00 0.00 178.31 176.20 3hiq n ASP 190 N -5.16 4.63 -4.99 0.41 8.00 -1.26 -4.87 116.55 113.30 3hiq n ASP 190 Ca -0.10 -2.69 -0.19 0.00 0.71 0.00 0.00 54.79 52.53 3hiq n ASP 190 Cb 0.28 -0.63 0.02 0.00 -0.02 0.00 0.00 41.12 40.77 3hiq n ASP 190 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 3hiq s THR 191 N -2.32 2.85 -0.01 -3.53 -4.23 -1.24 -5.04 115.64 102.12 3hiq s THR 191 Ca 0.42 -0.88 -0.25 0.00 -1.18 0.00 0.00 61.69 59.80 3hiq s THR 191 Cb 0.32 -2.97 -0.19 0.00 1.34 0.00 0.00 72.50 71.00 3hiq s THR 191 CO 0.13 0.00 1.29 0.00 -0.54 0.00 0.00 174.62 175.50 3hiq h ALA 192 N 0.42 -0.09 0.00 3.99 0.00 -1.92 -3.28 119.26 118.38 3hiq h ALA 192 Ca -0.40 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.30 3hiq h ALA 192 Cb 1.29 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.11 3hiq h ALA 192 CO 0.47 -0.34 -0.37 0.87 0.00 0.00 0.00 179.25 179.88 3hiq h LYS 193 N -0.51 0.00 0.00 0.00 1.79 -1.96 -3.50 116.57 112.40 3hiq h LYS 193 Ca -0.01 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.46 3hiq h LYS 193 Cb 0.44 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.09 3hiq h LYS 193 CO 0.01 0.00 0.00 0.39 -1.08 0.00 0.00 179.45 178.77 3hiq n GLU 194 N -2.53 0.00 -2.76 3.15 1.02 -1.24 -3.93 120.64 114.35 3hiq n GLU 194 Ca 0.03 0.00 -0.43 0.00 -0.02 0.00 0.00 57.16 56.75 3hiq n GLU 194 Cb 0.48 0.00 -0.04 0.00 -0.02 0.00 0.00 31.44 31.87 3hiq n GLU 194 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3hiq s VAL 195 N 0.00 4.23 -0.29 2.62 1.01 -0.09 -4.95 120.40 122.93 3hiq s VAL 195 Ca 0.00 0.36 -0.14 0.00 0.00 0.00 0.00 61.98 62.20 3hiq s VAL 195 Cb 0.00 -4.63 0.12 0.00 0.00 0.00 0.00 36.38 31.87 3hiq s VAL 195 CO 0.00 -1.28 0.79 -0.70 0.00 0.00 0.00 175.10 173.91 3hiq s GLU 196 N 4.36 0.54 0.68 2.72 2.12 -1.25 0.43 118.70 128.30 3hiq s GLU 196 Ca 0.33 1.09 -0.11 0.00 0.36 0.00 0.00 54.97 56.64 3hiq s GLU 196 Cb -0.11 0.37 0.00 0.00 0.26 0.00 0.00 34.13 34.65 3hiq s GLU 196 CO 0.19 -0.14 1.06 -1.25 -0.54 0.00 0.00 175.26 174.58 3hiq s PRO 197 N 2.04 3.04 -0.02 4.30 0.04 -1.26 -5.03 135.00 138.10 3hiq s PRO 197 Ca -0.08 0.81 -0.30 0.00 0.04 0.00 0.00 61.00 61.48 3hiq s PRO 197 Cb -0.07 -2.01 -0.08 0.00 0.04 0.00 0.00 34.50 32.38 3hiq s PRO 197 CO -0.18 -0.99 2.03 0.28 0.04 0.00 0.00 177.00 178.18 3hiq n VAL 198 N -3.04 0.68 -1.59 -0.36 