#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hiq s VAL 1 N 0.00 2.67 -0.17 2.28 0.11 -1.26 -5.03 120.40 119.00 3hiq s VAL 1 Ca 0.00 -1.98 -0.29 0.00 -2.93 0.00 0.00 61.98 56.78 3hiq s VAL 1 Cb 0.00 -2.32 -0.01 0.00 -1.53 0.00 0.00 36.38 32.52 3hiq s VAL 1 CO 0.00 -0.17 1.13 -0.63 -3.33 0.00 0.00 175.10 172.10 3hiq s ILE 2 N -1.85 4.50 -0.11 7.04 1.01 -1.26 -4.96 121.20 125.58 3hiq s ILE 2 Ca 0.24 1.81 0.03 0.00 0.00 0.00 0.00 60.65 62.73 3hiq s ILE 2 Cb -0.08 -4.16 -0.00 0.00 0.01 0.00 0.00 42.46 38.23 3hiq s ILE 2 CO 0.13 -0.12 -0.22 -0.63 0.00 0.00 0.00 174.94 174.10 3hiq s ILE 3 N 3.03 2.22 0.04 2.92 1.01 -1.26 -0.21 121.20 128.95 3hiq s ILE 3 Ca 0.50 -0.96 0.07 0.00 0.00 0.00 0.00 60.65 60.26 3hiq s ILE 3 Cb -0.19 -1.86 -0.02 0.00 0.01 0.00 0.00 42.46 40.39 3hiq s ILE 3 CO 0.12 0.55 -0.20 -0.31 0.00 0.00 0.00 174.94 175.11 3hiq s TYR 4 N 0.36 1.71 0.00 3.97 2.02 -0.46 -5.00 117.35 119.95 3hiq s TYR 4 Ca -0.17 -0.36 0.07 0.00 -0.37 0.00 0.00 57.07 56.23 3hiq s TYR 4 Cb -0.18 -1.03 -0.02 0.00 -0.40 0.00 0.00 41.96 40.34 3hiq s TYR 4 CO 0.08 0.07 -0.21 -1.21 -1.57 0.00 0.00 175.55 172.71 3hiq s GLU 5 N -1.10 1.60 -0.17 -0.62 2.02 -1.26 -0.65 118.70 118.52 3hiq s GLU 5 Ca 0.07 -0.82 0.01 0.00 0.02 0.00 0.00 54.97 54.25 3hiq s GLU 5 Cb -0.08 -1.60 0.02 0.00 0.10 0.00 0.00 34.13 32.57 3hiq s GLU 5 CO 0.01 0.43 -0.16 -1.17 0.02 0.00 0.00 175.26 174.40 3hiq s LEU 6 N -0.72 1.95 -0.03 1.80 2.96 0.70 -4.86 118.68 120.47 3hiq s LEU 6 Ca 0.08 -0.61 -0.29 0.00 -0.22 0.00 0.00 54.13 53.09 3hiq s LEU 6 Cb -0.08 -1.30 -0.03 0.00 0.50 0.00 0.00 46.19 45.28 3hiq s LEU 6 CO 0.00 -0.05 0.95 0.21 -1.32 0.00 0.00 176.35 176.15 3hiq s ASN 7 N 1.40 7.30 -0.13 3.68 3.84 -1.26 -1.03 114.94 128.74 3hiq s ASN 7 Ca 0.04 1.58 0.17 0.00 0.21 0.00 0.00 52.86 54.86 3hiq s ASN 7 Cb -0.13 -2.55 0.71 0.00 -0.55 0.00 0.00 41.25 38.73 3hiq s ASN 7 CO -0.11 -0.28 1.62 0.18 -2.79 0.00 0.00 177.10 175.72 3hiq n LEU 8 N 4.11 4.79 -4.33 3.21 4.77 0.31 -4.27 117.00 125.59 3hiq n LEU 8 Ca 0.06 -2.54 -0.38 0.00 -0.03 0.00 0.00 56.01 53.12 3hiq n LEU 8 Cb 0.51 -0.58 -0.12 0.00 -2.33 0.00 0.00 43.42 40.89 3hiq n LEU 8 CO 0.51 0.78 -0.24 -1.10 -1.33 0.00 0.00 177.39 176.01 3hiq s GLN 9 N -2.01 2.89 -1.46 3.23 -1.52 -1.24 -4.57 119.66 114.98 3hiq s GLN 9 Ca 0.50 -1.01 -0.07 0.00 -1.95 0.00 0.00 55.36 52.84 3hiq s GLN 9 Cb 0.34 -3.47 0.01 0.00 -0.22 0.00 0.00 33.01 29.66 3hiq s GLN 9 CO 0.22 -0.57 0.91 0.41 -0.25 0.00 0.00 175.29 176.01 3hiq n GLY 10 N 4.87 -0.54 3.69 3.09 0.00 -1.26 -4.92 105.19 110.13 3hiq n GLY 10 Ca -0.13 0.20 -0.44 0.00 0.00 0.00 0.00 46.02 45.65 3hiq n GLY 10 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3hiq n THR 11 N -4.78 1.20 -3.77 2.61 -1.04 -1.26 -5.00 114.28 102.25 3hiq n THR 11 Ca -0.05 -0.30 -0.21 0.00 -2.04 0.00 0.00 64.05 61.45 3hiq n THR 11 Cb 0.59 -1.55 -0.03 0.00 -1.82 0.00 0.00 70.33 67.51 3hiq n THR 11 CO 0.00 0.00 0.00 0.42 -0.64 0.00 0.00 175.07 174.85 3hiq s THR 12 N -0.28 3.74 0.20 12.58 -4.23 -1.26 -5.00 115.64 121.39 3hiq s THR 12 Ca 0.65 -1.29 -0.10 0.00 -1.18 0.00 0.00 61.69 59.77 3hiq s THR 12 Cb -0.61 -3.26 0.14 0.00 1.34 0.00 0.00 72.50 70.10 3hiq s THR 12 CO 0.52 -0.19 1.83 0.11 -0.54 0.00 0.00 174.62 176.35 3hiq h LYS 13 N 1.19 0.74 -0.44 3.99 1.57 -1.98 -1.20 116.57 120.44 3hiq h LYS 13 Ca -0.45 -0.04 0.05 0.00 -1.87 0.00 0.00 60.65 58.33 3hiq h LYS 13 Cb 1.25 -0.17 -0.04 0.00 0.08 0.00 0.00 32.23 33.35 3hiq h LYS 13 CO 0.57 0.49 0.18 0.00 -0.57 0.00 0.00 179.45 180.12 3hiq h ALA 14 N 1.31 0.53 -0.66 3.86 0.00 -1.99 0.03 119.26 122.34 3hiq h ALA 14 Ca 0.28 0.04 -0.04 0.00 0.00 0.00 0.00 54.91 55.19 3hiq h ALA 14 Cb 0.09 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 3hiq h ALA 14 CO -0.14 -0.20 0.25 1.96 0.00 0.00 0.00 179.25 181.12 3hiq h GLN 15 N 0.36 1.01 0.25 0.00 4.20 -1.87 -0.72 115.11 118.34 3hiq h GLN 15 Ca 0.20 -0.19 -0.01 0.00 0.06 0.00 0.00 58.65 58.70 3hiq h GLN 15 Cb 0.16 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 27.79 3hiq h GLN 15 CO -0.18 0.85 -0.12 -0.92 -0.67 0.00 0.00 178.83 177.79 3hiq h TYR 16 N 0.95 -0.31 -0.41 2.96 3.20 -0.72 -1.49 116.97 121.14 3hiq h TYR 16 Ca 0.22 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.07 3hiq h TYR 16 Cb 0.23 0.10 -0.02 0.00 1.54 0.00 0.00 36.73 38.59 3hiq h TYR 16 CO 0.02 -0.09 0.20 0.77 -1.64 0.00 0.00 178.16 177.42 3hiq h SER 17 N -0.49 0.51 -0.19 -2.11 0.02 -0.94 -2.46 113.55 107.88 3hiq h SER 17 Ca -0.03 -0.04 -0.05 0.00 -0.84 0.00 0.00 61.79 60.82 3hiq h SER 17 Cb 0.37 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 62.77 3hiq h SER 17 CO 0.06 0.43 -0.08 0.74 -1.14 0.00 0.00 176.83 176.84 3hiq h THR 18 N 0.58 1.30 -0.17 -2.27 2.02 -1.06 -1.61 112.91 111.70 3hiq h THR 18 Ca 0.15 -1.13 0.05 0.00 0.77 0.00 0.00 66.41 66.25 3hiq h THR 18 Cb 0.06 1.64 -0.07 0.00 -1.74 0.00 0.00 68.15 68.04 3hiq h THR 18 CO -0.02 0.34 -0.34 0.15 0.37 0.00 0.00 175.52 176.02 3hiq h PHE 19 N 0.09 -0.96 -0.74 3.16 3.57 -0.92 -1.68 116.94 119.47 3hiq h PHE 19 Ca 0.04 0.04 -0.03 0.00 3.53 0.00 0.00 57.97 61.56 3hiq h PHE 19 Cb 0.56 0.45 -0.03 0.00 2.79 0.00 0.00 35.95 39.71 3hiq h PHE 19 CO 0.06 -0.41 0.36 -0.07 -2.23 0.00 0.00 178.31 176.02 3hiq h LEU 20 N -0.40 0.96 -1.49 0.59 3.38 -1.39 -1.84 115.31 115.12 3hiq h LEU 20 Ca 0.10 -0.10 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 3hiq h LEU 20 Cb 0.56 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 41.06 3hiq h LEU 20 CO -0.39 0.81 -0.26 0.50 0.09 0.00 0.00 178.44 179.19 3hiq h LYS 21 N 1.05 0.00 -0.22 1.13 3.64 -0.70 -1.96 116.57 119.51 3hiq h LYS 21 Ca 0.26 0.00 -0.15 0.00 -1.27 0.00 0.00 60.65 59.49 3hiq h LYS 21 Cb 0.10 0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 31.91 3hiq h LYS 21 CO -0.03 0.26 -0.49 1.96 -2.27 0.00 0.00 179.45 178.88 3hiq h GLN 22 N 0.00 0.59 0.27 1.90 4.20 -0.49 0.19 115.11 121.76 3hiq h GLN 22 Ca -0.00 -0.34 -0.00 0.00 0.06 0.00 0.00 58.65 58.37 3hiq h GLN 22 Cb 0.49 0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.28 3hiq h GLN 22 CO 0.03 0.94 -0.24 -0.07 -0.67 0.00 0.00 178.83 178.82 3hiq h LEU 23 N 0.47 -0.64 -0.50 1.46 4.07 -0.98 0.24 115.31 119.42 3hiq h LEU 23 Ca 0.02 0.06 0.00 0.00 0.08 0.00 0.00 57.88 58.04 3hiq h LEU 23 Cb 1.02 0.22 -0.02 0.00 1.08 0.00 0.00 40.66 42.95 3hiq h LEU 23 CO 0.09 -0.36 0.33 0.03 -1.08 0.00 0.00 178.44 177.45 3hiq h ARG 24 N -0.53 0.66 0.00 1.13 3.08 -1.30 -2.71 114.38 114.71 3hiq h ARG 24 Ca -0.01 -0.04 -0.09 0.00 0.07 0.00 0.00 59.98 59.91 3hiq h ARG 24 Cb 0.48 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.37 3hiq h ARG 24 CO -0.04 0.44 -0.41 -0.44 -1.07 0.00 0.00 179.97 178.45 3hiq h ASP 25 N 0.68 0.00 -0.77 7.04 3.32 -0.43 -0.76 116.42 125.49 3hiq h ASP 25 Ca 0.18 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.21 3hiq h ASP 25 Cb -0.07 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.44 3hiq h ASP 25 CO -0.04 0.41 0.40 -0.78 -1.72 0.00 0.00 179.24 177.51 3hiq h ASP 26 N 0.00 0.99 -0.01 6.45 3.58 -0.21 -3.30 116.42 123.92 3hiq h ASP 26 Ca -0.00 -0.10 0.00 0.00 0.42 0.00 0.00 57.03 57.35 3hiq h ASP 26 Cb 0.77 -0.25 0.00 0.00 1.72 0.00 0.00 39.33 41.56 3hiq h ASP 26 CO 0.05 0.82 -0.17 2.30 -2.88 0.00 0.00 179.24 179.35 3hiq n ILE 27 N -4.33 0.00 -2.64 2.25 -5.35 -0.77 -5.00 119.36 103.52 3hiq n ILE 27 Ca 0.08 -0.41 -0.32 0.00 -0.27 0.00 0.00 62.75 61.83 3hiq n ILE 27 Cb 0.12 1.19 -0.04 0.00 -1.74 0.00 0.00 39.64 39.17 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 -1.43 3.91 -0.42 6.28 -2.85 -0.37 -1.15 119.74 123.71 3hiq s LYS 28 Ca 0.12 0.77 -0.19 0.00 -1.00 0.00 0.00 55.97 55.67 3hiq s LYS 28 Cb 0.11 -2.25 0.02 0.00 -2.06 0.00 0.00 37.83 33.64 3hiq s LYS 28 CO 0.27 -0.14 0.57 0.34 0.10 0.00 0.00 175.35 176.49 3hiq s ASP 29 N -2.98 6.30 0.19 0.03 -1.08 -0.21 -4.48 116.67 114.43 3hiq s ASP 29 Ca 0.56 -0.35 0.21 0.00 -0.52 0.00 0.00 52.55 52.44 3hiq s ASP 29 Cb -0.10 -2.29 0.88 0.00 -1.46 0.00 0.00 42.92 39.95 3hiq s ASP 29 CO 0.29 -0.68 1.63 -0.81 0.52 0.00 0.00 175.17 176.12 3hiq n PRO 30 N 6.02 0.14 -0.03 4.34 -0.04 -1.26 -1.94 135.00 142.22 3hiq n PRO 30 Ca -0.03 0.39 0.12 0.00 -0.04 0.00 0.00 63.50 63.93 3hiq n PRO 30 Cb 0.48 -1.77 0.13 0.00 -0.04 0.00 0.00 33.50 32.29 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 -2.04 3.07 -4.57 3.54 4.13 -1.26 -4.98 115.26 113.14 3hiq n ASN 31 Ca 0.02 -1.99 -0.34 0.00 1.68 0.00 0.00 54.58 53.95 3hiq n ASN 31 Cb 0.20 -0.04 -0.11 0.00 -1.54 0.00 0.00 39.78 38.29 3hiq n ASN 31 CO 0.00 0.00 0.00 -0.22 0.28 0.00 0.00 177.26 177.32 3hiq s LEU 32 N -1.91 3.48 0.02 3.41 2.96 -0.82 -5.09 118.68 120.72 3hiq