#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uuh s GLN 21 N 0.00 0.08 -0.12 0.00 0.74 -1.26 -1.82 119.66 117.27 1uuh s GLN 21 Ca 0.00 0.26 0.01 0.00 0.05 0.00 0.00 55.36 55.69 1uuh s GLN 21 Cb 0.00 -0.11 0.02 0.00 1.10 0.00 0.00 33.01 34.02 1uuh s GLN 21 CO 0.00 -0.11 -0.16 0.42 -0.55 0.00 0.00 175.29 174.89 1uuh s ILE 22 N 0.77 1.58 -0.17 -2.34 1.01 -0.03 -4.96 121.20 117.05 1uuh s ILE 22 Ca -0.06 -0.67 -0.06 0.00 0.00 0.00 0.00 60.65 59.86 1uuh s ILE 22 Cb -0.08 -1.45 -0.03 0.00 0.01 0.00 0.00 42.46 40.91 1uuh s ILE 22 CO -0.03 0.46 0.01 -1.81 0.00 0.00 0.00 174.94 173.57 1uuh s ASP 23 N 1.13 5.17 -0.19 3.58 1.01 -1.26 -0.74 116.67 125.37 1uuh s ASP 23 Ca -0.03 -0.05 0.00 0.00 0.71 0.00 0.00 52.55 53.18 1uuh s ASP 23 Cb -0.14 -1.87 0.02 0.00 1.01 0.00 0.00 42.92 41.93 1uuh s ASP 23 CO -0.05 0.15 -0.17 -0.76 0.21 0.00 0.00 175.17 174.56 1uuh s LEU 24 N 0.47 2.31 -0.27 1.23 1.43 0.13 0.15 118.68 124.14 1uuh s LEU 24 Ca -0.00 -0.63 -0.13 0.00 -1.03 0.00 0.00 54.13 52.34 1uuh s LEU 24 Cb -0.13 -1.53 -0.04 0.00 0.03 0.00 0.00 46.19 44.51 1uuh s LEU 24 CO 0.02 -0.01 0.26 0.20 0.23 0.00 0.00 176.35 177.05 1uuh s ASN 25 N 1.32 6.13 0.18 2.29 -0.87 -0.11 -0.33 114.94 123.54 1uuh s ASN 25 Ca 0.05 0.13 0.09 0.00 -1.57 0.00 0.00 52.86 51.56 1uuh s ASN 25 Cb -0.13 -2.16 -0.04 0.00 -0.02 0.00 0.00 41.25 38.90 1uuh s ASN 25 CO -0.11 -0.09 -0.13 0.27 -2.57 0.00 0.00 177.10 174.47 1uuh s ILE 26 N 1.81 2.99 0.28 0.60 -4.36 -0.47 -1.36 121.20 120.68 1uuh s ILE 26 Ca 0.10 -1.72 0.02 0.00 -0.26 0.00 0.00 60.65 58.79 1uuh s ILE 26 Cb -0.16 -2.46 -0.03 0.00 1.25 0.00 0.00 42.46 41.06 1uuh s ILE 26 CO 0.10 -0.09 0.45 -0.89 0.24 0.00 0.00 174.94 174.75 1uuh s THR 27 N -1.65 5.18 0.84 8.37 2.01 -0.88 -4.26 115.64 125.25 1uuh s THR 27 Ca 0.23 -0.60 -0.13 0.00 0.31 0.00 0.00 61.69 61.51 1uuh s THR 27 Cb -0.09 -3.83 0.06 0.00 0.01 0.00 0.00 72.50 68.66 1uuh s THR 27 CO 0.14 -0.39 0.89 0.00 -0.69 0.00 0.00 174.62 174.57 1uuh s ARG 29 N -3.85 4.28 -0.30 0.00 3.00 0.06 -4.54 118.95 117.61 1uuh s ARG 29 Ca 0.67 0.71 0.02 0.00 0.00 0.00 0.00 55.73 57.12 1uuh s ARG 29 Cb -0.27 -3.32 0.07 0.00 0.00 0.00 0.00 34.95 31.42 1uuh s ARG 29 CO 0.57 0.42 -0.02 -0.06 0.00 0.00 0.00 175.30 176.20 1uuh s PHE 30 N -0.34 3.40 -1.47 -0.53 0.40 0.83 -0.65 117.98 119.63 1uuh s PHE 30 Ca 0.30 -2.36 -0.03 0.00 -0.60 0.00 0.00 56.93 54.24 1uuh s PHE 30 Cb -0.18 -2.29 0.03 0.00 0.51 0.00 0.00 43.02 41.09 1uuh s PHE 30 CO 0.17 -0.88 0.46 0.00 0.70 0.00 0.00 175.22 