0.31 -0.54 -4.90 118.33 108.89 3hiq n VAL 198 Ca 0.07 -0.21 -0.40 0.00 -0.01 0.00 0.00 64.34 63.79 3hiq n VAL 198 Cb 0.54 -2.36 0.02 0.00 -0.91 0.00 0.00 33.84 31.14 3hiq n VAL 198 CO 0.00 0.00 0.00 -2.65 -1.32 0.00 0.00 176.83 172.86 3hiq n PRO 199 N 7.78 1.13 -0.34 5.55 -0.02 -1.26 -4.69 135.00 143.15 3hiq n PRO 199 Ca 0.22 0.42 0.15 0.00 -2.02 0.00 0.00 63.50 62.27 3hiq n PRO 199 Cb 0.41 -2.03 0.37 0.00 -0.02 0.00 0.00 33.50 32.23 3hiq n PRO 199 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 3hiq h ASP 200 N 1.11 0.70 0.30 2.55 3.32 -2.00 -1.70 116.42 120.70 3hiq h ASP 200 Ca -0.46 0.09 -0.04 0.00 0.02 0.00 0.00 57.03 56.65 3hiq h ASP 200 Cb 1.35 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 40.87 3hiq h ASP 200 CO 0.54 0.23 -0.20 0.03 -1.72 0.00 0.00 179.24 178.12 3hiq h ARG 201 N 0.67 0.00 0.04 3.56 3.08 -1.99 0.80 114.38 120.55 3hiq h ARG 201 Ca 0.58 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.62 3hiq h ARG 201 Cb 1.02 0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.07 3hiq h ARG 201 CO -0.36 0.20 -0.02 0.28 -1.07 0.00 0.00 179.97 179.00 3hiq h VAL 202 N 0.00 1.24 -0.96 2.04 2.07 -1.66 0.97 116.25 119.95 3hiq h VAL 202 Ca -0.00 -0.90 0.12 0.00 0.82 0.00 0.00 66.70 66.74 3hiq h VAL 202 Cb 0.40 1.83 -0.08 0.00 -1.52 0.00 0.00 31.29 31.93 3hiq h VAL 202 CO 0.03 0.23 0.61 0.40 0.02 0.00 0.00 177.57 178.85 3hiq h ILE 203 N -0.45 0.90 0.23 4.57 1.08 -1.25 -1.50 117.51 121.09 3hiq h ILE 203 Ca -0.01 -0.31 -0.01 0.00 -0.39 0.00 0.00 64.86 64.14 3hiq h ILE 203 Cb 0.41 -0.08 0.00 0.00 -3.07 0.00 0.00 36.82 34.09 3hiq h ILE 203 CO 0.01 0.16 -0.11 0.40 -0.69 0.00 0.00 178.15 177.92 3hiq h ILE 204 N 0.90 0.84 -0.45 -0.67 2.04 -0.69 -3.14 117.51 116.35 3hiq h ILE 204 Ca 0.47 -0.42 0.08 0.00 1.00 0.00 0.00 64.86 66.00 3hiq h ILE 204 Cb 0.54 1.08 -0.07 0.00 -0.74 0.00 0.00 36.82 37.63 3hiq h ILE 204 CO -0.24 0.09 0.03 -0.07 0.00 0.00 0.00 178.15 177.97 3hiq h LEU 205 N -0.52 -0.12 -2.16 1.44 3.38 -0.16 -0.84 115.31 116.34 3hiq h LEU 205 Ca -0.03 0.10 0.04 0.00 0.09 0.00 0.00 57.88 58.08 3hiq h LEU 205 Cb 0.38 0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 3hiq h LEU 205 CO 0.05 -0.03 0.29 -0.33 0.09 0.00 0.00 178.44 178.52 3hiq h GLU 206 N 0.15 0.00 -0.20 1.13 5.08 -1.33 0.49 114.58 119.90 3hiq h GLU 206 Ca 0.22 