s LEU 32 Ca 0.30 -0.02 0.00 0.00 -0.22 0.00 0.00 54.13 54.20 3hiq s LEU 32 Cb 0.21 -1.84 -0.02 0.00 0.50 0.00 0.00 46.19 45.03 3hiq s LEU 32 CO 0.30 0.21 -0.04 -1.00 -1.32 0.00 0.00 176.35 174.51 3hiq s HIS 33 N 0.13 0.31 -0.05 5.38 3.76 -1.26 -4.01 115.29 119.55 3hiq s HIS 33 Ca 0.01 -0.54 0.01 0.00 -0.15 0.00 0.00 55.06 54.39 3hiq s HIS 33 Cb -0.13 -0.22 -0.03 0.00 1.11 0.00 0.00 32.58 33.31 3hiq s HIS 33 CO 0.02 -0.18 -0.04 0.71 -0.85 0.00 0.00 174.74 174.40 3hiq s TYR 34 N -1.49 3.01 -2.04 1.40 2.02 -1.26 -4.70 117.35 114.28 3hiq s TYR 34 Ca -0.15 0.07 0.00 0.00 -0.37 0.00 0.00 57.07 56.62 3hiq s TYR 34 Cb -0.10 -1.71 0.00 0.00 -0.40 0.00 0.00 41.96 39.75 3hiq s TYR 34 CO -0.01 0.39 0.00 0.41 -1.57 0.00 0.00 175.55 174.77 3hiq n GLY 35 N 1.98 1.39 2.03 0.71 0.00 -0.85 -0.99 105.19 109.46 3hiq n GLY 35 Ca -0.17 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 45.85 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 -0.51 0.47 3.97 -0.02 0.00 -1.26 -0.86 105.19 106.98 3hiq n GLY 36 Ca -0.21 -0.34 -0.21 0.00 0.00 0.00 0.00 46.02 45.26 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 -1.98 2.65 -2.25 2.61 -4.23 -0.17 -4.68 115.64 107.59 3hiq s THR 37 Ca 0.00 -0.67 0.19 0.00 -1.18 0.00 0.00 61.69 60.03 3hiq s THR 37 Cb 0.00 -2.98 0.22 0.00 1.34 0.00 0.00 72.50 71.08 3hiq s THR 37 CO 0.00 0.00 1.17 -0.46 -0.54 0.00 0.00 174.62 174.79 3hiq n ASN 38 N -2.35 2.78 -4.78 3.99 0.23 -1.26 -4.32 115.26 109.54 3hiq n ASN 38 Ca 0.08 -1.83 -0.33 0.00 -0.53 0.00 0.00 54.58 51.97 3hiq n ASN 38 Cb 0.60 -0.07 0.03 0.00 -2.08 0.00 0.00 39.78 38.25 3hiq n ASN 38 CO 0.00 0.00 0.00 -0.76 -0.93 0.00 0.00 177.26 175.57 3hiq s LEU 39 N -1.49 3.48 0.58 -4.53 1.43 -1.26 -5.00 118.68 111.89 3hiq s LEU 39 Ca 0.26 1.94 -0.19 0.00 -1.03 0.00 0.00 54.13 55.10 3hiq s LEU 39 Cb 0.17 -4.55 -0.04 0.00 0.03 0.00 0.00 46.19 41.80 3hiq s LEU 39 CO 0.25 -1.39 1.23 -2.84 0.23 0.00 0.00 176.35 173.83 3hiq s PRO 40 N -3.99 3.01 -0.04 1.29 0.01 -1.26 -4.64 135.00 129.37 3hiq s PRO 40 Ca 0.66 1.88 0.02 0.00 0.01 0.00 0.00 61.00 63.58 3hiq s PRO 40 Cb -0.19 -1.99 0.01 0.00 0.01 0.00 0.00 34.50 32.35 3hiq s PRO 40 CO 0.38 -1.19 -0.08 0.08 0.01 0.00 0.00 177.00 176.20 3hiq s VAL 41 N -1.54 0.77 0.37 3.83 1.01 -1.26 -1.52 120.40 122.07 3hiq s VAL 41 Ca 0.76 -0.30 -0.27 0.00 0.00 0.00 0.00 61.98 62.18 3hiq s VAL 41 Cb -0.32 -0.72 -0.11 0.00 0.00 0.00 0.00 36.38 35.23 3hiq s VAL 41 CO 0.35 0.26 1.31 -0.38 0.00 0.00 0.00 175.10 176.64 3hiq n ILE 42 N 3.69 2.20 -2.67 2.22 5.41 -0.62 -1.04 119.36 128.55 3hiq n ILE 42 Ca -0.22 -0.50 -0.33 0.00 1.00 0.00 0.00 62.75 62.69 3hiq n ILE 42 Cb 0.52 -1.62 -0.05 0.00 -0.71 0.00 0.00 39.64 37.78 3hiq n ILE 42 CO 0.00 0.00 0.00 -0.75 0.00 0.00 0.00 176.55 175.80 3hiq s LYS 43 N -2.03 4.00 -0.06 0.38 2.20 -0.30 -4.32 119.74 119.61 3hiq s LYS 43 Ca 0.57 1.24 -0.00 0.00 -0.36 0.00 0.00 55.97 57.42 3hiq s LYS 43 Cb -0.53 -2.14 0.03 0.00 -1.51 0.00 0.00 37.83 33.68 3hiq s LYS 43 CO 0.61 -0.24 -0.03 0.50 -0.36 0.00 0.00 175.35 175.83 3hiq s ARG 44 N -3.23 0.79 0.64 4.03 3.52 -1.26 -2.92 118.95 120.53 3hiq s ARG 44 Ca 0.65 -0.02 -0.15 0.00 -0.13 0.00 0.00 55.73 56.08 3hiq s ARG 44 Cb -0.13 -0.98 -0.01 0.00 -1.56 0.00 0.00 34.95 32.28 3hiq s ARG 44 CO 0.17 -0.21 1.09 -1.25 -0.81 0.00 0.00 175.30 174.30 3hiq s PRO 45 N 1.51 2.94 0.25 5.12 0.04 -1.26 -5.08 135.00 138.52 3hiq s PRO 45 Ca -0.02 1.33 0.22 0.00 0.04 0.00 0.00 61.00 62.57 3hiq s PRO 45 Cb -0.13 -1.97 0.07 0.00 0.04 0.00 0.00 34.50 32.51 3hiq s PRO 45 CO -0.03 -1.13 1.17 -0.24 0.04 0.00 0.00 177.00 176.81 3hiq h VAL 46 N 0.11 0.03 -2.36 -0.36 3.04 -1.91 -3.49 116.25 111.31 3hiq h VAL 46 Ca -0.47 -1.06 0.00 0.00 -1.01 0.00 0.00 66.70 64.17 3hiq h VAL 46 Cb 1.24 1.65 0.00 0.00 -2.01 0.00 0.00 31.29 32.17 3hiq h VAL 46 CO 0.55 0.02 0.00 0.61 -1.01 0.00 0.00 177.57 177.74 3hiq n GLY 47 N 1.17 4.58 3.70 3.17 0.00 -1.26 -4.72 105.19 111.84 3hiq n GLY 47 Ca 0.01 -1.77 -0.31 0.00 0.00 0.00 0.00 46.02 43.94 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 -1.23 1.47 0.60 1.61 0.02 -1.26 -5.02 135.00 131.19 3hiq s PRO 48 Ca 0.00 1.49 -0.08 0.00 0.02 0.00 0.00 61.00 62.43 3hiq s PRO 48 Cb 0.00 -1.78 -0.01 0.00 0.02 0.00 0.00 34.50 32.73 3hiq s PRO 48 CO 0.00 -2.29 0.94 -1.25 -0.33 0.00 0.00 177.00 174.08 3hiq s PRO 49 N -4.61 3.19 0.23 5.54 0.04 -1.26 -5.10 135.00 133.02 3hiq s PRO 49 Ca 0.66 0.29 0.23 0.00 0.04 0.00 0.00 61.00 62.22 3hiq s PRO 49 Cb -0.22 -2.20 0.09 0.00 0.04 0.00 0.00 34.50 32.20 3hiq s PRO 49 CO 0.56 -0.63 1.16 -0.22 0.04 0.00 0.00 177.00 177.91 3hiq h LYS 50 N -0.21 0.00 -5.57 4.56 3.64 -1.95 -3.46 116.57 113.58 3hiq h LYS 50 Ca -0.45 0.00 -0.45 0.00 -1.27 0.00 0.00 60.65 58.48 3hiq h LYS 50 Cb 1.23 0.00 -0.19 0.00 -0.41 0.00 0.00 32.23 32.86 3hiq h LYS 50 CO 0.62 0.00 -0.77 -0.06 -2.27 0.00 0.00 179.45 176.96 3hiq s PHE 51 N -3.32 1.47 0.29 1.91 0.40 -1.26 -1.38 117.98 116.10 3hiq s PHE 51 Ca 0.01 -0.51 0.09 0.00 -0.60 0.00 0.00 56.93 55.93 3hiq s PHE 51 Cb 0.09 -0.78 -0.06 0.00 0.51 0.00 0.00 43.02 42.79 3hiq s PHE 51 CO 0.76 0.16 -0.13 -0.48 0.70 0.00 0.00 175.22 176.24 3hiq s LEU 52 N -2.30 2.61 -0.12 -0.37 0.05 -0.36 -4.72 118.68 113.48 3hiq s LEU 52 Ca 0.08 -1.12 -0.04 0.00 0.05 0.00 0.00 54.13 53.10 3hiq s LEU 52 Cb -0.06 -0.92 -0.03 0.00 -2.05 0.00 0.00 46.19 43.13 3hiq s LEU 52 CO 0.03 -0.15 0.01 -0.60 -0.55 0.00 0.00 176.35 175.10 3hiq s ARG 53 N -3.61 3.38 -0.13 1.48 3.52 0.70 -1.24 118.95 123.06 3hiq s ARG 53 Ca 0.30 -0.41 -0.02 0.00 -0.13 0.00 0.00 55.73 55.46 3hiq s ARG 53 Cb -0.00 -2.92 -0.03 0.00 -1.56 0.00 0.00 34.95 30.44 3hiq s ARG 53 CO 0.14 0.50 -0.06 0.08 -0.81 0.00 0.00 175.30 175.14 3hiq s VAL 54 N -0.32 3.68 -0.23 7.11 1.01 -0.41 -1.36 120.40 129.88 3hiq s VAL 54 Ca 0.07 -0.45 -0.09 0.00 0.00 0.00 0.00 61.98 61.51 3hiq s VAL 54 Cb -0.12 -2.58 -0.04 0.00 0.00 0.00 0.00 36.38 33.64 3hiq s VAL 54 CO 0.02 0.52 0.13 0.20 0.00 0.00 0.00 175.10 175.97 3hiq s ASN 55 N 0.11 5.85 -0.44 3.32 0.01 0.17 -0.51 114.94 123.45 3hiq s ASN 55 Ca -0.02 0.05 -0.11 0.00 -0.71 0.00 0.00 52.86 52.06 3hiq s ASN 55 Cb -0.14 -2.05 0.08 0.00 0.41 0.00 0.00 41.25 39.56 3hiq s ASN 55 CO 0.03 0.07 0.32 -0.76 -1.51 0.00 0.00 177.10 175.25 3hiq s LEU 56 N 1.02 5.38 -0.28 0.60 1.43 0.77 -0.22 118.68 127.39 3hiq s LEU 56 Ca 0.06 -1.49 -0.15 0.00 -1.03 0.00 0.00 54.13 51.52 3hiq s LEU 56 Cb -0.14 -2.06 -0.04 0.00 0.03 0.00 0.00 46.19 43.99 3hiq s LEU 56 CO 0.04 -0.59 0.35 -0.54 0.23 0.00 0.00 176.35 175.84 3hiq s LYS 57 N 1.49 3.97 0.18 1.70 1.02 -0.19 -2.25 119.74 125.65 3hiq s LYS 57 Ca 0.04 -0.04 0.08 0.00 0.02 0.00 0.00 55.97 56.07 3hiq s LYS 57 Cb -0.24 -3.67 -0.04 0.00 -0.52 0.00 0.00 37.83 33.36 3hiq s LYS 57 CO 0.03 -0.29 -0.17 0.00 -0.92 0.00 0.00 175.35 174.00 3hiq s ALA 58 N 2.04 2.00 0.51 5.17 0.00 -0.98 0.11 121.76 130.61 3hiq s ALA 58 Ca 0.14 -1.53 0.38 0.00 0.00 0.00 0.00 51.96 50.95 3hiq s ALA 58 Cb -0.16 -0.16 1.54 0.00 0.00 0.00 0.00 23.12 24.34 3hiq s ALA 58 CO 0.10 0.19 1.69 1.03 0.00 0.00 0.00 175.76 178.77 3hiq h SER 59 N 3.07 0.10 0.75 0.00 0.87 -1.97 -0.12 113.55 116.26 3hiq h SER 59 Ca -0.41 0.04 -0.25 0.00 -1.23 0.00 0.00 61.79 59.94 3hiq h SER 59 Cb 1.21 0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 63.19 3hiq h SER 59 CO 0.54 -0.03 -1.19 0.74 -0.53 0.00 0.00 176.83 176.36 3hiq h THR 60 N 0.06 1.54 0.00 2.23 2.02 -1.98 -3.50 112.91 113.28 3hiq h THR 60 Ca 0.75 -3.17 0.00 0.00 0.77 0.00 0.00 66.41 64.76 3hiq h THR 60 Cb 2.74 2.89 0.00 0.00 -1.74 0.00 0.00 68.15 72.04 3hiq h THR 60 CO -0.13 0.91 0.00 0.61 0.37 0.00 0.00 175.52 177.28 3hiq n GLY 61 N 1.48 0.33 3.47 2.16 0.00 -0.06 -5.02 105.19 107.55 3hiq n GLY 61 Ca -0.06 -1.25 -0.33 0.00 0.00 0.00 0.00 46.02 44.37 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 -1.98 3.60 -0.09 2.61 2.01 -1.26 -2.31 115.64 118.21 3hiq s THR 62 Ca 0.00 -0.47 -0.02 0.00 0.31 0.00 0.00 61.69 61.50 3hiq s THR 62 Cb 0.00 -2.54 -0.03 0.00 0.01 0.00 0.00 72.50 69.94 3hiq s THR 62 CO 0.00 0.52 0.02 -0.69 -0.69 0.00 0.00 174.62 173.77 3hiq s VAL 63 N 0.17 4.42 0.33 3.82 1.01 -0.95 -4.71 120.40 124.49 3hiq s VAL 63 Ca -0.04 -0.21 0.08 0.00 0.00 0.00 0.00 61.98 61.81 3hiq s VAL 63 Cb -0.14 -2.87 -0.06 0.00 0.00 0.00 0.00 36.38 33.30 3hiq s VAL 63 CO 0.04 0.60 -0.05 -0.44 0.00 0.00 0.00 175.10 175.24 3hiq s SER 64 N -0.92 3.31 0.09 3.32 0.01 -0.13 -0.16 113.70 119.21 3hiq s SER 64 Ca 0.14 -1.24 0.06 0.00 1.31 0.00 0.00 55.95 56.22 3hiq s SER 64 Cb -0.11 -0.27 -0.03 0.00 0.21 0.00 0.00 66.02 65.81 3hiq s SER 64 CO 0.03 -0.33 -0.15 -0.76 0.41 0.00 0.00 173.24 172.44 3hiq s LEU 65 N -3.56 