175.67 1uuh n ALA 31 N 4.45 -1.88 0.00 5.36 0.00 -0.77 -1.52 120.51 126.16 1uuh n ALA 31 Ca -0.09 -0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.12 1uuh n ALA 31 Cb 0.42 -1.82 0.00 0.00 0.00 0.00 0.00 19.45 18.06 1uuh n ALA 31 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1uuh n GLY 32 N -1.93 3.16 3.75 0.00 0.00 -1.25 -4.81 105.19 104.12 1uuh n GLY 32 Ca -0.24 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.39 1uuh n GLY 32 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1uuh s VAL 33 N -1.84 5.08 0.08 1.61 1.01 -0.58 -0.19 120.40 125.58 1uuh s VAL 33 Ca 0.00 1.03 -0.04 0.00 0.00 0.00 0.00 61.98 62.97 1uuh s VAL 33 Cb 0.00 -3.84 -0.03 0.00 0.00 0.00 0.00 36.38 32.52 1uuh s VAL 33 CO 0.00 0.39 0.06 0.72 0.00 0.00 0.00 175.10 176.28 1uuh s PHE 34 N 0.10 0.47 -0.09 5.22 -0.12 -0.27 -0.12 117.98 123.17 1uuh s PHE 34 Ca 0.27 -0.95 -0.02 0.00 -0.05 0.00 0.00 56.93 56.19 1uuh s PHE 34 Cb -0.16 -0.29 -0.03 0.00 -0.63 0.00 0.00 43.02 41.90 1uuh s PHE 34 CO 0.13 -0.47 -0.01 -1.58 -0.05 0.00 0.00 175.22 173.24 1uuh s HIS 35 N -3.93 3.13 -0.09 3.49 5.65 -1.26 -1.03 115.29 121.25 1uuh s HIS 35 Ca 0.10 0.13 0.02 0.00 0.25 0.00 0.00 55.06 55.55 1uuh s HIS 35 Cb 0.07 -1.81 0.01 0.00 -1.18 0.00 0.00 32.58 29.68 1uuh s HIS 35 CO -0.08 0.40 -0.13 0.08 -0.65 0.00 0.00 174.74 174.35 1uuh s VAL 36 N -0.71 1.30 -0.10 0.89 1.01 -0.13 -2.07 120.40 120.59 1uuh s VAL 36 Ca 0.11 -0.54 0.02 0.00 0.00 0.00 0.00 61.98 61.57 1uuh s VAL 36 Cb -0.12 -1.19 -0.02 0.00 0.00 0.00 0.00 36.38 35.06 1uuh s VAL 36 CO 0.02 0.40 -0.15 -0.70 0.00 0.00 0.00 175.10 174.67 1uuh s GLU 37 N 0.86 3.00 -0.24 2.72 2.12 -0.46 -1.82 118.70 124.89 1uuh s GLU 37 Ca -0.10 -0.72 -0.09 0.00 0.36 0.00 0.00 54.97 54.42 1uuh s GLU 37 Cb -0.15 -2.48 -0.04 0.00 0.26 0.00 0.00 34.13 31.71 1uuh s GLU 37 CO 0.01 0.36 0.12 0.21 -0.54 0.00 0.00 175.26 175.42 1uuh s LYS 38 N -0.05 3.92 -1.72 4.30 2.20 -1.26 -0.93 119.74 126.20 1uuh s LYS 38 Ca -0.04 -0.35 -0.01 0.00 -0.36 0.00 0.00 55.97 55.22 1uuh s LYS 38 Cb -0.14 -3.43 0.00 0.00 -1.51 0.00 0.00 37.83 32.75 1uuh s LYS 38 CO 0.04 0.01 0.07 0.09 -0.36 0.00 0.00 175.35 175.20 1uuh n ASN 39 N 4.40 -5.84 -0.88 1.43 3.02 0.12 -2.81 115.26 114.70 1uuh n ASN 39 Ca -0.15 -0.04 -0.11 0.00 -0.03 0.00 0.00 54.58 54.24 1uuh n ASN 39 Cb 0.52 -4.84 -0.05 0.00 -0.61 0.00 0.00 39.78 34.80 1uuh n ASN 39 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1uuh n GLY 40 N -1.07 1.22 3.83 7.41 0.00 -1.26 -4.94 105.19 110.39 