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.58 3hiq h GLU 206 Cb 0.32 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.57 3hiq h GLU 206 CO -0.34 0.00 0.00 -1.71 -1.00 0.00 0.00 179.01 175.96 3hiq n ASN 207 N -3.34 2.40 -0.31 1.42 4.05 -0.33 -4.48 115.26 114.67 3hiq n ASN 207 Ca 0.01 -1.82 0.00 0.00 0.45 0.00 0.00 54.58 53.23 3hiq n ASN 207 Cb 0.39 -0.12 0.00 0.00 1.23 0.00 0.00 39.78 41.28 3hiq n ASN 207 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 177.26 174.80 3hiq n ASN 208 N 0.82 0.04 0.02 1.20 3.02 0.17 -4.87 115.26 115.66 3hiq n ASN 208 Ca 0.17 -1.64 -0.11 0.00 -0.03 0.00 0.00 54.58 52.97 3hiq n ASN 208 Cb 0.46 -0.13 -0.06 0.00 -0.61 0.00 0.00 39.78 39.44 3hiq n ASN 208 CO 0.00 0.00 0.00 -0.25 -2.62 0.00 0.00 177.26 174.39 3hiq h TRP 209 N 0.00 -0.03 0.14 3.10 7.01 -1.74 0.14 115.95 124.58 3hiq h TRP 209 Ca 0.00 0.01 0.02 0.00 2.11 0.00 0.00 58.89 61.02 3hiq h TRP 209 Cb 1.24 0.02 -0.04 0.00 -2.10 0.00 0.00 29.16 28.29 3hiq h TRP 209 CO 0.06 -0.03 -0.31 0.78 -2.79 0.00 0.00 178.44 176.15 3hiq h GLY 210 N -0.00 -0.61 0.41 2.65 0.00 -1.91 -0.33 103.07 103.28 3hiq h GLY 210 Ca 0.03 0.37 0.08 0.00 0.00 0.00 0.00 47.33 47.80 3hiq h GLY 210 CO -0.06 -0.25 0.11 -2.00 0.00 0.00 0.00 176.54 174.34 3hiq h LEU 211 N -0.55 0.03 -1.44 3.11 7.12 -1.88 -1.71 115.31 119.99 3hiq h LEU 211 Ca 0.02 0.08 -0.04 0.00 0.13 0.00 0.00 57.88 58.07 3hiq h LEU 211 Cb 0.57 0.10 -0.01 0.00 -0.53 0.00 0.00 40.66 40.79 3hiq h LEU 211 CO -0.17 0.05 -0.07 -0.07 -0.13 0.00 0.00 178.44 178.05 3hiq h LEU 212 N 0.25 0.26 -0.23 2.25 3.38 -0.43 0.25 115.31 121.04 3hiq h LEU 212 Ca 0.24 -0.04 -0.09 0.00 0.09 0.00 0.00 57.88 58.07 3hiq h LEU 212 Cb 0.30 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 40.98 3hiq h LEU 212 CO -0.30 0.37 -0.20 0.28 0.09 0.00 0.00 178.44 178.68 3hiq h SER 213 N 0.27 0.58 -0.08 -0.43 0.02 -0.70 -0.22 113.55 113.00 3hiq h SER 213 Ca 0.06 -0.46 -0.00 0.00 -0.84 0.00 0.00 61.79 60.55 3hiq h SER 213 Cb 0.30 -0.16 -0.00 0.00 0.14 0.00 0.00 62.40 62.67 3hiq h SER 213 CO 0.01 0.92 0.04 0.03 -1.14 0.00 0.00 176.83 176.69 3hiq h ARG 214 N 0.25 0.11 -0.68 3.45 3.08 -0.99 -2.45 114.38 117.14 3hiq h ARG 214 Ca 0.04 -0.01 0.03 0.00 0.07 0.00 0.00 59.98 60.11 3hiq h ARG 214 Cb 0.74 -0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.73 3hiq h