2.31 -0.17 2.44 1.43 0.34 -0.59 118.68 120.87 3hiq s LEU 65 Ca 0.32 -0.67 -0.05 0.00 -1.03 0.00 0.00 54.13 52.70 3hiq s LEU 65 Cb 0.05 -0.58 -0.03 0.00 0.03 0.00 0.00 46.19 45.65 3hiq s LEU 65 CO 0.15 -0.07 -0.01 0.00 0.23 0.00 0.00 176.35 176.66 3hiq s ALA 66 N -1.44 3.12 -0.09 4.21 0.00 -0.48 -1.29 121.76 125.80 3hiq s ALA 66 Ca 0.02 -0.81 0.02 0.00 0.00 0.00 0.00 51.96 51.18 3hiq s ALA 66 Cb -0.09 -1.68 0.01 0.00 0.00 0.00 0.00 23.12 21.37 3hiq s ALA 66 CO 0.03 0.17 -0.13 0.08 0.00 0.00 0.00 175.76 175.91 3hiq s VAL 67 N 0.41 1.25 0.02 0.00 1.01 -0.37 -0.24 120.40 122.48 3hiq s VAL 67 Ca -0.02 -0.51 -0.30 0.00 0.00 0.00 0.00 61.98 61.15 3hiq s VAL 67 Cb -0.14 -1.15 -0.04 0.00 0.00 0.00 0.00 36.38 35.05 3hiq s VAL 67 CO 0.02 0.39 1.10 -1.58 0.00 0.00 0.00 175.10 175.03 3hiq s GLN 68 N 0.91 4.48 0.18 2.72 0.74 0.18 -1.22 119.66 127.65 3hiq s GLN 68 Ca -0.09 1.61 0.06 0.00 0.05 0.00 0.00 55.36 56.98 3hiq s GLN 68 Cb -0.15 -3.42 0.03 0.00 1.10 0.00 0.00 33.01 30.57 3hiq s GLN 68 CO 0.01 -0.19 1.41 0.00 -0.55 0.00 0.00 175.29 175.97 3hiq h ARG 69 N 6.86 0.08 0.00 1.67 3.08 -1.55 0.93 114.38 125.44 3hiq h ARG 69 Ca -0.40 -0.09 -0.00 0.00 0.07 0.00 0.00 59.98 59.55 3hiq h ARG 69 Cb 1.21 0.03 -0.00 0.00 0.08 0.00 0.00 29.97 31.29 3hiq h ARG 69 CO 0.79 0.87 -0.02 0.66 -1.07 0.00 0.00 179.97 181.21 3hiq h SER 70 N 0.04 0.00 0.00 7.04 4.64 -1.93 -3.36 113.55 119.98 3hiq h SER 70 Ca -0.02 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.30 3hiq h SER 70 Cb 1.48 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.57 3hiq h SER 70 CO 0.12 0.02 0.00 -0.46 -0.87 0.00 0.00 176.83 175.64 3hiq n ASN 71 N -3.12 0.00 -0.59 4.97 2.04 -1.19 -4.65 115.26 112.72 3hiq n ASN 71 Ca 0.01 -1.00 -0.08 0.00 -0.44 0.00 0.00 54.58 53.07 3hiq n ASN 71 Cb 0.34 0.00 -0.03 0.00 -2.53 0.00 0.00 39.78 37.55 3hiq n ASN 71 CO 0.00 0.00 0.00 0.18 -0.44 0.00 0.00 177.26 177.00 3hiq n LEU 72 N 0.00 -0.30 -4.71 -4.53 4.77 0.32 -4.95 117.00 107.61 3hiq n LEU 72 Ca 0.00 0.19 -0.42 0.00 -0.03 0.00 0.00 56.01 55.75 3hiq n LEU 72 Cb 0.39 -1.89 -0.03 0.00 -2.33 0.00 0.00 43.42 39.56 3hiq n LEU 72 CO 0.00 -0.66 0.74 0.00 -1.33 0.00 0.00 177.39 176.13 3hiq s ALA 73 N -2.02 3.24 0.11 -1.18 0.00 -1.23 -4.60 121.76 116.08 3hiq s ALA 73 Ca 0.00 0.59 -0.31 0.00 0.00 0.00 0.00 51.96 52.24 3hiq s ALA 73 Cb 0.00 -3.37 -0.07 0.00 0.00 0.00 0.00 23.12 19.67 3hiq s ALA 73 CO 0.00 -0.32 1.32 0.08 0.00 0.00 0.00 175.76 176.84 3hiq s VAL 74 N 1.14 3.50 -0.19 0.00 1.01 -1.26 0.47 120.40 125.08 3hiq s VAL 74 Ca 0.53 1.10 0.14 0.00 0.00 0.00 0.00 61.98 63.75 3hiq s VAL 74 Cb -0.23 -3.70 -0.21 0.00 0.00 0.00 0.00 36.38 32.24 3hiq s VAL 74 CO 0.27 0.10 0.03 0.00 0.00 0.00 0.00 175.10 175.50 3hiq n ALA 75 N 3.72 1.55 -3.68 5.51 0.00 0.66 -4.93 120.51 123.34 3hiq n ALA 75 Ca 0.10 -1.17 -0.04 0.00 0.00 0.00 0.00 53.44 52.32 3hiq n ALA 75 Cb 0.44 -0.12 -0.01 0.00 0.00 0.00 0.00 19.45 19.75 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 -2.44 -1.75 0.13 0.00 0.00 -1.23 -1.52 121.76 114.96 3hiq s ALA 76 Ca -0.12 0.40 0.01 0.00 0.00 0.00 0.00 51.96 52.26 3hiq s ALA 76 Cb 0.06 0.55 -0.04 0.00 0.00 0.00 0.00 23.12 23.69 3hiq s ALA 76 CO 0.72 -0.96 -0.02 1.52 0.00 0.00 0.00 175.76 177.02 3hiq s TYR 77 N -3.16 1.03 -0.04 0.00 1.13 -0.16 -1.38 117.35 114.77 3hiq s TYR 77 Ca 0.11 -1.00 0.02 0.00 -1.41 0.00 0.00 57.07 54.79 3hiq s TYR 77 Cb -0.01 -0.59 0.01 0.00 -1.10 0.00 0.00 41.96 40.27 3hiq s TYR 77 CO -0.01 -0.23 -0.10 -1.17 -2.51 0.00 0.00 175.55 171.54 3hiq s LEU 78 N -3.10 1.69 -0.07 -3.49 2.96 0.24 -1.45 118.68 115.46 3hiq s LEU 78 Ca 0.19 -0.22 -0.30 0.00 -0.22 0.00 0.00 54.13 53.57 3hiq s LEU 78 Cb 0.06 -0.64 0.09 0.00 0.50 0.00 0.00 46.19 46.20 3hiq s LEU 78 CO -0.00 0.05 0.78 0.00 -1.32 0.00 0.00 176.35 175.86 3hiq s ALA 79 N 0.41 -1.81 0.45 5.97 0.00 -1.03 -0.96 121.76 124.79 3hiq s ALA 79 Ca -0.07 1.34 -0.21 0.00 0.00 0.00 0.00 51.96 53.02 3hiq s ALA 79 Cb -0.12 -0.16 -0.09 0.00 0.00 0.00 0.00 23.12 22.75 3hiq s ALA 79 CO 0.01 -0.39 1.00 0.15 0.00 0.00 0.00 175.76 176.54 3hiq s LYS 80 N -1.39 4.02 0.00 0.00 1.02 -1.26 -1.61 119.74 120.52 3hiq s LYS 80 Ca -0.07 1.29 0.00 0.00 0.02 0.00 0.00 55.97 57.21 3hiq s LYS 80 Cb -0.00 -2.20 0.00 0.00 -0.52 0.00 0.00 37.83 35.11 3hiq s LYS 80 CO 0.05 -0.23 0.00 0.27 -0.92 0.00 0.00 175.35 174.52 3hiq n ASN 81 N -0.70 0.04 0.00 2.83 0.23 -0.37 -0.50 115.26 116.79 3hiq n ASN 81 Ca 0.08 0.00 0.12 0.00 -0.53 0.00 0.00 54.58 54.25 3hiq n ASN 81 Cb 0.53 0.00 0.56 0.00 -2.08 0.00 0.00 39.78 38.78 3hiq n ASN 81 CO 0.00 0.00 0.00 -3.20 -0.93 0.00 0.00 177.26 173.13 3hiq n ASN 82 N 0.00 0.00 -0.43 0.53 4.05 -1.20 -2.82 115.26 115.40 3hiq n ASN 82 Ca 0.00 0.26 0.05 0.00 0.45 0.00 0.00 54.58 55.35 3hiq n ASN 82 Cb 0.00 -0.41 0.13 0.00 1.23 0.00 0.00 39.78 40.73 3hiq n ASN 82 CO 0.00 0.00 0.00 0.59 -3.05 0.00 0.00 177.26 174.80 3hiq n ASN 83 N -1.41 2.78 -2.79 1.20 5.03 -1.26 -4.89 115.26 113.91 3hiq n ASN 83 Ca 0.08 -2.39 -0.13 0.00 0.87 0.00 0.00 54.58 53.01 3hiq n ASN 83 Cb 0.25 -0.26 0.07 0.00 -1.02 0.00 0.00 39.78 38.81 3hiq n ASN 83 CO 0.00 0.00 0.00 0.29 -1.83 0.00 0.00 177.26 175.72 3hiq n LYS 84 N -0.29 -5.04 -3.91 3.52 4.76 -1.13 -5.01 118.16 111.07 3hiq n LYS 84 Ca 0.11 0.63 -0.18 0.00 -2.87 0.00 0.00 58.31 56.00 3hiq n LYS 84 Cb 0.51 -4.99 -0.16 0.00 -1.84 0.00 0.00 35.03 28.54 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 -5.14 0.31 0.20 1.97 -0.21 -1.26 -4.91 119.66 110.62 3hiq s GLN 85 Ca 0.06 0.09 -0.30 0.00 0.02 0.00 0.00 55.36 55.23 3hiq s GLN 85 Cb -0.03 -0.52 -0.08 0.00 1.00 0.00 0.00 33.01 33.38 3hiq s GLN 85 CO 0.54 -0.15 1.15 -0.06 -2.12 0.00 0.00 175.29 174.64 3hiq s PHE 86 N 1.13 3.51 -0.00 0.91 0.08 -1.26 -1.24 117.98 121.11 3hiq s PHE 86 Ca -0.08 1.53 0.01 0.00 0.12 0.00 0.00 56.93 58.51 3hiq s PHE 86 Cb -0.13 -3.35 -0.00 0.00 -0.57 0.00 0.00 43.02 38.96 3hiq s PHE 86 CO -0.02 -0.89 -0.03 0.50 -0.10 0.00 0.00 175.22 174.68 3hiq s ARG 87 N -0.47 0.27 0.01 0.44 3.52 -0.63 -4.82 118.95 117.26 3hiq s ARG 87 Ca 0.50 -0.14 -0.00 0.00 -0.13 0.00 0.00 55.73 55.96 3hiq s ARG 87 Cb -0.31 -0.25 -0.04 0.00 -1.56 0.00 0.00 34.95 32.79 3hiq s ARG 87 CO 0.37 0.07 0.10 0.00 -0.81 0.00 0.00 175.30 175.02 3hiq s ALA 88 N -0.13 3.64 -0.03 6.12 0.00 -0.56 -2.45 121.76 128.36 3hiq s ALA 88 Ca 0.01 -0.87 0.01 0.00 0.00 0.00 0.00 51.96 51.11 3hiq s ALA 88 Cb -0.02 -1.61 0.01 0.00 0.00 0.00 0.00 23.12 21.50 3hiq s ALA 88 CO -0.00 0.71 -0.05 0.71 0.00 0.00 0.00 175.76 177.12 3hiq s TYR 89 N -1.24 0.69 0.08 0.00 1.51 -0.53 -0.52 117.35 117.35 3hiq s TYR 89 Ca 0.24 -0.17 0.07 0.00 -1.01 0.00 0.00 57.07 56.21 3hiq s TYR 89 Cb -0.12 -0.56 -0.03 0.00 -0.11 0.00 0.00 41.96 41.14 3hiq s TYR 89 CO 0.16 -0.12 -0.18 1.52 -1.11 0.00 0.00 175.55 175.82 3hiq s TYR 90 N 0.50 1.52 0.28 2.71 1.13 -0.36 -0.99 117.35 122.15 3hiq s TYR 90 Ca -0.06 -0.43 -0.29 0.00 -1.41 0.00 0.00 57.07 54.88 3hiq s TYR 90 Cb -0.10 -0.85 -0.13 0.00 -1.10 0.00 0.00 41.96 39.77 3hiq s TYR 90 CO 0.00 0.13 1.20 1.19 -2.51 0.00 0.00 175.55 175.56 3hiq n PHE 91 N 1.26 1.80 -1.70 -3.49 3.72 -0.57 -0.77 117.46 117.71 3hiq n PHE 91 Ca -0.20 0.59 -0.54 0.00 -0.05 0.00 0.00 57.45 57.26 3hiq n PHE 91 Cb 0.54 -2.35 -0.06 0.00 -0.94 0.00 0.00 39.48 36.66 3hiq n PHE 91 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 176.76 177.88 3hiq n LYS 92 N 1.04 1.58 -0.69 -1.08 4.81 -0.14 -1.59 118.16 122.09 3hiq n LYS 92 Ca 0.09 0.58 0.00 0.00 -0.87 0.00 0.00 58.31 58.11 3hiq n LYS 92 Cb 0.32 -2.33 0.00 0.00 0.02 0.00 0.00 35.03 33.04 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 4.26 1.35 3.74 3.14 0.00 -1.26 -4.36 105.19 112.05 3hiq n GLY 93 Ca 0.25 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.85 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 -3.59 3.14 -1.21 1.61 2.19 -0.62 -4.90 117.98 114.60 3hiq s PHE 94 Ca 0.00 1.05 -0.17 0.00 0.33 0.00 0.00 56.93 58.14 3hiq s PHE 94 Cb 0.00 -3.73 -0.03 0.00 -1.31 0.00 0.00 43.02 37.95 3hiq s PHE 94 CO 0.00 -2.42 2.11 1.04 1.83 0.00 0.00 175.22 177.78 3hiq n GLN 95 N 2.82 2.37 -4.65 10.12 1.13 -1.26 -4.89 117.38 123.02 3hiq n GLN 95 Ca 0.08 -2.34 -0.23 0.00 -1.94 0.00 0.00 57.00 52.56 3hiq n GLN 95 Cb 0.41 -3.17 -0.15 0.00 0.11 0.00 0.00 30.24 27.45 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 3.94 1.32 0.40 5.09 2.07 -1.26 -5.15 121.20 127.60 3hiq s ILE 96 Ca 0.51 -0.87 0.06 0.00 -1.41 0.00 0.00 60.65 58.94 3hiq s ILE 96 Cb 0.14 -1.13 0.00 0.00 0.13 0.00 0.00 42.46 41.60 3hiq s ILE 96 CO -0.01 0.25 0.56 0.42 -1.91 0.00 0.00 174.94 174.24 3hiq s THR 97 N -0.57 3.63 0.15 4.00 -4.23 -1.26 -5.00 115.64 