1uuh n GLY 40 Ca -0.23 -0.30 -0.07 0.00 0.00 0.00 0.00 46.02 45.42 1uuh n GLY 40 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1uuh s ARG 41 N -2.85 1.92 -0.32 1.61 1.70 -1.13 -5.11 118.95 114.77 1uuh s ARG 41 Ca 0.00 -1.15 -0.29 0.00 -0.47 0.00 0.00 55.73 53.83 1uuh s ARG 41 Cb 0.00 0.60 -0.02 0.00 -0.57 0.00 0.00 34.95 34.96 1uuh s ARG 41 CO 0.00 -0.89 1.73 0.71 -1.08 0.00 0.00 175.30 175.77 1uuh s TYR 42 N -3.19 1.92 0.00 5.89 4.12 -1.26 -4.19 117.35 120.64 1uuh s TYR 42 Ca 0.13 0.61 0.00 0.00 0.02 0.00 0.00 57.07 57.83 1uuh s TYR 42 Cb -0.05 -4.14 0.00 0.00 -1.52 0.00 0.00 41.96 36.25 1uuh s TYR 42 CO 0.08 -2.85 0.64 -1.13 0.02 0.00 0.00 175.55 172.31 1uuh n SER 43 N 9.84 0.00 -4.37 2.29 3.41 -1.10 -4.69 113.62 118.99 1uuh n SER 43 Ca 0.22 -1.34 -0.33 0.00 -0.26 0.00 0.00 58.87 57.15 1uuh n SER 43 Cb 0.47 -0.07 -0.14 0.00 -0.26 0.00 0.00 64.21 64.21 1uuh n SER 43 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 1uuh s ILE 44 N 0.00 3.13 0.59 -1.33 1.01 0.09 -4.89 121.20 119.79 1uuh s ILE 44 Ca 0.00 -0.63 -0.02 0.00 0.00 0.00 0.00 60.65 60.00 1uuh s ILE 44 Cb 0.00 -2.32 0.04 0.00 0.01 0.00 0.00 42.46 40.18 1uuh s ILE 44 CO 0.00 0.52 0.84 -0.94 0.00 0.00 0.00 174.94 175.36 1uuh s SER 45 N 0.44 5.23 0.30 3.58 1.04 -1.26 -0.83 113.70 122.19 1uuh s SER 45 Ca -0.09 0.21 -0.01 0.00 0.48 0.00 0.00 55.95 56.55 1uuh s SER 45 Cb -0.16 -1.08 0.49 0.00 0.10 0.00 0.00 66.02 65.37 1uuh s SER 45 CO 0.05 -1.22 1.95 -0.09 0.98 0.00 0.00 173.24 174.90 1uuh h ARG 46 N -0.11 1.04 -0.47 4.02 2.43 -1.94 0.10 114.38 119.45 1uuh h ARG 46 Ca -0.43 -0.06 -0.08 0.00 -0.81 0.00 0.00 59.98 58.59 1uuh h ARG 46 Cb 1.29 -0.24 -0.02 0.00 -0.42 0.00 0.00 29.97 30.59 1uuh h ARG 46 CO 0.56 0.69 -0.03 1.79 -1.51 0.00 0.00 179.97 181.47 1uuh h THR 47 N 1.08 1.27 -0.02 0.20 1.35 -2.00 -1.68 112.91 113.11 1uuh h THR 47 Ca 0.34 -1.11 -0.14 0.00 -0.55 0.00 0.00 66.41 64.95 1uuh h THR 47 Cb 0.01 1.03 -0.02 0.00 -1.73 0.00 0.00 68.15 67.45 1uuh h THR 47 CO -0.10 0.39 -0.64 -0.08 -0.25 0.00 0.00 175.52 174.84 1uuh h GLU 48 N 0.71 0.06 -0.05 4.72 4.81 -1.84 -2.17 114.58 120.82 1uuh h GLU 48 Ca 0.13 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.32 1uuh h GLU 48 Cb 0.55 0.01 -0.00 0.00 0.63 0.00 0.00 28.75 29.93 1uuh h GLU 48 CO 0.03 0.68 0.02 0.00 -0.73 0.00 0.00 179.01 179.01 1uuh h ALA 49 N 1.31 0.06 -0.71 2.92 0.00 -0.56 0.16 119.26 122.44 1uuh h ALA 49 Ca -0.01 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1uuh h ALA 49 Cb 1.14 -0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.89 1uuh h ALA 49 CO 0.09 -0.46 0.42 0.00 0.00 0.00 0.00 179.25 179.30 1uuh h ALA 50 N 1.03 0.90 -0.56 0.00 0.00 -1.13 -0.88 119.26 118.63 1uuh h ALA 50 Ca 0.02 -0.09 0.03 0.00 0.00 0.00 0.00 54.91 54.87 1uuh h ALA 50 Cb 0.01 -0.28 -0.04 0.00 0.00 0.00 0.00 17.79 17.48 1uuh h ALA 50 CO -0.02 0.38 0.34 -0.44 0.00 0.00 0.00 179.25 179.51 1uuh h ASP 51 N 0.97 0.55 -0.21 0.00 3.32 -1.17 -2.15 116.42 117.72 1uuh h ASP 51 Ca 0.25 0.00 -0.02 0.00 0.02 0.00 0.00 57.03 57.28 1uuh h ASP 51 Cb -0.01 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 39.41 1uuh h ASP 51 CO -0.05 0.38 0.04 0.25 -1.72 0.00 0.00 179.24 178.14 1uuh h LEU 52 N 0.67 0.33 -0.61 1.55 5.85 0.03 -0.42 115.31 122.71 1uuh h LEU 52 Ca 0.22 -0.25 0.01 0.00 0.84 0.00 0.00 57.88 58.70 1uuh h LEU 52 Cb 0.02 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 40.93 1uuh h LEU 52 CO -0.10 0.50 0.40 0.00 -0.34 0.00 0.00 178.44 178.89 1uuh h LYS 54 N 0.80 1.20 0.00 0.00 3.64 -1.23 0.23 116.57 121.21 1uuh h LYS 54 Ca 0.23 -0.07 -0.01 0.00 -1.27 0.00 0.00 60.65 59.53 1uuh h LYS 54 Cb -0.06 -0.27 -0.00 0.00 -0.41 0.00 0.00 32.23 31.49 1uuh h LYS 54 CO -0.06 0.79 -0.04 0.00 -2.27 0.00 0.00 179.45 177.87 1uuh h ALA 55 N 1.35 1.26 -0.52 5.00 0.00 -0.54 -1.27 119.26 124.54 1uuh h ALA 55 Ca 0.35 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.22 1uuh h ALA 55 Cb -0.11 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.68 1uuh h ALA 55 CO -0.09 0.05 0.00 1.19 0.00 0.00 0.00 179.25 180.41 1uuh n PHE 56 N -3.52 1.46 -4.02 0.00 3.01 -0.24 -0.74 117.46 113.41 1uuh n PHE 56 Ca -0.02 -0.54 -0.32 0.00 1.01 0.00 0.00 57.45 57.58 1uuh n PHE 56 Cb 0.15 -0.31 0.01 0.00 -0.01 0.00 0.00 39.48 39.32 1uuh n PHE 56 CO 0.00 0.00 0.00 0.09 1.01 0.00 0.00 176.76 177.86 1uuh n ASN 57 N 0.76 -4.01 -3.84 4.37 3.02 -0.48 -4.95 115.26 110.12 1uuh n ASN 57 Ca 0.22 -0.87 -0.20 0.00 -0.03 0.00 0.00 54.58 53.70 1uuh n ASN 57 Cb 0.88 -3.47 -0.09 0.00 -0.61 0.00 0.00 39.78 36.49 1uuh n ASN 57 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 1uuh s SER 58 N -3.38 1.82 0.22 6.41 0.01 0.66 -4.69 113.70 114.75 1uuh s SER 58 Ca 0.64 -1.64 0.03 0.00 1.31 0.00 0.00 55.95 56.30 1uuh s SER 58 Cb -0.33 0.46 -0.05 0.00 0.21 0.00 0.00 66.02 66.31 1uuh s SER 58 CO 0.87 -0.95 -0.01 0.42 0.41 0.00 0.00 173.24 173.98 1uuh s THR 59 N -3.49 1.01 0.06 1.44 -4.23 -0.04 -3.07 115.64 107.32 1uuh s THR 59 Ca 0.34 -2.03 -0.31 0.00 -1.18 0.00 0.00 61.69 