ARG 214 CO 0.05 0.15 0.45 0.00 -1.07 0.00 0.00 179.97 179.55 3hiq h ALA 215 N 0.95 1.62 -0.07 0.04 0.00 -0.96 -2.56 119.26 118.27 3hiq h ALA 215 Ca 0.03 -0.03 -0.09 0.00 0.00 0.00 0.00 54.91 54.81 3hiq h ALA 215 Cb 0.08 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 3hiq h ALA 215 CO -0.00 0.31 -0.38 0.00 0.00 0.00 0.00 179.25 179.17 3hiq h ALA 216 N 1.60 1.22 0.00 0.00 0.00 -0.81 -2.47 119.26 118.81 3hiq h ALA 216 Ca 0.27 -0.38 -0.06 0.00 0.00 0.00 0.00 54.91 54.75 3hiq h ALA 216 Cb 0.07 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 3hiq h ALA 216 CO -0.08 0.54 -0.26 -0.22 0.00 0.00 0.00 179.25 179.23 3hiq h LYS 217 N 0.13 0.00 -0.28 0.00 3.64 -1.01 -0.83 116.57 118.22 3hiq h LYS 217 Ca 0.01 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 3hiq h LYS 217 Cb 0.74 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.56 3hiq h LYS 217 CO 0.06 0.26 0.00 0.25 -2.27 0.00 0.00 179.45 177.75 3hiq n THR 218 N -3.90 2.31 -2.15 1.00 -2.24 -1.02 -4.21 114.28 104.07 3hiq n THR 218 Ca -0.02 -1.84 -0.32 0.00 -2.27 0.00 0.00 64.05 59.60 3hiq n THR 218 Cb 0.34 -0.25 -0.01 0.00 -2.10 0.00 0.00 70.33 68.31 3hiq n THR 218 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3hiq s ALA 219 N -2.81 3.08 -0.31 6.98 0.00 -0.96 -4.05 121.76 123.69 3hiq s ALA 219 Ca 0.43 0.06 -0.01 0.00 0.00 0.00 0.00 51.96 52.43 3hiq s ALA 219 Cb 0.34 -3.10 0.06 0.00 0.00 0.00 0.00 23.12 20.42 3hiq s ALA 219 CO 0.09 -0.45 0.02 -0.80 0.00 0.00 0.00 175.76 174.62 3hiq s ASN 220 N -3.58 4.90 -1.38 0.00 -0.87 -0.32 -4.42 114.94 109.27 3hiq s ASN 220 Ca 0.57 -1.38 -0.03 0.00 -1.57 0.00 0.00 52.86 50.45 3hiq s ASN 220 Cb -0.10 -1.71 0.02 0.00 -0.02 0.00 0.00 41.25 39.43 3hiq s ASN 220 CO 0.42 -0.29 0.69 0.59 -2.57 0.00 0.00 177.10 175.94 3hiq n ASN 221 N 4.60 -1.65 -0.01 -1.22 5.03 -0.97 -1.87 115.26 119.17 3hiq n ASN 221 Ca -0.11 -0.86 -0.00 0.00 0.87 0.00 0.00 54.58 54.47 3hiq n ASN 221 Cb 0.43 -3.76 -0.00 0.00 -1.02 0.00 0.00 39.78 35.43 3hiq n ASN 221 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 3hiq n GLY 222 N -1.68 0.42 3.32 7.41 0.00 0.44 -4.97 105.19 110.12 3hiq n GLY 222 Ca -0.23 -0.03 -0.36 0.00 0.00 0.00 0.00 46.02 45.39 3hiq n GLY 222 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hiq s VAL 223 N -1.83 3.68 0.22 1.61 1.01 -0.78 -0.93 120.40 123.37 