112.36 3hiq s THR 97 Ca 0.05 -0.90 -0.11 0.00 -1.18 0.00 0.00 61.69 59.56 3hiq s THR 97 Cb -0.07 -3.26 0.00 0.00 1.34 0.00 0.00 72.50 70.51 3hiq s THR 97 CO 0.00 -0.12 1.55 0.74 -0.54 0.00 0.00 174.62 176.25 3hiq h THR 98 N 0.67 1.27 -0.51 3.99 2.02 -2.01 -1.93 112.91 116.41 3hiq h THR 98 Ca -0.44 -1.34 0.07 0.00 0.77 0.00 0.00 66.41 65.48 3hiq h THR 98 Cb 1.27 1.13 -0.06 0.00 -1.74 0.00 0.00 68.15 68.74 3hiq h THR 98 CO 0.51 0.46 0.17 0.78 0.37 0.00 0.00 175.52 177.81 3hiq h ASN 99 N 0.81 0.15 -0.24 4.18 4.21 -1.99 0.16 115.58 122.86 3hiq h ASN 99 Ca 0.11 0.07 -0.11 0.00 1.21 0.00 0.00 56.30 57.58 3hiq h ASN 99 Cb 0.75 0.06 -0.01 0.00 -1.12 0.00 0.00 38.32 38.00 3hiq h ASN 99 CO 0.06 0.11 -0.23 1.56 -1.29 0.00 0.00 177.43 177.64 3hiq h GLN 100 N 0.34 0.71 -0.42 0.81 4.20 -1.91 -2.18 115.11 116.65 3hiq h GLN 100 Ca 0.25 -0.28 -0.11 0.00 0.06 0.00 0.00 58.65 58.57 3hiq h GLN 100 Cb 0.29 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.01 3hiq h GLN 100 CO -0.27 0.88 -0.17 -0.07 -0.67 0.00 0.00 178.83 178.53 3hiq h LEU 101 N 0.62 0.80 -0.63 1.46 -0.00 -0.73 0.13 115.31 116.95 3hiq h LEU 101 Ca 0.09 -0.27 0.02 0.00 -0.00 0.00 0.00 57.88 57.72 3hiq h LEU 101 Cb 0.72 -0.22 -0.04 0.00 -0.00 0.00 0.00 40.66 41.12 3hiq h LEU 101 CO 0.06 0.97 0.40 0.78 -0.00 0.00 0.00 178.44 180.64 3hiq h ASN 102 N 0.71 0.65 -0.13 -0.43 2.35 -0.41 0.27 115.58 118.59 3hiq h ASN 102 Ca 0.11 -0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.83 3hiq h ASN 102 Cb 0.68 -0.14 -0.00 0.00 0.05 0.00 0.00 38.32 38.90 3hiq h ASN 102 CO 0.05 0.46 -0.01 0.78 -1.65 0.00 0.00 177.43 177.06 3hiq h ASN 103 N 0.78 0.23 -0.00 5.81 2.35 -1.03 -2.57 115.58 121.15 3hiq h ASN 103 Ca 0.25 -0.32 -0.15 0.00 -0.55 0.00 0.00 56.30 55.53 3hiq h ASN 103 Cb -0.00 -0.06 -0.01 0.00 0.05 0.00 0.00 38.32 38.30 3hiq h ASN 103 CO -0.09 0.50 -0.50 -0.07 -1.65 0.00 0.00 177.43 175.61 3hiq h LEU 104 N -0.04 0.62 -6.08 1.61 3.38 -0.58 -3.38 115.31 110.84 3hiq h LEU 104 Ca 0.04 -0.31 -0.58 0.00 0.09 0.00 0.00 57.88 57.11 3hiq h LEU 104 Cb 0.38 -0.18 -0.41 0.00 0.09 0.00 0.00 40.66 40.55 3hiq h LEU 104 CO 0.01 1.02 -0.80 0.49 0.09 0.00 0.00 178.44 179.24 3hiq n PHE 105 N -3.98 2.07 0.32 1.13 3.72 0.94 -4.91 117.46 116.74 3hiq n PHE 105 Ca -0.03 -3.92 0.19 0.00 -0.05 0.00 0.00 57.45 53.65 3hiq n PHE 105 Cb 0.58 -0.47 1.03 0.00 -0.94 0.00 0.00 39.48 39.67 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 4.03 0.00 0.00 -1.08 0.13 -1.63 0.17 132.00 133.62 3hiq h PRO 106 Ca 0.15 0.00 0.00 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 0.69 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 178.85 3hiq n GLU 107 N -2.93 0.15 -3.18 0.86 4.71 -1.26 -3.47 120.64 115.51 3hiq n GLU 107 Ca -0.03 0.48 -0.21 0.00 -0.01 0.00 0.00 57.16 57.39 3hiq n GLU 107 Cb 0.17 -1.84 -0.05 0.00 -1.01 0.00 0.00 31.44 28.72 3hiq n GLU 107 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 3hiq n ALA 108 N -1.73 2.42 -2.10 0.62 0.00 0.59 -4.67 120.51 115.63 3hiq n ALA 108 Ca 0.01 -3.55 -0.41 0.00 0.00 0.00 0.00 53.44 49.49 3hiq n ALA 108 Cb 0.15 -0.88 -0.05 0.00 0.00 0.00 0.00 19.45 18.68 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 -2.18 4.31 0.00 0.00 2.01 -1.23 -4.62 115.64 113.93 3hiq s THR 109 Ca 0.39 2.03 0.00 0.00 0.31 0.00 0.00 61.69 64.42 3hiq s THR 109 Cb 0.28 -4.30 0.00 0.00 0.01 0.00 0.00 72.50 68.49 3hiq s THR 109 CO -0.09 0.36 0.00 0.61 -0.69 0.00 0.00 174.62 174.81 3hiq n GLY 110 N 2.01 -1.44 0.38 4.40 0.00 -1.26 -4.31 105.19 104.97 3hiq n GLY 110 Ca 0.01 -1.51 0.18 0.00 0.00 0.00 0.00 46.02 44.70 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 0.77 0.00 1.61 -1.51 -1.91 -0.97 116.25 114.24 3hiq h VAL 111 Ca 0.00 -0.07 0.00 0.00 -1.23 0.00 0.00 66.70 65.40 3hiq h VAL 111 Cb 0.00 0.55 0.00 0.00 -2.13 0.00 0.00 31.29 29.71 3hiq h VAL 111 CO 0.00 0.04 0.14 0.28 -1.23 0.00 0.00 177.57 176.80 3hiq h SER 112 N 0.20 0.00 -0.05 4.19 0.02 -1.96 -1.80 113.55 114.14 3hiq h SER 112 Ca 0.31 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.26 3hiq h SER 112 Cb 0.93 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.47 3hiq h SER 112 CO -0.06 0.00 0.00 0.59 -1.14 0.00 0.00 176.83 176.22 3hiq n ASN 113 N -2.88 1.73 -4.18 3.07 3.02 -0.37 -4.96 115.26 110.69 3hiq n ASN 113 Ca -0.02 -1.48 -0.33 0.00 -0.03 0.00 0.00 54.58 52.71 3hiq n ASN 113 Cb 0.20 -0.03 -0.16 0.00 -0.61 0.00 0.00 39.78 39.18 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 -0.60 3.08 -0.15 3.52 -0.21 -0.68 -1.49 119.66 123.13 3hiq s GLN 114 Ca 0.06 -0.81 0.02 0.00 0.02 0.00 0.00 55.36 54.66 3hiq s GLN 114 Cb 0.04 -2.56 0.01 0.00 1.00 0.00 0.00 33.01 31.50 3hiq s GLN 114 CO 0.06 -0.09 -0.22 -1.14 -2.12 0.00 0.00 175.29 171.78 3hiq s GLN 115 N 1.02 3.02 -0.13 2.91 0.74 0.33 -4.89 119.66 122.66 3hiq s GLN 115 Ca -0.02 -0.85 -0.29 0.00 0.05 0.00 0.00 55.36 54.25 3hiq s GLN 115 Cb -0.15 -2.46 -0.03 0.00 1.10 0.00 0.00 33.01 31.47 3hiq s GLN 115 CO -0.05 -0.05 1.45 -2.00 -0.55 0.00 0.00 175.29 174.08 3hiq s GLU 116 N 0.91 4.17 0.69 1.67 2.12 -1.26 -1.23 118.70 125.77 3hiq s GLU 116 Ca -0.05 1.86 -0.17 0.00 0.36 0.00 0.00 54.97 56.98 3hiq s GLU 116 Cb -0.15 -3.88 0.01 0.00 0.26 0.00 0.00 34.13 30.37 3hiq s GLU 116 CO -0.04 -0.82 1.20 1.28 -0.54 0.00 0.00 175.26 176.34 3hiq n LEU 117 N 7.00 5.14 0.20 2.70 4.77 0.05 -4.89 117.00 131.96 3hiq n LEU 117 Ca 0.16 0.75 0.14 0.00 -0.03 0.00 0.00 56.01 57.02 3hiq n LEU 117 Cb 0.44 -1.51 0.69 0.00 -2.33 0.00 0.00 43.42 40.71 3hiq n LEU 117 CO 0.59 -1.37 0.91 1.23 -1.33 0.00 0.00 177.39 177.42 3hiq h GLY 118 N 0.09 0.00 -2.82 -0.72 0.00 -1.94 -3.27 103.07 94.42 3hiq h GLY 118 Ca -0.49 0.00 -0.29 0.00 0.00 0.00 0.00 47.33 46.55 3hiq h GLY 118 CO 0.50 0.00 -0.69 -2.52 0.00 0.00 0.00 176.54 173.83 3hiq s TYR 119 N -3.62 1.15 0.19 5.60 1.13 -1.26 -4.92 117.35 115.63 3hiq s TYR 119 Ca -0.01 -0.90 0.01 0.00 -1.41 0.00 0.00 57.07 54.75 3hiq s TYR 119 Cb 0.08 -0.64 0.04 0.00 -1.10 0.00 0.00 41.96 40.34 3hiq s TYR 119 CO 0.29 -0.09 0.27 0.41 -2.51 0.00 0.00 175.55 173.92 3hiq n GLY 120 N -0.18 1.02 0.21 5.49 0.00 -1.26 -0.96 105.19 109.51 3hiq n GLY 120 Ca -0.09 -2.02 0.11 0.00 0.00 0.00 0.00 46.02 44.02 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 -7.06 1.61 4.11 -1.91 -3.36 114.58 107.97 3hiq h GLU 121 Ca -0.09 0.00 -0.56 0.00 0.07 0.00 0.00 59.36 58.78 3hiq h GLU 121 Cb 0.34 0.00 0.16 0.00 0.50 0.00 0.00 28.75 29.75 3hiq h GLU 121 CO 0.10 0.06 0.49 -1.13 0.07 0.00 0.00 179.01 178.60 3hiq n SER 122 N -3.11 2.06 -0.37 3.06 3.41 -1.26 -4.75 113.62 112.66 3hiq n SER 122 Ca 0.04 0.86 -0.00 0.00 -0.26 0.00 0.00 58.87 59.50 3hiq n SER 122 Cb 0.56 -1.54 0.13 0.00 -0.26 0.00 0.00 64.21 63.10 3hiq n SER 122 CO 0.00 0.00 0.00 1.88 -0.16 0.00 0.00 175.04 176.76 3hiq h TYR 123 N 0.73 1.24 -0.68 7.33 0.05 -1.99 -0.35 116.97 123.30 3hiq h TYR 123 Ca -0.51 0.03 -0.02 0.00 0.05 0.00 0.00 58.73 58.29 3hiq h TYR 123 Cb 1.33 -0.41 -0.03 0.00 1.01 0.00 0.00 36.73 38.63 3hiq h TYR 123 CO 0.42 0.73 0.36 -1.35 -1.05 0.00 0.00 178.16 177.26 3hiq h PRO 124 N 1.29 0.96 -0.01 4.88 0.11 -1.96 0.98 132.00 138.25 3hiq h PRO 124 Ca 0.39 -0.12 0.03 0.00 0.11 0.00 0.00 66.00 66.41 3hiq h PRO 124 Cb -0.04 -0.18 -0.05 0.00 0.11 0.00 0.00 31.00 30.84 3hiq h PRO 124 CO -0.11 0.74 -0.32 1.96 -0.21 0.00 0.00 178.00 180.06 3hiq h GLN 125 N 0.94 -0.45 -0.24 1.05 1.08 -1.62 -1.18 115.11 114.70 3hiq h GLN 125 Ca 0.24 0.03 -0.13 0.00 -1.45 0.00 0.00 58.65 57.33 3hiq h GLN 125 Cb 0.07 0.10 -0.01 0.00 -0.05 0.00 0.00 27.48 27.59 3hiq h GLN 125 CO -0.04 -0.30 -0.41 0.82 -0.95 0.00 0.00 178.83 177.96 3hiq h ILE 126 N -0.46 1.30 -0.47 2.54 2.04 -0.47 -2.99 117.51 118.99 3hiq h ILE 126 Ca 0.06 -1.58 -0.12 0.00 1.00 0.00 0.00 64.86 64.22 3hiq h ILE 126 Cb 0.56 1.56 -0.01 0.00 -0.74 0.00 0.00 36.82 38.18 3hiq h ILE 126 CO -0.27 0.50 -0.20 1.56 0.00 0.00 0.00 178.15 179.74 3hiq h GLN 127 N 0.47 0.95 -0.28 2.37 4.20 0.11 -1.68 115.11 121.25 3hiq h GLN 127 Ca 0.04 -0.39 0.01 0.00 0.06 0.00 0.00 58.65 58.37 3hiq h GLN 127 Cb 0.91 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.64 3hiq h GLN 127 CO 0.08 1.05 0.16 -0.97 -0.67 0.00 0.00 178.83 178.48 3hiq h ASN 128 N 0.82 0.26 -0.26 1.46 -1.24 -1.11 0.38 115.58 115.90 3hiq h ASN 128 Ca 0.11 0.00 -0.06 0.00 0.71 0.00 0.00 56.30 57.06 3hiq h ASN 128 Cb 0.76 -0.05 -0.02 0.00 0.73 0.00 0.00 38.32 39.74 3hiq h ASN 128 CO 0.06 0.19 -0.03 0.00 -1.29 0.00 0.00 177.43 176.36 3hiq h ALA 129 N 1.12 1.26 0.00 1.57 0.00 -1.42 -2.89 119.26 118.91 3hiq h ALA 129 Ca 0.11 -0.24 -0.14 0.00 0.00 0.00 0.00 54.91 54.64 3hiq h ALA 129 Cb -0.00 