58.52 1uuh s THR 59 Cb 0.04 -2.31 -0.07 0.00 1.34 0.00 0.00 72.50 71.50 1uuh s THR 59 CO 0.20 -0.35 1.46 -0.76 -0.54 0.00 0.00 174.62 174.62 1uuh s LEU 60 N -3.29 4.35 0.63 4.79 1.43 -1.26 0.54 118.68 125.87 1uuh s LEU 60 Ca 0.28 2.29 -0.18 0.00 -1.03 0.00 0.00 54.13 55.49 1uuh s LEU 60 Cb 0.06 -3.57 -0.02 0.00 0.03 0.00 0.00 46.19 42.69 1uuh s LEU 60 CO 0.08 -0.74 1.23 -2.84 0.23 0.00 0.00 176.35 174.31 1uuh s PRO 61 N 1.97 2.71 0.00 1.29 0.02 -1.26 -4.22 135.00 135.51 1uuh s PRO 61 Ca 0.67 1.88 0.00 0.00 0.02 0.00 0.00 61.00 63.56 1uuh s PRO 61 Cb -0.36 -1.89 0.00 0.00 0.02 0.00 0.00 34.50 32.28 1uuh s PRO 61 CO 0.29 -1.43 0.00 0.25 -0.33 0.00 0.00 177.00 175.78 1uuh n THR 62 N -1.89 0.00 0.00 0.99 -2.24 -1.26 -0.55 114.28 109.34 1uuh n THR 62 Ca 0.14 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.92 1uuh n THR 62 Cb 0.49 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.72 1uuh n THR 62 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1uuh n ALA 64 N -3.00 0.00 0.22 6.98 0.00 -1.26 -4.70 120.51 118.74 1uuh n ALA 64 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1uuh n ALA 64 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1uuh n ALA 64 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1uuh n GLN 65 N 0.00 0.22 0.00 0.00 6.02 -1.26 -2.21 117.38 120.14 1uuh n GLN 65 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 1uuh n GLN 65 Cb 0.00 -1.32 0.00 0.00 1.02 0.00 0.00 30.24 29.94 1uuh n GLN 65 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 1uuh n GLU 67 N 0.76 0.00 -0.15 -1.09 -0.58 -1.26 -2.21 120.64 116.12 1uuh n GLU 67 Ca 0.00 0.00 -0.10 0.00 -0.42 0.00 0.00 57.16 56.64 1uuh n GLU 67 Cb 0.09 0.00 -0.01 0.00 -0.57 0.00 0.00 31.44 30.96 1uuh n GLU 67 CO 0.00 0.00 0.00 -0.22 -0.48 0.00 0.00 177.13 176.43 1uuh h LYS 68 N 0.00 0.76 -0.35 3.49 3.64 -1.85 -2.61 116.57 119.66 1uuh h LYS 68 Ca 0.00 -0.25 -0.02 0.00 -1.27 0.00 0.00 60.65 59.11 1uuh h LYS 68 Cb 0.00 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 31.74 1uuh h LYS 68 CO 0.00 0.84 0.14 0.00 -2.27 0.00 0.00 179.45 178.16 1uuh h ALA 69 N 0.89 0.46 -0.91 5.00 0.00 -1.63 -2.85 119.26 120.22 1uuh h ALA 69 Ca 0.12 -0.13 0.20 0.00 0.00 0.00 0.00 54.91 55.10 1uuh h ALA 69 Cb 0.51 -0.14 -0.11 0.00 0.00 0.00 0.00 17.79 18.04 1uuh h ALA 69 CO 0.02 0.06 0.45 1.25 0.00 0.00 0.00 179.25 181.04 1uuh h LEU 70 N 0.42 0.47 -0.88 0.00 7.12 -1.70 -1.48 115.31 119.26 1uuh h LEU 70 Ca 0.12 0.13 0.00 0.00 0.13 0.00 0.00 57.88 58.26 1uuh h