3hiq s VAL 223 Ca 0.00 -0.69 -0.32 0.00 0.00 0.00 0.00 61.98 60.97 3hiq s VAL 223 Cb 0.00 -2.84 -0.13 0.00 0.00 0.00 0.00 36.38 33.41 3hiq s VAL 223 CO 0.00 0.18 1.61 0.49 0.00 0.00 0.00 175.10 177.38 3hiq n PHE 224 N 4.82 2.55 -0.29 5.22 3.72 -0.67 -1.17 117.46 131.64 3hiq n PHE 224 Ca -0.16 0.21 0.09 0.00 -0.05 0.00 0.00 57.45 57.55 3hiq n PHE 224 Cb 0.48 -2.59 0.22 0.00 -0.94 0.00 0.00 39.48 36.66 3hiq n PHE 224 CO 0.00 0.00 0.00 0.37 -0.05 0.00 0.00 176.76 177.08 3hiq h GLN 225 N 5.71 0.11 -4.87 -1.08 4.15 -1.85 -3.37 115.11 113.91 3hiq h GLN 225 Ca -0.45 -0.01 -0.54 0.00 0.77 0.00 0.00 58.65 58.42 3hiq h GLN 225 Cb 1.23 -0.03 -0.33 0.00 0.21 0.00 0.00 27.48 28.57 3hiq h GLN 225 CO 0.87 0.07 -0.83 0.99 -1.93 0.00 0.00 178.83 178.01 3hiq s THR 226 N -6.04 1.30 0.50 2.39 2.01 -1.26 -5.11 115.64 109.44 3hiq s THR 226 Ca -0.13 -0.60 -0.21 0.00 0.31 0.00 0.00 61.69 61.05 3hiq s THR 226 Cb 0.25 -1.15 -0.08 0.00 0.01 0.00 0.00 72.50 71.52 3hiq s THR 226 CO 0.76 0.39 0.93 -2.65 -0.69 0.00 0.00 174.62 173.36 3hiq n PRO 227 N 3.54 1.09 -4.53 4.92 -0.02 -1.26 -4.99 135.00 133.75 3hiq n PRO 227 Ca -0.21 0.40 -0.34 0.00 -2.02 0.00 0.00 63.50 61.34 3hiq n PRO 227 Cb 0.52 -2.05 -0.11 0.00 -0.02 0.00 0.00 33.50 31.85 3hiq n PRO 227 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 3hiq s LEU 228 N -0.89 3.30 -0.39 2.45 1.43 -0.02 -4.95 118.68 119.60 3hiq s LEU 228 Ca 0.68 0.02 -0.09 0.00 -1.03 0.00 0.00 54.13 53.71 3hiq s LEU 228 Cb -0.49 -1.75 0.06 0.00 0.03 0.00 0.00 46.19 44.03 3hiq s LEU 228 CO 0.53 0.36 0.21 -0.69 0.23 0.00 0.00 176.35 176.99 3hiq s VAL 229 N -0.86 4.22 -0.01 -1.59 1.01 -1.26 -0.11 120.40 121.80 3hiq s VAL 229 Ca 0.13 -1.21 -0.20 0.00 0.00 0.00 0.00 61.98 60.70 3hiq s VAL 229 Cb -0.11 -3.49 -0.05 0.00 0.00 0.00 0.00 36.38 32.73 3hiq s VAL 229 CO 0.03 -0.37 0.59 -0.76 0.00 0.00 0.00 175.10 174.59 3hiq s LEU 230 N 1.45 4.41 0.21 3.92 1.43 0.15 -4.83 118.68 125.43 3hiq s LEU 230 Ca 0.02 1.15 -0.01 0.00 -1.03 0.00 0.00 54.13 54.26 3hiq s LEU 230 Cb -0.21 -2.91 -0.04 0.00 0.03 0.00 0.00 46.19 43.06 3hiq s LEU 230 CO 0.03 0.10 0.16 0.42 0.23 0.00 0.00 176.35 177.30 3hiq s THR 231 N -0.18 0.00 -0.03 5.49 -4.23 -1.26 -0.12 115.64 115.31 3hiq s THR 231 Ca 0.31 -1.97 -0.11 0.00 -1.18 0.00 0.00 61.69 58.74 3hiq s THR 231 Cb -0.18 -2.49 0.02 0.00 