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.61 3hiq h ALA 129 CO -0.05 0.49 -0.70 0.00 0.00 0.00 0.00 179.25 178.99 3hiq h ALA 130 N 1.41 0.60 -0.03 0.00 0.00 -0.98 -3.35 119.26 116.90 3hiq h ALA 130 Ca 0.11 -0.61 -0.01 0.00 0.00 0.00 0.00 54.91 54.40 3hiq h ALA 130 Cb 0.41 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 3hiq h ALA 130 CO 0.02 0.81 -0.01 0.41 0.00 0.00 0.00 179.25 180.48 3hiq n GLY 131 N 1.27 0.46 3.27 0.00 0.00 0.13 -4.83 105.19 105.49 3hiq n GLY 131 Ca 0.00 -0.73 -0.09 0.00 0.00 0.00 0.00 46.02 45.20 3hiq n GLY 131 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 3hiq s VAL 132 N -2.01 0.10 0.44 1.61 -7.23 -1.08 -5.04 120.40 107.19 3hiq s VAL 132 Ca 0.00 -1.29 0.00 0.00 -1.81 0.00 0.00 61.98 58.88 3hiq s VAL 132 Cb 0.00 -1.60 -0.01 0.00 0.56 0.00 0.00 36.38 35.33 3hiq s VAL 132 CO 0.00 -0.47 0.66 0.42 -0.31 0.00 0.00 175.10 175.41 3hiq s THR 133 N -3.92 4.16 0.22 5.32 -4.23 -1.26 -4.41 115.64 111.52 3hiq s THR 133 Ca 0.11 -0.46 -0.09 0.00 -1.18 0.00 0.00 61.69 60.07 3hiq s THR 133 Cb 0.04 -3.54 0.20 0.00 1.34 0.00 0.00 72.50 70.54 3hiq s THR 133 CO -0.05 -0.38 1.68 0.03 -0.54 0.00 0.00 174.62 175.36 3hiq h ARG 134 N 0.43 0.20 -0.34 3.99 3.08 -1.95 0.15 114.38 119.93 3hiq h ARG 134 Ca -0.47 -0.01 -0.03 0.00 0.07 0.00 0.00 59.98 59.54 3hiq h ARG 134 Cb 1.25 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 31.24 3hiq h ARG 134 CO 0.58 0.13 0.10 1.96 -1.07 0.00 0.00 179.97 181.67 3hiq h GLN 135 N 0.20 0.54 -0.82 0.04 4.20 -1.94 -1.84 115.11 115.50 3hiq h GLN 135 Ca 0.35 -0.12 -0.04 0.00 0.06 0.00 0.00 58.65 58.90 3hiq h GLN 135 Cb 0.56 -0.08 -0.04 0.00 0.30 0.00 0.00 27.48 28.22 3hiq h GLN 135 CO -0.48 0.57 0.36 1.96 -0.67 0.00 0.00 178.83 180.57 3hiq h GLN 136 N 0.40 1.20 -0.69 1.46 4.20 -1.86 -3.19 115.11 116.63 3hiq h GLN 136 Ca 0.11 -0.20 -0.04 0.00 0.06 0.00 0.00 58.65 58.58 3hiq h GLN 136 Cb 0.26 -0.20 -0.03 0.00 0.30 0.00 0.00 27.48 27.81 3hiq h GLN 136 CO -0.00 0.95 0.26 0.00 -0.67 0.00 0.00 178.83 179.37 3hiq h ALA 137 N 1.19 0.89 -0.26 3.87 0.00 -0.25 -3.48 119.26 121.22 3hiq h ALA 137 Ca 0.28 -0.19 0.03 0.00 0.00 0.00 0.00 54.91 55.03 3hiq h ALA 137 Cb 0.17 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.68 3hiq h ALA 137 CO -0.03 0.53 -0.06 0.41 0.00 0.00 0.00 179.25 180.10 3hiq n GLY 138 N -0.82 -1.82 3.21 0.00 0.00 -0.73 -5.00 105.19 100.03 3hiq n GLY 138 Ca 0.05 -1.48 -0.16 0.00 0.00 0.00 0.00 46.02 44.44 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 -4.45 2.43 0.00 0.99 1.43 0.12 -4.92 118.68 114.28 3hiq s LEU 139 Ca 0.00 -0.85 0.00 0.00 -1.03 0.00 0.00 54.13 52.25 3hiq s LEU 139 Cb 0.00 -0.40 0.00 0.00 0.03 0.00 0.00 46.19 45.82 3hiq s LEU 139 CO 0.00 -0.23 0.00 0.61 0.23 0.00 0.00 176.35 176.96 3hiq n GLY 140 N 0.40 3.16 0.24 -3.19 0.00 -1.26 0.18 105.19 104.72 3hiq n GLY 140 Ca -0.15 -0.81 -0.15 0.00 0.00 0.00 0.00 46.02 44.91 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 1.68 1.28 -0.13 -0.61 1.08 -1.93 -1.09 117.51 117.79 3hiq h ILE 141 Ca 0.00 -1.76 -0.11 0.00 -0.39 0.00 0.00 64.86 62.60 3hiq h ILE 141 Cb 0.00 1.71 -0.01 0.00 -3.07 0.00 0.00 36.82 35.45 3hiq h ILE 141 CO 0.00 0.57 -0.40 0.11 -0.69 0.00 0.00 178.15 177.74 3hiq h LYS 142 N 0.61 0.29 -0.31 2.37 1.57 -1.95 -0.55 116.57 118.61 3hiq h LYS 142 Ca 0.00 -0.13 -0.01 0.00 -1.87 0.00 0.00 60.65 58.63 3hiq h LYS 142 Cb 1.18 -0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.48 3hiq h LYS 142 CO 0.13 0.64 0.13 0.87 -0.57 0.00 0.00 179.45 180.65 3hiq h LYS 143 N 0.24 0.45 -0.19 3.15 1.57 -1.87 -1.08 116.57 118.85 3hiq h LYS 143 Ca 0.02 -0.08 -0.01 0.00 -1.87 0.00 0.00 60.65 58.72 3hiq h LYS 143 Cb 0.81 -0.08 -0.01 0.00 0.08 0.00 0.00 32.23 33.03 3hiq h LYS 143 CO 0.06 0.45 0.10 1.25 -0.57 0.00 0.00 179.45 180.74 3hiq h LEU 144 N 0.35 0.24 -0.70 2.94 5.85 -0.93 -2.34 115.31 120.72 3hiq h LEU 144 Ca 0.10 -0.10 -0.07 0.00 0.84 0.00 0.00 57.88 58.66 3hiq h LEU 144 Cb 0.16 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.10 3hiq h LEU 144 CO -0.01 0.27 0.18 0.00 -0.34 0.00 0.00 178.44 178.55 3hiq h ALA 145 N 0.98 0.93 0.10 1.25 0.00 -1.00 -1.54 119.26 119.98 3hiq h ALA 145 Ca 0.06 -0.24 0.01 0.00 0.00 0.00 0.00 54.91 54.74 3hiq h ALA 145 Cb 0.09 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 3hiq h ALA 145 CO -0.01 0.64 -0.12 1.49 0.00 0.00 0.00 179.25 181.25 3hiq h GLU 146 N 1.06 -0.25 -0.02 0.00 4.57 -1.14 -2.56 114.58 116.24 3hiq h GLU 146 Ca 0.22 0.02 -0.03 0.00 -1.18 0.00 0.00 59.36 58.39 3hiq h GLU 146 Cb 0.35 0.06 -0.00 0.00 -0.16 0.00 0.00 28.75 29.00 3hiq h GLU 146 CO -0.00 -0.16 -0.12 0.66 -1.18 0.00 0.00 179.01 178.21 3hiq h SER 147 N -0.26 0.03 0.11 1.04 4.64 -1.00 -2.21 113.55 115.90 3hiq h SER 147 Ca 0.01 -0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.28 3hiq h SER 147 Cb 0.25 -0.01 -0.01 0.00 -0.31 0.00 0.00 62.40 62.33 3hiq h SER 147 CO -0.04 0.15 -0.17 -0.03 -0.87 0.00 0.00 176.83 175.87 3hiq h MET 148 N 0.03 0.12 -0.12 4.77 1.85 -0.87 -2.72 114.93 118.00 3hiq h MET 148 Ca 0.01 -0.03 0.04 0.00 -0.61 0.00 0.00 59.70 59.10 3hiq h MET 148 Cb 0.23 -0.02 -0.00 0.00 0.43 0.00 0.00 31.60 32.24 3hiq h MET 148 CO 0.02 0.30 0.23 1.79 -0.40 0.00 0.00 176.91 178.84 3hiq h THR 149 N 0.12 0.24 -0.11 -0.77 1.35 -1.27 0.44 112.91 112.91 3hiq h THR 149 Ca 0.02 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.88 3hiq h THR 149 Cb 0.37 0.80 0.00 0.00 -1.73 0.00 0.00 68.15 67.59 3hiq h THR 149 CO 0.02 0.00 0.00 0.29 -0.25 0.00 0.00 175.52 175.58 3hiq n LYS 150 N -3.40 1.52 0.00 4.72 4.76 -1.02 -3.81 118.16 120.92 3hiq n LYS 150 Ca 0.00 -0.78 0.00 0.00 -2.87 0.00 0.00 58.31 54.67 3hiq n LYS 150 Cb 0.33 -1.38 0.00 0.00 -1.84 0.00 0.00 35.03 32.14 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 -0.01 0.00 -2.85 -0.18 0.24 0.14 -4.60 118.33 111.07 3hiq n VAL 151 Ca 0.16 -0.03 -0.43 0.00 -2.04 0.00 0.00 64.34 62.00 3hiq n VAL 151 Cb 0.26 0.34 -0.03 0.00 -1.47 0.00 0.00 33.84 32.93 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 -0.87 6.29 -0.46 -1.34 3.04 -0.09 -3.85 114.94 117.66 3hiq s ASN 152 Ca 0.00 -1.24 0.00 0.00 0.04 0.00 0.00 52.86 51.66 3hiq s ASN 152 Cb 0.00 -2.43 0.00 0.00 -1.54 0.00 0.00 41.25 37.28 3hiq s ASN 152 CO 0.00 -1.37 0.00 0.61 -3.04 0.00 0.00 177.10 173.30 3hiq n GLY 153 N 5.45 0.47 3.34 1.21 0.00 0.35 -4.91 105.19 111.09 3hiq n GLY 153 Ca 0.05 -0.77 -0.17 0.00 0.00 0.00 0.00 46.02 45.12 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 -2.21 1.04 0.41 1.61 -7.23 -1.20 -4.18 120.40 108.63 3hiq s VAL 154 Ca 0.00 -2.03 -0.25 0.00 -1.81 0.00 0.00 61.98 57.89 3hiq s VAL 154 Cb 0.00 -2.39 -0.11 0.00 0.56 0.00 0.00 36.38 34.44 3hiq s VAL 154 CO 0.00 -0.29 1.11 0.00 -0.31 0.00 0.00 175.10 175.61 3hiq n ALA 155 N -0.44 0.57 -2.08 1.32 0.00 -1.26 -3.21 120.51 115.41 3hiq n ALA 155 Ca -0.05 0.26 -0.41 0.00 0.00 0.00 0.00 53.44 53.24 3hiq n ALA 155 Cb 0.64 -2.15 -0.04 0.00 0.00 0.00 0.00 19.45 17.90 3hiq n ALA 155 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 3hiq s ARG 156 N -2.04 4.62 -0.19 0.00 3.52 -1.26 -4.85 118.95 118.75 3hiq s ARG 156 Ca 0.62 1.67 -0.02 0.00 -0.13 0.00 0.00 55.73 57.88 3hiq s ARG 156 Cb -0.55 -3.29 0.05 0.00 -1.56 0.00 0.00 34.95 29.60 3hiq s ARG 156 CO 0.58 0.11 0.00 0.08 -0.81 0.00 0.00 175.30 175.26 3hiq s VAL 157 N -0.24 0.80 0.22 7.11 1.01 -1.26 -5.06 120.40 122.97 3hiq s VAL 157 Ca 0.49 -0.63 -0.09 0.00 0.00 0.00 0.00 61.98 61.74 3hiq s VAL 157 Cb -0.28 -1.17 0.33 0.00 0.00 0.00 0.00 36.38 35.26 3hiq s VAL 157 CO 0.34 -0.09 1.29 1.21 0.00 0.00 0.00 175.10 177.85 3hiq n GLU 158 N 4.96 -0.11 0.05 2.72 2.13 -1.26 -0.45 120.64 128.67 3hiq n GLU 158 Ca -0.10 1.29 -0.02 0.00 0.66 0.00 0.00 57.16 59.00 3hiq n GLU 158 Cb 0.47 -1.93 0.25 0.00 0.27 0.00 0.00 31.44 30.50 3hiq n GLU 158 CO 0.00 0.00 0.00 1.57 -0.41 0.00 0.00 177.13 178.29 3hiq h LYS 159 N 0.00 0.40 -0.01 5.31 2.10 -1.93 -0.15 116.57 122.30 3hiq h LYS 159 Ca 0.37 -0.14 -0.23 0.00 -2.00 0.00 0.00 60.65 58.66 3hiq h LYS 159 Cb 0.58 -0.03 0.02 0.00 -0.90 0.00 0.00 32.23 31.89 3hiq h LYS 159 CO -0.85 0.61 -0.88 -0.44 -2.00 0.00 0.00 179.45 175.89 3hiq h ASP 160 N 0.36 0.79 -0.30 7.07 3.32 -1.08 -2.31 116.42 124.27 3hiq h ASP 160 Ca 0.06 -0.74 0.04 0.00 0.02 0.00 0.00 57.03 56.41 3hiq h ASP 160 Cb 0.60 -0.24 -0.04 0.00 0.22 0.00 0.00 39.33 39.87 3hiq h ASP 160 CO 0.04 1.42 0.07 -0.08 -1.72 0.00 0.00 179.24 178.98 3hiq h GLU 161 N 0.23 0.19 -0.50 3.56 4.81 -1.16 -1.81 114.58 119.89 3hiq h GLU 161 Ca -0.11 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.11 3hiq h GLU 161 Cb 1.55 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 30.87 3hiq h GLU 161 CO 