LEU 70 Cb 0.19 0.07 0.00 0.00 -0.53 0.00 0.00 40.66 40.38 1uuh h LEU 70 CO -0.01 0.10 0.00 -1.54 -0.13 0.00 0.00 178.44 176.86 1uuh n SER 71 N -4.95 0.66 -0.69 1.25 3.41 -0.99 -1.45 113.62 110.86 1uuh n SER 71 Ca 0.21 0.69 0.04 0.00 -0.26 0.00 0.00 58.87 59.56 1uuh n SER 71 Cb 0.60 -0.82 0.20 0.00 -0.26 0.00 0.00 64.21 63.93 1uuh n SER 71 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 1uuh n ILE 72 N -2.26 2.25 -0.01 -1.33 -5.35 -0.58 -4.98 119.36 107.11 1uuh n ILE 72 Ca 0.01 -2.64 0.00 0.00 -0.27 0.00 0.00 62.75 59.86 1uuh n ILE 72 Cb 0.19 -0.27 0.00 0.00 -1.74 0.00 0.00 39.64 37.82 1uuh n ILE 72 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1uuh n GLY 73 N -1.10 1.00 3.59 3.28 0.00 -0.53 -4.92 105.19 106.50 1uuh n GLY 73 Ca 0.23 -0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.82 1uuh n GLY 73 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1uuh s PHE 74 N -2.00 2.95 0.02 1.61 5.36 -1.06 -5.00 117.98 119.87 1uuh s PHE 74 Ca 0.00 0.61 -0.10 0.00 -0.96 0.00 0.00 56.93 56.48 1uuh s PHE 74 Cb 0.00 -3.97 0.01 0.00 -0.34 0.00 0.00 43.02 38.72 1uuh s PHE 74 CO 0.00 -1.04 0.19 -1.83 -1.46 0.00 0.00 175.22 171.08 1uuh s GLU 75 N 3.82 0.62 0.30 10.12 -1.05 -1.26 -4.17 118.70 127.08 1uuh s GLU 75 Ca 0.40 -0.49 0.04 0.00 -0.15 0.00 0.00 54.97 54.78 1uuh s GLU 75 Cb -0.10 0.26 -0.03 0.00 -0.44 0.00 0.00 34.13 33.82 1uuh s GLU 75 CO 0.25 -0.17 0.20 0.99 0.95 0.00 0.00 175.26 177.48 1uuh s THR 76 N -1.98 0.14 -0.18 1.83 2.01 -0.89 -5.02 115.64 111.55 1uuh s THR 76 Ca -0.10 -2.00 0.13 0.00 0.31 0.00 0.00 61.69 60.03 1uuh s THR 76 Cb -0.04 -2.49 0.41 0.00 0.01 0.00 0.00 72.50 70.39 1uuh s THR 76 CO -0.01 0.00 1.21 0.00 -0.69 0.00 0.00 174.62 175.13 1uuh s ARG 78 N -2.85 1.21 0.29 0.00 0.52 -1.26 -4.92 118.95 111.94 1uuh s ARG 78 Ca 0.37 -0.26 -0.30 0.00 -0.52 0.00 0.00 55.73 55.02 1uuh s ARG 78 Cb 0.37 -1.08 -0.11 0.00 0.52 0.00 0.00 34.95 34.65 1uuh s ARG 78 CO -0.08 -0.01 1.47 0.71 0.02 0.00 0.00 175.30 177.42 1uuh s TYR 79 N 0.70 2.89 -0.09 -0.53 1.51 -1.26 -4.56 117.35 116.02 1uuh s TYR 79 Ca -0.12 1.03 -0.15 0.00 -1.01 0.00 0.00 57.07 56.82 1uuh s TYR 79 Cb -0.14 -3.90 0.03 0.00 -0.11 0.00 0.00 41.96 37.84 1uuh s TYR 79 CO 0.02 -2.86 0.37 0.20 -1.11 0.00 0.00 175.55 172.17 1uuh s GLY 80 N 0.22 -0.25 0.35 0.71 0.00 -0.23 -1.48 107.32 106.64 1uuh s GLY 80 Ca 0.58 0.80 -0.28 0.00 0.00 0.00 0.00 44.72 45.82 1uuh s GLY 80 CO 0.48 0.62 1.40 -1.36 0.00 0.00 0.00 173.10 174.25 1uuh s PHE 81 N -0.47 2.82 0.11 