1.34 0.00 0.00 72.50 71.19 3hiq s THR 231 CO 0.17 0.00 0.23 -0.55 -0.54 0.00 0.00 174.62 173.93 3hiq s SER 232 N -3.17 -0.13 0.62 3.99 0.15 -1.26 -4.91 113.70 108.99 3hiq s SER 232 Ca 0.38 0.08 0.40 0.00 0.70 0.00 0.00 55.95 57.51 3hiq s SER 232 Cb 0.06 0.32 2.16 0.00 -1.71 0.00 0.00 66.02 66.85 3hiq s SER 232 CO 0.13 -0.33 2.21 0.10 1.20 0.00 0.00 173.24 176.55 3hiq h TYR 233 N 4.47 0.00 0.00 3.44 -0.00 -1.98 -2.12 116.97 120.78 3hiq h TYR 233 Ca -0.29 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.44 3hiq h TYR 233 Cb 1.19 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.92 3hiq h TYR 233 CO 0.52 0.00 -0.63 0.00 -0.00 0.00 0.00 178.16 178.05 3hiq n ALA 234 N -2.01 3.05 -3.29 0.10 0.00 -1.26 -4.04 120.51 113.06 3hiq n ALA 234 Ca -0.03 -0.27 -0.25 0.00 0.00 0.00 0.00 53.44 52.88 3hiq n ALA 234 Cb 0.11 -1.15 -0.07 0.00 0.00 0.00 0.00 19.45 18.34 3hiq n ALA 234 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 3hiq n VAL 235 N -1.99 1.09 -2.07 0.00 0.24 -0.80 -5.09 118.33 109.72 3hiq n VAL 235 Ca 0.04 -4.74 -0.41 0.00 -2.04 0.00 0.00 64.34 57.19 3hiq n VAL 235 Cb 0.42 -1.93 -0.02 0.00 -1.47 0.00 0.00 33.84 30.84 3hiq n VAL 235 CO 0.00 0.00 0.00 -2.16 -2.14 0.00 0.00 176.83 172.53 3hiq s PRO 236 N -2.02 4.31 0.00 7.34 0.04 -1.22 -2.57 135.00 140.88 3hiq s PRO 236 Ca 0.39 2.26 0.00 0.00 0.04 0.00 0.00 61.00 63.68 3hiq s PRO 236 Cb 0.17 -3.09 0.00 0.00 0.04 0.00 0.00 34.50 31.63 3hiq s PRO 236 CO -0.06 -0.29 0.00 0.41 0.04 0.00 0.00 177.00 177.10 3hiq n GLY 237 N 1.36 0.74 3.14 0.56 0.00 -1.26 -5.04 105.19 104.69 3hiq n GLY 237 Ca 0.03 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.74 3hiq n GLY 237 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hiq s VAL 238 N -2.53 1.82 0.15 1.61 1.01 -1.06 -5.13 120.40 116.27 3hiq s VAL 238 Ca 0.00 -0.85 0.07 0.00 0.00 0.00 0.00 61.98 61.20 3hiq s VAL 238 Cb 0.00 -1.61 -0.04 0.00 0.00 0.00 0.00 36.38 34.73 3hiq s VAL 238 CO 0.00 0.50 -0.15 -1.83 0.00 0.00 0.00 175.10 173.63 3hiq s GLU 239 N 0.69 1.16 -0.26 2.72 -1.05 -1.26 -4.45 118.70 116.25 3hiq s GLU 239 Ca -0.12 -1.38 0.00 0.00 -0.15 0.00 0.00 54.97 53.32 3hiq s GLU 239 Cb -0.16 -1.02 0.07 0.00 -0.44 0.00 0.00 34.13 32.58 3hiq s GLU 239 CO 0.02 0.19 0.00 -0.46 0.95 0.00 0.00 175.26 175.96 3hiq s TRP 240 N -2.44 2.19 -0.25 4.83 -0.00 0.83 -4.93 118.94 119.18 3hiq s TRP 240 Ca 0.14 -1.75 -0.24 0.00 -0.00 0.00 0.00 56.10 54.26 3hiq s TRP 240 Cb -0.03 -1.67 -0.01 0.00 -0.00 0.00 0.00 33.47 31.76 3hiq s TRP 240 CO 0.04 -0.79 0.79 1.03 -0.00 0.00 0.00 176.95 178.03 3hiq s ARG 241 N 1.46 4.15 0.09 5.86 0.52 -1.25 0.34 118.95 130.11 3hiq s ARG 241 Ca -0.00 0.85 0.09 0.00 -0.52 0.00 0.00 55.73 56.15 3hiq s ARG 241 Cb -0.18 -3.65 -0.04 0.00 0.52 0.00 0.00 34.95 31.60 3hiq s ARG 241 CO -0.11 -0.52 -0.24 0.14 0.02 0.00 0.00 175.30 174.60 3hiq s VAL 242 N 2.80 2.43 -0.00 3.52 -7.23 0.84 -4.94 120.40 117.81 3hiq s VAL 242 Ca 0.33 -1.51 0.01 0.00 -1.81 0.00 0.00 61.98 59.01 3hiq s VAL 242 Cb -0.15 -2.04 -0.02 0.00 0.56 0.00 0.00 36.38 34.73 3hiq s VAL 242 CO 0.08 0.21 0.02 0.35 -0.31 0.00 0.00 175.10 175.46 3hiq n THR 243 N 1.25 0.00 -4.38 5.32 -2.24 -1.26 -0.84 114.28 112.13 3hiq n THR 243 Ca -0.17 -0.03 -0.20 0.00 -2.27 0.00 0.00 64.05 61.39 3hiq n THR 243 Cb 0.52 0.42 -0.10 0.00 -2.10 0.00 0.00 70.33 69.07 3hiq n THR 243 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 3hiq s THR 244 N -2.07 1.77 0.12 4.28 -4.23 -1.26 -1.67 115.64 112.57 3hiq s THR 244 Ca -0.00 -2.20 -0.15 0.00 -1.18 0.00 0.00 61.69 58.16 3hiq s THR 244 Cb 0.01 -2.17 -0.04 0.00 1.34 0.00 0.00 72.50 71.63 3hiq s THR 244 CO 0.04 -0.50 1.52 0.58 -0.54 0.00 0.00 174.62 175.72 3hiq h VAL 245 N 2.46 1.28 -0.96 2.29 2.07 -1.41 -3.28 116.25 118.69 3hiq h VAL 245 Ca -0.39 -1.17 0.10 0.00 0.82 0.00 0.00 66.70 66.07 3hiq h VAL 245 Cb 1.23 1.28 -0.07 0.00 -1.52 0.00 0.00 31.29 32.20 3hiq h VAL 245 CO 0.63 0.39 0.62 0.00 0.02 0.00 0.00 177.57 179.22 3hiq h ALA 246 N 0.82 1.55 -0.05 1.67 0.00 -1.97 -2.64 119.26 118.64 3hiq h ALA 246 Ca 0.09 0.00 0.02 0.00 0.00 0.00 0.00 54.91 55.02 3hiq h ALA 246 Cb 0.61 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 3hiq h ALA 246 CO 0.04 0.24 0.05 0.93 0.00 0.00 0.00 179.25 180.50 3hiq h GLU 247 N 0.98 0.00 -0.02 0.00 5.08 -1.97 -1.93 114.58 116.72 3hiq h GLU 247 Ca 0.46 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.82 3hiq h GLU 247 Cb 0.42 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.67 3hiq h GLU 247 CO -0.22 0.00 -0.09 1.33 -1.00 0.00 0.00 179.01 179.03 3hiq n VAL 248 N -4.14 0.00 -3.69 3.13 0.24 -0.99 -5.00 118.33 107.87 3hiq n VAL 248 Ca -0.02 -0.33 -0.21 0.00 -2.04 0.00 