0.17 0.12 0.31 0.00 -0.73 0.00 0.00 179.01 178.89 3hiq h ALA 162 N 1.21 0.64 -0.05 2.92 0.00 -1.02 0.23 119.26 123.20 3hiq h ALA 162 Ca 0.14 -0.06 0.03 0.00 0.00 0.00 0.00 54.91 55.02 3hiq h ALA 162 Cb 0.14 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.69 3hiq h ALA 162 CO -0.17 0.11 -0.15 1.25 0.00 0.00 0.00 179.25 180.30 3hiq h LEU 163 N 0.67 -0.44 -0.61 0.00 5.85 -1.14 0.61 115.31 120.25 3hiq h LEU 163 Ca 0.18 0.07 0.12 0.00 0.84 0.00 0.00 57.88 59.09 3hiq h LEU 163 Cb -0.03 0.20 -0.12 0.00 0.37 0.00 0.00 40.66 41.08 3hiq h LEU 163 CO -0.04 -0.20 -0.21 0.15 -0.34 0.00 0.00 178.44 177.81 3hiq h PHE 164 N -0.22 -0.50 -0.72 1.25 3.57 -0.97 -2.00 116.94 117.36 3hiq h PHE 164 Ca 0.07 0.06 -0.00 0.00 3.53 0.00 0.00 57.97 61.62 3hiq h PHE 164 Cb 0.31 0.31 -0.03 0.00 2.79 0.00 0.00 35.95 39.33 3hiq h PHE 164 CO -0.23 -0.31 0.44 -0.07 -2.23 0.00 0.00 178.31 175.92 3hiq h LEU 165 N -0.05 0.86 -1.04 0.59 3.38 0.10 -0.77 115.31 118.37 3hiq h LEU 165 Ca 0.28 -0.06 0.01 0.00 0.09 0.00 0.00 57.88 58.20 3hiq h LEU 165 Cb 0.49 -0.22 -0.05 0.00 0.09 0.00 0.00 40.66 40.98 3hiq h LEU 165 CO -0.66 0.66 0.62 0.25 0.09 0.00 0.00 178.44 179.40 3hiq h LEU 166 N 0.98 1.10 0.22 1.67 5.85 0.85 -1.67 115.31 124.32 3hiq h LEU 166 Ca 0.26 -0.04 -0.35 0.00 0.84 0.00 0.00 57.88 58.60 3hiq h LEU 166 Cb -0.05 -0.28 0.02 0.00 0.37 0.00 0.00 40.66 40.73 3hiq h LEU 166 CO -0.05 0.81 -1.62 0.40 -0.34 0.00 0.00 178.44 177.64 3hiq h ILE 167 N 1.29 1.11 -0.04 4.05 2.04 -1.26 -3.33 117.51 121.38 3hiq h ILE 167 Ca 0.35 -2.61 -0.17 0.00 1.00 0.00 0.00 64.86 63.42 3hiq h ILE 167 Cb -0.13 2.91 -0.01 0.00 -0.74 0.00 0.00 36.82 38.85 3hiq h ILE 167 CO -0.07 0.84 -0.73 1.62 0.00 0.00 0.00 178.15 179.81 3hiq h VAL 168 N 0.13 1.43 -0.11 1.67 3.04 -0.80 0.17 116.25 121.78 3hiq h VAL 168 Ca -0.30 -2.26 -0.06 0.00 -1.01 0.00 0.00 66.70 63.08 3hiq h VAL 168 Cb 2.14 2.20 -0.01 0.00 -2.01 0.00 0.00 31.29 33.61 3hiq h VAL 168 CO 0.23 0.66 -0.19 -0.37 -1.01 0.00 0.00 177.57 176.89 3hiq h VAL 169 N 0.15 1.19 0.05 1.51 -1.51 -1.47 0.33 116.25 116.51 3hiq h VAL 169 Ca -0.02 -0.88 -0.08 0.00 -1.23 0.00 0.00 66.70 64.49 3hiq h VAL 169 Cb 1.29 1.32 0.01 0.00 -2.13 0.00 0.00 31.29 31.78 3hiq h VAL 169 CO 0.11 0.27 -0.36 1.56 -1.23 0.00 0.00 177.57 177.92 3hiq h GLN 170 N 0.16 0.15 -0.69 5.19 4.20 -1.57 0.42 115.11 122.96 3hiq h GLN 170 Ca 0.03 -0.23 0.08 0.00 0.06 0.00 0.00 58.65 58.60 3hiq h GLN 170 Cb 0.44 0.08 -0.04 0.00 0.30 0.00 0.00 27.48 28.25 3hiq h GLN 170 CO 0.03 1.08 0.46 0.52 -0.67 0.00 0.00 178.83 180.25 3hiq h MET 171 N -0.67 0.60 0.00 1.46 2.86 -0.54 -0.74 114.93 117.90 3hiq h MET 171 Ca -0.06 -0.04 -0.13 0.00 -2.06 0.00 0.00 59.70 57.41 3hiq h MET 171 Cb 1.25 -0.14 -0.02 0.00 0.06 0.00 0.00 31.60 32.76 3hiq h MET 171 CO 0.07 0.40 -1.35 0.28 1.06 0.00 0.00 176.91 177.37 3hiq n VAL 172 N -4.48 1.43 0.16 -2.22 0.31 0.09 -4.36 118.33 109.25 3hiq n VAL 172 Ca 0.11 0.01 -0.06 0.00 -0.01 0.00 0.00 64.34 64.39 3hiq n VAL 172 Cb 0.30 -2.12 -0.03 0.00 -0.91 0.00 0.00 33.84 31.08 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 -0.87 -0.42 1.53 2.92 0.00 -0.34 -2.43 103.07 103.45 3hiq h GLY 173 Ca -0.20 0.16 -0.08 0.00 0.00 0.00 0.00 47.33 47.21 3hiq h GLY 173 CO -0.12 -0.15 -0.12 0.83 0.00 0.00 0.00 176.54 176.98 3hiq h GLU 174 N -0.45 0.57 -0.20 4.80 4.39 -0.97 -1.41 114.58 121.31 3hiq h GLU 174 Ca -0.04 -0.17 -0.06 0.00 0.34 0.00 0.00 59.36 59.43 3hiq h GLU 174 Cb 0.31 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 28.89 3hiq h GLU 174 CO 0.07 0.68 -0.15 0.00 -1.16 0.00 0.00 179.01 178.45 3hiq h ALA 175 N 1.35 1.38 -0.08 3.43 0.00 -1.24 0.39 119.26 124.49 3hiq h ALA 175 Ca 0.10 -0.25 -0.03 0.00 0.00 0.00 0.00 54.91 54.73 3hiq h ALA 175 Cb 0.52 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.20 3hiq h ALA 175 CO 0.03 0.43 -0.05 0.00 0.00 0.00 0.00 179.25 179.65 3hiq h ALA 176 N 1.54 0.12 -0.09 0.00 0.00 -0.85 -3.07 119.26 116.90 3hiq h ALA 176 Ca 0.06 -0.26 -0.04 0.00 0.00 0.00 0.00 54.91 54.67 3hiq h ALA 176 Cb 0.46 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.21 3hiq h ALA 176 CO 0.03 -0.10 -0.15 0.00 0.00 0.00 0.00 179.25 179.03 3hiq h ARG 177 N -0.21 0.14 -4.05 0.00 3.08 -0.70 -3.33 114.38 109.30 3hiq h ARG 177 Ca 0.02 -0.03 -0.58 0.00 0.07 0.00 0.00 59.98 59.46 3hiq h ARG 177 Cb 0.53 -0.02 -0.39 0.00 0.08 0.00 0.00 29.97 30.17 3hiq h ARG 177 CO 0.01 0.29 -0.78 -0.06 -1.07 0.00 0.00 179.97 178.37 3hiq s PHE 178 N -4.70 1.88 0.32 3.04 0.40 0.13 0.51 117.98 119.56 3hiq s PHE 178 Ca -0.05 -1.42 0.04 0.00 -0.60 0.00 0.00 56.93 54.90 3hiq s PHE 178 Cb 0.16 -1.38 0.66 0.00 0.51 0.00 0.00 43.02 42.97 3hiq s PHE 178 CO 0.72 -0.71 1.88 -0.22 0.70 0.00 0.00 175.22 177.58 3hiq h LYS 179 N 8.06 0.84 -0.84 0.44 1.63 -1.43 -1.70 116.57 123.57 3hiq h LYS 179 Ca -0.17 -0.05 0.17 0.00 -0.85 0.00 0.00 60.65 59.75 3hiq h LYS 179 Cb 1.09 -0.19 -0.16 0.00 -0.60 0.00 0.00 32.23 32.37 3hiq h LYS 179 CO 0.38 0.56 -0.18 -0.92 -3.45 0.00 0.00 179.45 175.84 3hiq h TYR 180 N 0.87 -0.39 -0.03 1.91 5.03 -1.53 0.39 116.97 123.22 3hiq h TYR 180 Ca 0.44 0.07 -0.03 0.00 2.58 0.00 0.00 58.73 61.79 3hiq h TYR 180 Cb 0.48 0.30 0.00 0.00 1.55 0.00 0.00 36.73 39.07 3hiq h TYR 180 CO -0.00 -0.36 -0.10 0.82 -1.32 0.00 0.00 178.16 177.21 3hiq h ILE 181 N 0.01 1.47 -0.66 1.81 2.04 -1.64 -2.44 117.51 118.10 3hiq h ILE 181 Ca 0.42 -1.53 0.14 0.00 1.00 0.00 0.00 64.86 64.88 3hiq h ILE 181 Cb 0.66 2.41 -0.11 0.00 -0.74 0.00 0.00 36.82 39.04 3hiq h ILE 181 CO -0.85 0.41 -0.00 -0.08 0.00 0.00 0.00 178.15 177.63 3hiq h GLU 182 N -0.46 0.11 -0.48 2.37 4.81 -0.58 -1.55 114.58 118.80 3hiq h GLU 182 Ca -0.00 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.21 3hiq h GLU 182 Cb 0.72 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 30.06 3hiq h GLU 182 CO 0.02 0.07 0.27 -0.91 -0.73 0.00 0.00 179.01 177.74 3hiq h ASN 183 N 0.11 0.59 -0.88 1.04 2.35 -0.23 -0.36 115.58 118.21 3hiq h ASN 183 Ca 0.35 -0.08 0.04 0.00 -0.55 0.00 0.00 56.30 56.05 3hiq h ASN 183 Cb 0.58 -0.15 -0.05 0.00 0.05 0.00 0.00 38.32 38.74 3hiq h ASN 183 CO -0.57 0.50 0.56 -0.07 -1.65 0.00 0.00 177.43 176.20 3hiq h LEU 184 N 0.64 0.93 -0.36 1.61 3.38 -0.88 0.21 115.31 120.85 3hiq h LEU 184 Ca 0.17 -0.01 -0.06 0.00 0.09 0.00 0.00 57.88 58.08 3hiq h LEU 184 Cb 0.03 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 3hiq h LEU 184 CO -0.03 0.64 0.00 0.58 0.09 0.00 0.00 178.44 179.72 3hiq h VAL 185 N 1.09 1.26 -0.61 1.22 2.07 -0.87 -3.00 116.25 117.41 3hiq h VAL 185 Ca 0.35 -0.97 0.01 0.00 0.82 0.00 0.00 66.70 66.91 3hiq h VAL 185 Cb 0.02 1.19 -0.03 0.00 -1.52 0.00 0.00 31.29 30.94 3hiq h VAL 185 CO -0.12 0.32 0.40 -0.07 0.02 0.00 0.00 177.57 178.12 3hiq h LEU 186 N 0.44 0.68 -2.06 2.57 3.38 -0.55 -1.84 115.31 117.94 3hiq h LEU 186 Ca 0.10 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 58.04 3hiq h LEU 186 Cb 0.45 -0.16 -0.00 0.00 0.09 0.00 0.00 40.66 41.04 3hiq h LEU 186 CO 0.02 0.49 -0.08 0.78 0.09 0.00 0.00 178.44 179.74 3hiq h ASN 187 N 0.81 0.00 -0.01 -0.43 2.35 -0.48 -2.47 115.58 115.34 3hiq h ASN 187 Ca 0.23 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.98 3hiq h ASN 187 Cb -0.06 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.30 3hiq h ASN 187 CO -0.06 0.08 -0.09 0.59 -1.65 0.00 0.00 177.43 176.30 3hiq n ASN 188 N -3.50 2.29 -0.22 5.81 3.02 -1.10 -4.84 115.26 116.72 3hiq n ASN 188 Ca -0.02 -3.24 0.12 0.00 -0.03 0.00 0.00 54.58 51.42 3hiq n ASN 188 Cb 0.21 -0.45 0.42 0.00 -0.61 0.00 0.00 39.78 39.34 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 0.24 0.70 -0.02 3.10 3.57 -0.84 -3.16 116.94 120.54 3hiq h PHE 189 Ca 0.00 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.52 3hiq h PHE 189 Cb 1.02 -0.22 0.00 0.00 2.79 0.00 0.00 35.95 39.54 3hiq h PHE 189 CO 0.16 0.28 -0.11 -0.25 -2.23 0.00 0.00 178.31 176.16 3hiq n ASP 190 N -4.52 2.07 -4.90 0.41 8.00 -1.26 -4.87 116.55 111.46 3hiq n ASP 190 Ca 0.16 -1.53 -0.28 0.00 0.71 0.00 0.00 54.79 53.84 3hiq n ASP 190 Cb 0.46 0.16 0.04 0.00 -0.02 0.00 0.00 41.12 41.76 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 -1.49 3.48 0.12 -3.53 -4.23 -1.19 -4.98 115.64 103.82 3hiq s THR 191 Ca 0.16 0.20 -0.14 0.00 -1.18 0.00 0.00 61.69 60.74 3hiq s THR 191 Cb 0.13 -3.43 -0.04 0.00 1.34 0.00 0.00 72.50 70.50 3hiq s THR 191 CO 0.26 -0.51 1.51 0.00 -0.54 0.00 0.00 174.62 175.34 3hiq h ALA 192 N -0.43 0.54 0.00 3.99 0.00 -1.93 -3.31 119.26 118.12 3hiq h ALA 192 Ca -0.45 -0.34 -0.16 0.00 0.00 0.00 0.00 54.91 53.95 3hiq h ALA 192 Cb 1.26 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 18.89 3hiq h ALA 192 CO 0.62 0.46 -0.77 0.87 0.00 0.00 0.00 179.25 180.42 3hiq h LYS 193 N 0.59 0.00 0.00 0.00 1.79 -1.93 -3.49 116.57 113.53 3hiq h LYS 193 Ca 0.09 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.56 3hiq h LYS 193 Cb 0.69 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.34 3hiq h LYS 193 CO 0.05 0.77 0.00 0.39 -1.08 0.00 0.00 179.45 179.58 3hiq n GLU 194 N -3.29 0.00 -3.19 3.15 1.02 -1.25 -4.20 120.64 112.88 3hiq n GLU 194 Ca 0.01 0.00 -0.44 0.00 -0.02 0.00 0.00 57.16 56.71 3hiq n GLU 194 Cb 0.85 0.00 -0.06 0.00 -0.02 0.00 0.00 31.44 32.20 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 4.93 -0.29 2.62 1.01 0.13 -4.94 120.40 123.84 3hiq s VAL 195 Ca 0.00 -0.55 -0.15 0.00 0.00 0.00 0.00 61.98 61.28 3hiq s VAL 195 Cb 0.00 -4.27 0.15 0.00 0.00 0.00 0.00 36.38 32.26 3hiq s VAL 195 CO 0.00 -0.76 0.90 -0.70 0.00 0.00 0.00 175.10 174.54 3hiq s GLU 196 N 2.49 0.40 0.93 2.72 2.12 -1.26 0.14 118.70 126.25 3hiq s GLU 196 Ca 0.14 0.87 -0.12 0.00 0.36 0.00 0.00 54.97 56.23 3hiq s GLU 196 Cb -0.20 0.37 0.15 0.00 0.26 0.00 0.00 34.13 34.72 3hiq s GLU 196 CO 0.11 -0.12 1.09 -1.25 -0.54 0.00 0.00 175.26 174.56 3hiq s PRO 197 N 2.11 0.94 0.05 4.30 0.04 -1.26 -5.05 135.00 136.12 3hiq s PRO 197 Ca -0.06 0.82 -0.30 0.00 0.04 0.00 0.00 61.00 61.50 3hiq s PRO 197 Cb -0.06 -1.77 -0.09 0.00 0.04 0.00 0.00 34.50 32.62 3hiq s PRO 197 CO -0.17 -2.46 1.92 0.08 0.04 0.00 0.00 177.00 176.40 3hiq s VAL 198 N -2.88 2.96 0.83 -0.36 1.01 -1.21 -4.97 120.40 115.79 3hiq s VAL 198 Ca 0.64 0.08 -0.13 0.00 0.00 0.00 0.00 61.98 62.58 3hiq s VAL 198 Cb -0.19 -3.05 0.10 0.00 0.00 0.00 0.00 36.38 33.24 3hiq s VAL 198 CO 0.58 -0.01 1.19 -2.84 0.00 0.00 0.00 175.10 174.03 3hiq s PRO 199 N 4.08 1.48 0.30 2.72 0.02 -1.26 -4.78 135.00 137.56 3hiq s PRO 199 Ca 0.86 1.72 -0.01 0.00 0.02 0.00 0.00 61.00 63.59 3hiq s PRO 199 Cb -0.43 -1.76 0.45 0.00 0.02 0.00 0.00 34.50 32.78 3hiq s PRO 199 CO 0.40 -2.33 1.88 -0.44 -0.33 0.00 0.00 177.00 176.18 3hiq h ASP 200 N -1.13 0.79 -0.45 2.53 3.32 -2.00 -2.46 116.42 117.02 3hiq h ASP 200 Ca -0.46 -0.10 -0.07 0.00 0.02 0.00 0.00 57.03 56.43 3hiq h ASP 200 Cb 1.29 -0.20 -0.02 0.00 0.22 0.00 0.00 39.33 40.61 3hiq h ASP 200 CO 0.45 0.71 0.05 0.03 -1.72 0.00 0.00 179.24 178.75 3hiq h ARG 201 N 0.86 0.84 0.36 3.56 3.08 -1.98 -0.20 114.38 120.89 3hiq h ARG 201 Ca 0.21 -0.21 -0.00 0.00 0.07 0.00 0.00 59.98 60.04 3hiq h ARG 201 Cb 0.16 -0.11 -0.03 0.00 0.08 0.00 0.00 29.97 30.08 3hiq h ARG 201 CO -0.02 0.81 -0.42 0.28 -1.07 0.00 0.00 179.97 179.55 3hiq h VAL 202 N 0.79 0.15 -0.94 2.04 2.07 -1.80 0.28 116.25 118.85 3hiq h VAL 202 Ca 0.16 0.00 0.23 0.00 0.82 0.00 0.00 66.70 67.91 3hiq h VAL 202 Cb 0.41 0.15 -0.12 0.00 -1.52 0.00 0.00 31.29 30.21 3hiq h VAL 202 CO 0.01 0.00 0.48 0.40 0.02 0.00 0.00 177.57 178.48 3hiq h ILE 203 N -0.82 0.51 -0.21 4.57 1.08 -1.39 0.25 117.51 121.51 3hiq h ILE 203 Ca -0.03 -0.17 -0.21 0.00 -0.39 0.00 0.00 64.86 64.07 3hiq h ILE 203 Cb 0.74 -0.02 0.01 0.00 -3.07 0.00 0.00 36.82 34.48 3hiq h ILE 203 CO -0.10 0.09 -0.67 0.40 -0.69 0.00 0.00 178.15 177.18 3hiq h ILE 204 N 0.49 1.28 -0.41 -0.67 2.04 -0.37 -2.99 117.51 116.87 3hiq h ILE 204 Ca 0.59 -1.86 0.00 0.00 1.00 0.00 0.00 64.86 64.60 3hiq h ILE 204 Cb 1.11 1.83 -0.02 0.00 -0.74 0.00 0.00 36.82 38.99 3hiq h ILE 204 CO -0.50 0.60 0.27 -0.07 0.00 0.00 0.00 178.15 178.45 3hiq h LEU 205 N 0.59 0.47 -1.95 1.44 3.38 0.11 -2.36 115.31 117.00 3hiq h LEU 205 Ca -0.02 -0.01 0.10 0.00 0.09 0.00 0.00 57.88 58.04 3hiq h LEU 205 Cb 1.29 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.91 3hiq h LEU 205 CO 0.14 0.34 0.27 -0.33 0.09 0.00 0.00 178.44 178.96 3hiq h GLU 206 N 0.56 0.05 -0.01 1.13 5.08 -0.96 -0.93 114.58 119.50 3hiq h GLU 206 Ca 0.15 -0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.51 3hiq h GLU 206 Cb -0.07 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.17 3hiq h GLU 206 CO -0.03 0.04 -0.05 -1.71 -1.00 0.00 0.00 179.01 176.25 3hiq n ASN 207 N -4.44 0.71 -0.19 1.42 2.85 -0.90 -4.20 115.26 110.51 3hiq n ASN 207 Ca 0.06 -1.02 0.02 0.00 -0.11 0.00 0.00 54.58 53.53 3hiq n ASN 207 Cb 0.42 -0.02 0.03 0.00 1.24 0.00 0.00 39.78 41.45 3hiq n ASN 207 CO 0.00 0.00 0.00 0.59 -2.11 0.00 0.00 177.26 175.74 3hiq n ASN 208 N -0.58 0.80 -0.29 1.20 3.02 -0.36 -4.84 115.26 114.21 3hiq n ASN 208 Ca 0.18 -1.93 0.03 0.00 -0.03 0.00 0.00 54.58 52.83 3hiq n ASN 208 Cb 0.26 -0.16 0.17 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 0.85 -0.23 3.10 7.01 -1.70 -0.15 115.95 124.83 3hiq h TRP 209 Ca 0.00 0.03 -0.13 0.00 2.11 0.00 0.00 58.89 60.90 3hiq h TRP 209 Cb 1.06 -0.26 -0.00 0.00 -2.10 0.00 0.00 29.16 27.86 3hiq h TRP 209 CO 0.04 0.35 -0.35 0.78 -2.79 0.00 0.00 178.44 176.46 3hiq h GLY 210 N 0.79 0.70 0.83 2.65 0.00 -1.92 -0.87 103.07 105.24 3hiq h GLY 210 Ca 0.39 -0.78 0.03 0.00 0.00 0.00 0.00 47.33 46.98 3hiq h GLY 210 CO -0.25 0.70 0.34 -2.00 0.00 0.00 0.00 176.54 175.33 3hiq h LEU 211 N 0.34 0.53 -0.28 3.11 7.12 -1.83 -1.11 115.31 123.20 3hiq h LEU 211 Ca 0.02 0.01 -0.05 0.00 0.13 0.00 0.00 57.88 57.99 3hiq h LEU 211 Cb 0.94 -0.10 -0.01 0.00 -0.53 0.00 0.00 40.66 40.96 3hiq h LEU 211 CO 0.08 0.37 -0.03 -0.07 -0.13 0.00 0.00 178.44 178.66 3hiq h LEU 212 N 0.66 0.50 -0.45 2.25 3.38 -0.88 -1.47 115.31 119.29 3hiq h LEU 212 Ca 0.24 -0.34 0.05 0.00 0.09 0.00 0.00 57.88 57.92 3hiq h LEU 212 Cb 0.06 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 40.62 3hiq h LEU 212 CO -0.12 0.72 0.18 0.28 0.09 0.00 0.00 178.44 179.60 3hiq h SER 213 N 0.28 0.21 -0.89 -0.43 0.02 -0.98 0.58 113.55 112.34 3hiq h SER 213 Ca 0.07 0.04 0.04 0.00 -0.84 0.00 0.00 61.79 61.11 3hiq h SER 213 Cb 0.48 0.02 -0.05 0.00 0.14 0.00 0.00 62.40 62.98 3hiq h SER 213 CO 0.02 0.16 0.59 0.03 -1.14 0.00 0.00 176.83 176.48 3hiq h ARG 214 N 0.37 1.06 0.00 3.45 3.08 -1.09 -2.05 114.38 119.20 3hiq h ARG 214 Ca 0.21 -0.06 -0.15 0.00 0.07 0.00 0.00 59.98 60.04 3hiq h ARG 214 Cb 0.18 -0.24 -0.02 0.00 0.08 0.00 0.00 29.97 29.97 3hiq h ARG 214 CO -0.20 0.70 -0.73 0.00 -1.07 0.00 0.00 179.97 178.68 3hiq h ALA 215 N 1.49 0.55 -0.63 0.04 0.00 -0.70 -3.09 119.26 116.91 3hiq h ALA 215 Ca 0.36 -0.66 -0.09 0.00 0.00 0.00 0.00 54.91 54.52 3hiq h ALA 215 Cb 0.06 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.71 3hiq h ALA 215 CO -0.11 0.91 0.04 0.00 0.00 0.00 0.00 179.25 180.09 3hiq h ALA 216 N 1.27 0.85 -0.66 0.00 0.00 -0.40 -1.12 119.26 119.20 3hiq h ALA 216 Ca -0.01 -0.30 0.02 0.00 0.00 0.00 0.00 54.91 54.62 3hiq h ALA 216 Cb 1.53 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 19.05 3hiq h ALA 216 CO 0.09 0.67 0.44 -0.22 0.00 0.00 0.00 179.25 180.23 3hiq h LYS 217 N 1.00 0.82 -0.38 0.00 3.64 -1.30 -2.15 116.57 118.19 3hiq h LYS 217 Ca 0.18 -0.05 0.00 0.00 -1.27 0.00 0.00 60.65 59.51 3hiq h LYS 217 Cb 0.52 -0.19 0.00 0.00 -0.41 0.00 0.00 32.23 32.16 3hiq h LYS 217 CO 0.03 0.54 0.00 0.25 -2.27 0.00 0.00 179.45 178.00 3hiq n THR 218 N -4.45 0.56 -1.56 1.00 -2.24 -1.13 -4.19 114.28 102.27 3hiq n THR 218 Ca 0.07 -0.78 -0.34 0.00 -2.27 0.00 0.00 64.05 60.74 3hiq n THR 218 Cb 0.08 0.92 0.07 0.00 -2.10 0.00 0.00 70.33 69.31 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 -1.35 2.26 -0.25 6.98 0.00 -0.44 -4.26 121.76 124.70 3hiq s ALA 219 Ca 0.36 0.73 -0.03 0.00 0.00 0.00 0.00 51.96 53.01 3hiq s ALA 219 Cb 0.21 -3.40 0.01 0.00 0.00 0.00 0.00 23.12 19.94 3hiq s ALA 219 CO 0.29 -1.63 -0.02 -0.80 0.00 0.00 0.00 175.76 173.59 3hiq s ASN 220 N -2.28 4.48 -1.51 0.00 -0.87 -0.63 -4.30 114.94 109.82 3hiq s ASN 220 Ca 0.71 -0.69 -0.13 0.00 -1.57 0.00 0.00 52.86 51.18 3hiq s ASN 220 Cb -0.25 -1.73 0.08 0.00 -0.02 0.00 0.00 41.25 39.32 3hiq s ASN 220 CO 0.44 -0.11 1.01 0.59 -2.57 0.00 0.00 177.10 176.46 3hiq n ASN 221 N 4.75 -5.06 0.00 -1.22 3.02 -0.08 -1.28 115.26 115.39 3hiq n ASN 221 Ca -0.17 -0.74 0.00 0.00 -0.03 0.00 0.00 54.58 53.64 3hiq n ASN 221 Cb 0.48 -4.03 0.00 0.00 -0.61 0.00 0.00 39.78 35.63 3hiq n ASN 221 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3hiq n GLY 222 N -1.73 1.92 3.54 7.41 0.00 -0.04 -4.95 105.19 111.34 3hiq n GLY 222 Ca 0.04 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.65 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 -2.34 5.10 0.26 1.61 1.01 -0.40 -0.35 120.40 125.29 3hiq s VAL 223 Ca 0.00 0.12 -0.30 0.00 0.00 0.00 0.00 61.98 61.81 3hiq s VAL 223 Cb 0.00 -3.89 -0.14 0.00 0.00 0.00 0.00 36.38 32.35 3hiq s VAL 223 CO 0.00 -0.17 1.18 0.49 0.00 0.00 0.00 175.10 176.60 3hiq n PHE 224 N 5.54 1.64 -0.32 5.22 3.72 -0.06 -1.60 117.46 131.60 3hiq n PHE 224 Ca -0.07 0.61 0.13 0.00 -0.05 0.00 0.00 57.45 58.07 3hiq n PHE 224 Cb 0.49 -2.33 0.35 0.00 -0.94 0.00 0.00 