0.00 64.34 61.74 3hiq n VAL 248 Cb 0.14 0.95 0.00 0.00 -1.47 0.00 0.00 33.84 33.46 3hiq n VAL 248 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 3hiq n GLU 249 N 0.48 -1.48 -2.24 7.34 1.02 -0.73 -4.30 120.64 120.73 3hiq n GLU 249 Ca 0.15 0.85 -0.41 0.00 -0.02 0.00 0.00 57.16 57.73 3hiq n GLU 249 Cb 0.46 -2.80 -0.03 0.00 -0.02 0.00 0.00 31.44 29.05 3hiq n GLU 249 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 3hiq s ILE 250 N -3.01 3.06 -0.12 -3.67 -1.09 -1.26 -0.42 121.20 114.69 3hiq s ILE 250 Ca 0.01 1.00 -0.07 0.00 -2.23 0.00 0.00 60.65 59.36 3hiq s ILE 250 Cb -0.01 -3.64 -0.05 0.00 -1.58 0.00 0.00 42.46 37.19 3hiq s ILE 250 CO 0.88 0.21 0.06 1.23 -1.23 0.00 0.00 174.94 176.08 3hiq h GLY 251 N 4.14 0.00 -5.20 6.18 0.00 0.28 -3.35 103.07 105.13 3hiq h GLY 251 Ca -0.47 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 46.78 3hiq h GLY 251 CO 0.70 0.00 -0.10 -1.50 0.00 0.00 0.00 176.54 175.64 3hiq s ILE 252 N -1.85 -0.00 0.36 2.60 2.07 -0.85 -4.46 121.20 119.06 3hiq s ILE 252 Ca -0.07 0.02 -0.26 0.00 -1.41 0.00 0.00 60.65 58.92 3hiq s ILE 252 Cb 0.00 -0.77 -0.09 0.00 0.13 0.00 0.00 42.46 41.74 3hiq s ILE 252 CO 0.17 0.01 1.04 -0.36 -1.91 0.00 0.00 174.94 173.88 3hiq s PHE 253 N 0.65 3.43 0.53 3.50 0.08 -0.63 -4.73 117.98 120.80 3hiq s PHE 253 Ca -0.03 1.69 -0.22 0.00 0.12 0.00 0.00 56.93 58.49 3hiq s PHE 253 Cb -0.05 -3.12 -0.05 0.00 -0.57 0.00 0.00 43.02 39.23 3hiq s PHE 253 CO -0.04 -0.43 1.34 -1.17 -0.10 0.00 0.00 175.22 174.82 3hiq s LEU 254 N -2.25 3.88 -0.34 -0.37 2.96 -1.26 -1.60 118.68 119.69 3hiq s LEU 254 Ca 0.53 2.72 -0.29 0.00 -0.22 0.00 0.00 54.13 56.87 3hiq s LEU 254 Cb -0.23 -4.26 0.01 0.00 0.50 0.00 0.00 46.19 42.21 3hiq s LEU 254 CO 0.30 -1.49 1.23 0.21 -1.32 0.00 0.00 176.35 175.28 3hiq s ASN 255 N -0.99 6.70 -0.26 3.68 2.47 -1.26 -4.67 114.94 120.61 3hiq s ASN 255 Ca 0.70 1.02 0.09 0.00 0.42 0.00 0.00 52.86 55.10 3hiq s ASN 255 Cb -0.39 -2.54 0.48 0.00 -1.45 0.00 0.00 41.25 37.34 3hiq s ASN 255 CO 0.46 -1.09 1.38 1.33 -3.72 0.00 0.00 177.10 175.47 3hiq n VAL 256 N 6.30 2.44 1.84 -5.21 0.24 -1.26 -5.06 118.33 117.62 3hiq n VAL 256 Ca 0.14 -2.93 0.15 0.00 -2.04 0.00 0.00 64.34 59.66 3hiq n VAL 256 Cb 0.47 -0.29 0.81 0.00 -1.47 0.00 0.00 33.84 33.36 3hiq n VAL 256 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16