39.48 37.05 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 2.88 0.71 -4.14 -1.08 4.15 -1.82 -3.39 115.11 112.41 3hiq h GLN 225 Ca -0.43 -0.04 -0.44 0.00 0.77 0.00 0.00 58.65 58.51 3hiq h GLN 225 Cb 1.32 -0.16 -0.34 0.00 0.21 0.00 0.00 27.48 28.51 3hiq h GLN 225 CO 0.66 0.47 -0.78 0.99 -1.93 0.00 0.00 178.83 178.24 3hiq s THR 226 N -5.76 0.69 0.66 2.39 2.01 -1.26 -5.10 115.64 109.28 3hiq s THR 226 Ca -0.11 -0.21 -0.17 0.00 0.31 0.00 0.00 61.69 61.52 3hiq s THR 226 Cb 0.23 -0.70 -0.06 0.00 0.01 0.00 0.00 72.50 71.99 3hiq s THR 226 CO 0.80 0.26 0.54 -2.65 -0.69 0.00 0.00 174.62 172.88 3hiq n PRO 227 N 4.07 0.40 -5.09 4.92 -0.02 -1.26 -4.95 135.00 133.07 3hiq n PRO 227 Ca -0.23 0.17 -0.32 0.00 -2.02 0.00 0.00 63.50 61.10 3hiq n PRO 227 Cb 0.51 -1.79 -0.15 0.00 -0.02 0.00 0.00 33.50 32.04 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 0.10 2.33 -0.56 2.45 1.43 0.96 -4.95 118.68 120.45 3hiq s LEU 228 Ca 0.67 -0.41 -0.14 0.00 -1.03 0.00 0.00 54.13 53.22 3hiq s LEU 228 Cb -0.39 -1.46 0.14 0.00 0.03 0.00 0.00 46.19 44.52 3hiq s LEU 228 CO 0.56 0.25 0.49 -0.69 0.23 0.00 0.00 176.35 177.20 3hiq s VAL 229 N -0.18 5.00 0.51 -1.59 1.01 -1.26 1.00 120.40 124.89 3hiq s VAL 229 Ca -0.02 -1.71 -0.17 0.00 0.00 0.00 0.00 61.98 60.08 3hiq s VAL 229 Cb -0.14 -4.21 -0.08 0.00 0.00 0.00 0.00 36.38 31.96 3hiq s VAL 229 CO 0.04 -0.87 0.99 -0.76 0.00 0.00 0.00 175.10 174.49 3hiq s LEU 230 N 1.35 3.63 0.06 3.92 1.43 0.59 -4.87 118.68 124.79 3hiq s LEU 230 Ca 0.06 1.58 -0.23 0.00 -1.03 0.00 0.00 54.13 54.50 3hiq s LEU 230 Cb -0.27 -4.51 0.06 0.00 0.03 0.00 0.00 46.19 41.50 3hiq s LEU 230 CO 0.01 -0.59 0.55 -0.89 0.23 0.00 0.00 176.35 175.66 3hiq s THR 231 N -2.61 0.02 -0.19 5.49 2.01 -1.26 -1.65 115.64 117.45 3hiq s THR 231 Ca 0.59 -0.18 -0.11 0.00 0.31 0.00 0.00 61.69 62.30 3hiq s THR 231 Cb -0.10 -0.99 0.06 0.00 0.01 0.00 0.00 72.50 71.48 3hiq s THR 231 CO 0.31 -0.10 0.46 -0.55 -0.69 0.00 0.00 174.62 174.05 3hiq s SER 232 N -2.04 -0.58 0.63 3.53 0.15 -1.26 -4.85 113.70 109.27 3hiq s SER 232 Ca -0.05 1.00 0.29 0.00 0.70 0.00 0.00 55.95 57.89 3hiq s SER 232 Cb -0.01 0.89 1.56 0.00 -1.71 0.00 0.00 66.02 66.75 3hiq s SER 232 CO -0.03 -0.20 1.92 0.10 1.20 0.00 0.00 173.24 176.24 3hiq h TYR 233 N 6.91 0.00 0.00 3.44 -0.00 -1.98 0.16 116.97 125.50 3hiq h TYR 233 Ca -0.35 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.38 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 0.23 0.00 -0.35 0.00 -0.00 0.00 0.00 178.16 178.05 3hiq n ALA 234 N -2.12 3.06 -3.44 0.10 0.00 -1.26 -3.86 120.51 112.99 3hiq n ALA 234 Ca 0.03 -0.25 -0.26 0.00 0.00 0.00 0.00 53.44 52.95 3hiq n ALA 234 Cb 0.50 -1.24 -0.09 0.00 0.00 0.00 0.00 19.45 18.61 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 -1.61 0.13 -1.69 0.00 0.24 0.04 -5.08 118.33 110.36 3hiq n VAL 235 Ca 0.06 -4.20 -0.44 0.00 -2.04 0.00 0.00 64.34 57.72 3hiq n VAL 235 Cb 0.35 -1.93 -0.03 0.00 -1.47 0.00 0.00 33.84 30.77 3hiq n VAL 235 CO 0.00 0.00 0.00 -0.81 -2.14 0.00 0.00 176.83 173.88 3hiq n PRO 236 N 1.89 2.29 0.00 7.34 -0.04 -1.23 -2.35 135.00 142.90 3hiq n PRO 236 Ca 0.25 0.82 0.00 0.00 -0.04 0.00 0.00 63.50 64.53 3hiq n PRO 236 Cb 0.46 -2.54 0.00 0.00 -0.04 0.00 0.00 33.50 31.37 3hiq n PRO 236 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 3hiq n GLY 237 N 2.54 2.03 3.76 0.55 0.00 -1.26 -5.03 105.19 107.78 3hiq n GLY 237 Ca 0.12 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.76 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 -2.33 5.09 -0.07 1.61 1.01 -0.99 -5.08 120.40 119.64 3hiq s VAL 238 Ca 0.00 0.97 0.03 0.00 0.00 0.00 0.00 61.98 62.97 3hiq s VAL 238 Cb 0.00 -3.81 0.01 0.00 0.00 0.00 0.00 36.38 32.58 3hiq s VAL 238 CO 0.00 0.41 -0.15 -1.61 0.00 0.00 0.00 175.10 173.75 3hiq s GLU 239 N 0.01 2.04 -0.39 2.72 2.02 -1.26 -4.55 118.70 119.29 3hiq s GLU 239 Ca 0.26 -0.54 -0.05 0.00 0.02 0.00 0.00 54.97 54.67 3hiq s GLU 239 Cb -0.16 -1.63 0.09 0.00 0.10 0.00 0.00 34.13 32.52 3hiq s GLU 239 CO 0.12 0.07 0.18 -0.46 0.02 0.00 0.00 175.26 175.19 3hiq s TRP 240 N 0.56 3.44 -0.04 1.61 -0.00 -0.66 -4.94 118.94 118.91 3hiq s TRP 240 Ca -0.15 -2.02 -0.26 0.00 -0.00 0.00 0.00 56.10 53.67 3hiq s TRP 240 Cb -0.16 -2.91 -0.03 0.00 -0.00 0.00 0.00 33.47 30.37 3hiq s TRP 240 CO 0.05 -0.90 0.83 0.50 -0.00 0.00 0.00 176.95 177.43 3hiq s ARG 241 N 1.26 4.48 0.09 5.86 3.52 -1.26 -0.30 118.95 132.61 3hiq s ARG 241 Ca 0.04 1.12 0.05 0.00 -0.13 0.00 0.00 55.73 56.80 3hiq s ARG 241 Cb -0.22 -3.46 -0.03 0.00 -1.56 0.00 0.00 34.95 29.68 3hiq s ARG 241 CO -0.02 0.00 -0.13 0.14 -0.81 0.00 0.00 175.30 174.49 3hiq s VAL 242 N 0.94 1.09 0.00 7.11 -7.23 0.28 -4.96 120.40 117.64 3hiq s VAL 242 Ca 0.44 -1.50 0.00 0.00 -1.81 0.00 0.00 61.98 59.11 3hiq s VAL 242 Cb -0.19 -1.25 0.00 0.00 0.56 0.00 0.00 36.38 35.50 3hiq s VAL 242 CO 0.22 -0.38 0.00 0.35 -0.31 0.00 0.00 175.10 174.99 3hiq n THR 243 N 0.89 0.00 -4.22 5.32 -2.24 -1.26 -0.03 114.28 112.75 3hiq n THR 243 Ca -0.18 -0.02 -0.13 0.00 -2.27 0.00 0.00 64.05 61.45 3hiq n THR 243 Cb 0.56 0.38 -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 -1.28 0.94 0.29 4.28 -4.23 -1.26 -0.88 115.64 113.50 3hiq s THR 244 Ca 0.00 -2.00 0.04 0.00 -1.18 0.00 0.00 61.69 58.55 3hiq s THR 244 Cb 0.00 -1.80 0.06 0.00 1.34 0.00 0.00 72.50 72.10 3hiq s THR 244 CO 0.00 -0.78 1.72 0.58 -0.54 0.00 0.00 174.62 175.60 3hiq h VAL 245 N 2.85 1.27 -0.97 2.29 2.07 -1.08 -2.72 116.25 119.95 3hiq h VAL 245 Ca -0.36 -1.33 0.20 0.00 0.82 0.00 0.00 66.70 66.03 3hiq h VAL 245 Cb 1.18 1.46 -0.09 0.00 -1.52 0.00 0.00 31.29 32.32 3hiq h VAL 245 CO 0.64 0.41 0.61 0.00 0.02 0.00 0.00 177.57 179.26 3hiq h ALA 246 N 1.34 1.91 0.00 1.67 0.00 -1.97 -2.41 119.26 119.81 3hiq h ALA 246 Ca 0.04 0.05 -0.06 0.00 0.00 0.00 0.00 54.91 54.95 3hiq h ALA 246 Cb 0.71 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.43 3hiq h ALA 246 CO 0.05 -0.25 -0.28 0.93 0.00 0.00 0.00 179.25 179.70 3hiq h GLU 247 N 0.61 0.00 -0.00 0.00 5.08 -1.87 -2.85 114.58 115.55 3hiq h GLU 247 Ca 0.54 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.90 3hiq h GLU 247 Cb 1.04 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.29 3hiq h GLU 247 CO -0.29 0.28 -0.80 1.33 -1.00 0.00 0.00 179.01 178.53 3hiq n VAL 248 N -3.77 0.00 -3.57 3.13 0.24 -0.91 -5.00 118.33 108.44 3hiq n VAL 248 Ca -0.01 -0.03 -0.25 0.00 -2.04 0.00 0.00 64.34 62.00 3hiq n VAL 248 Cb 0.38 0.82 0.05 0.00 -1.47 0.00 0.00 33.84 33.62 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 -1.31 -2.14 -2.04 7.34 1.02 -1.08 -4.50 120.64 117.93 3hiq n GLU 249 Ca 0.05 0.59 -0.41 0.00 -0.02 0.00 0.00 57.16 57.37 3hiq n GLU 249 Cb 0.35 -4.76 -0.02 0.00 -0.02 0.00 0.00 31.44 26.98 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 -3.49 2.74 -0.14 -3.67 -1.09 -1.26 -1.61 121.20 112.68 3hiq s ILE 250 Ca 0.38 0.62 -0.28 0.00 -2.23 0.00 0.00 60.65 59.14 3hiq s ILE 250 Cb -0.11 -3.39 -0.25 0.00 -1.58 0.00 0.00 42.46 37.13 3hiq s ILE 250 CO 0.82 0.10 0.76 1.23 -1.23 0.00 0.00 174.94 176.62 3hiq h GLY 251 N 5.14 -0.00 -5.06 6.18 0.00 -0.12 -3.39 103.07 105.82 3hiq h GLY 251 Ca -0.46 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 46.79 3hiq h GLY 251 CO 0.78 -0.00 -0.06 -1.50 0.00 0.00 0.00 176.54 175.76 3hiq s ILE 252 N -2.26 0.00 0.25 2.60 2.07 -1.09 -4.28 121.20 118.49 3hiq s ILE 252 Ca -0.18 -0.02 -0.27 0.00 -1.41 0.00 0.00 60.65 58.78 3hiq s ILE 252 Cb -0.03 -0.78 -0.09 0.00 0.13 0.00 0.00 42.46 41.69 3hiq s ILE 252 CO 0.67 -0.01 0.89 -0.36 -1.91 0.00 0.00 174.94 174.21 3hiq s PHE 253 N 0.18 3.83 0.31 3.50 0.08 -0.57 -4.79 117.98 120.51 3hiq s PHE 253 Ca -0.01 1.76 -0.29 0.00 0.12 0.00 0.00 56.93 58.51 3hiq s PHE 253 Cb -0.04 -2.88 -0.13 0.00 -0.57 0.00 0.00 43.02 39.41 3hiq s PHE 253 CO 0.01 0.37 1.32 -0.11 -0.10 0.00 0.00 175.22 176.71 3hiq n LEU 254 N 1.08 3.32 -4.65 -0.37 7.94 -1.26 -1.59 117.00 121.48 3hiq n LEU 254 Ca -0.01 1.18 -0.43 0.00 -1.11 0.00 0.00 56.01 55.64 3hiq n LEU 254 Cb 0.49 -1.46 -0.02 0.00 0.53 0.00 0.00 43.42 42.96 3hiq n LEU 254 CO 0.46 -0.53 0.99 0.21 -1.11 0.00 0.00 177.39 177.41 3hiq s ASN 255 N -0.12 6.96 -0.06 1.96 2.47 -1.26 -4.77 114.94 120.11 3hiq s ASN 255 Ca 0.60 1.28 0.10 0.00 0.42 0.00 0.00 52.86 55.25 3hiq s ASN 255 Cb -0.60 -2.54 0.18 0.00 -1.45 0.00 0.00 41.25 36.84 3hiq s ASN 255 CO 0.58 -0.82 1.12 1.33 -3.72 0.00 0.00 177.10 175.59 3hiq n VAL 256 N 5.65 1.44 0.19 -5.21 0.24 -1.26 -5.06 118.33 114.32 3hiq n VAL 256 Ca 0.13 -1.55 0.02 0.00 -2.04 0.00 0.00 64.34 60.90 3hiq n VAL 256 Cb 0.46 0.16 0.09 0.00 -1.47 0.00 0.00 33.84 33.08 3hiq n VAL 256 CO 0.00 0.00 0.00 0.47 -2.14 0.00 0.00 176.83 175.16