1.90 0.40 -0.93 -1.09 117.98 120.72 1uuh s PHE 81 Ca -0.06 1.26 0.00 0.00 -0.60 0.00 0.00 56.93 57.54 1uuh s PHE 81 Cb -0.04 -3.86 -0.00 0.00 0.51 0.00 0.00 43.02 39.63 1uuh s PHE 81 CO 0.02 -2.47 0.02 0.44 0.70 0.00 0.00 175.22 173.93 1uuh n ILE 82 N 0.75 0.00 -1.79 0.64 -5.35 -0.26 -1.66 119.36 111.70 1uuh n ILE 82 Ca 0.01 -0.57 -0.42 0.00 -0.27 0.00 0.00 62.75 61.50 1uuh n ILE 82 Cb 0.40 0.16 -0.03 0.00 -1.74 0.00 0.00 39.64 38.43 1uuh n ILE 82 CO 0.00 0.00 0.00 -0.70 -1.76 0.00 0.00 176.55 174.09 1uuh s GLU 83 N -2.40 3.93 0.00 6.28 2.12 0.29 -3.18 118.70 125.74 1uuh s GLU 83 Ca 0.02 2.30 0.00 0.00 0.36 0.00 0.00 54.97 57.66 1uuh s GLU 83 Cb 0.00 -4.15 0.00 0.00 0.26 0.00 0.00 34.13 30.25 1uuh s GLU 83 CO 0.02 -1.17 0.00 0.41 -0.54 0.00 0.00 175.26 173.98 1uuh n GLY 84 N 4.68 0.34 3.44 -1.50 0.00 -1.26 -4.90 105.19 105.98 1uuh n GLY 84 Ca 0.21 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.09 1uuh n GLY 84 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1uuh s HIS 85 N -1.94 0.99 -0.08 1.61 3.76 -1.19 -5.15 115.29 113.30 1uuh s HIS 85 Ca 0.00 -1.22 0.01 0.00 -0.15 0.00 0.00 55.06 53.70 1uuh s HIS 85 Cb 0.00 -0.17 0.02 0.00 1.11 0.00 0.00 32.58 33.54 1uuh s HIS 85 CO 0.00 -0.99 -0.10 0.08 -0.85 0.00 0.00 174.74 172.88 1uuh s VAL 86 N -3.50 1.04 0.16 -0.90 1.01 -1.26 -1.10 120.40 115.85 1uuh s VAL 86 Ca 0.31 -0.39 -0.01 0.00 0.00 0.00 0.00 61.98 61.90 1uuh s VAL 86 Cb 0.01 -0.99 -0.04 0.00 0.00 0.00 0.00 36.38 35.36 1uuh s VAL 86 CO 0.17 0.35 0.09 0.68 0.00 0.00 0.00 175.10 176.38 1uuh s VAL 87 N 1.00 0.07 -0.08 2.92 -7.23 -0.25 -1.12 120.40 115.71 1uuh s VAL 87 Ca -0.08 -1.95 0.00 0.00 -1.81 0.00 0.00 61.98 58.14 1uuh s VAL 87 Cb -0.15 -2.23 0.02 0.00 0.56 0.00 0.00 36.38 34.59 1uuh s VAL 87 CO -0.00 -0.28 -0.06 -0.63 -0.31 0.00 0.00 175.10 173.82 1uuh s ILE 88 N -4.09 0.76 0.01 -0.62 1.01 -0.71 -1.07 121.20 116.49 1uuh s ILE 88 Ca 0.30 -0.17 -0.29 0.00 0.00 0.00 0.00 60.65 60.49 1uuh s ILE 88 Cb 0.07 -0.80 -0.03 0.00 0.01 0.00 0.00 42.46 41.71 1uuh s ILE 88 CO 0.06 0.31 0.94 -2.16 0.00 0.00 0.00 174.94 174.09 1uuh s PRO 89 N 1.45 4.56 -0.07 2.79 0.04 -1.26 -1.45 135.00 141.06 1uuh s PRO 89 Ca -0.01 1.35 0.00 0.00 0.04 0.00 0.00 61.00 62.38 1uuh s PRO 89 Cb -0.13 -3.45 0.02 0.00 0.04 0.00 0.00 34.50 30.98 1uuh s PRO 89 CO -0.04 -0.00 -0.06 1.03 0.04 0.00 0.00 177.00 177.97 1uuh s ARG 90 N 0.85 1.17 -0.24 4.56 1.81 0.77 -2.10 118.95 125.78 1uuh s ARG 90 Ca 0.50 -0.17 -0.05 0.00 -1.72 0.00 0.00 55.73 54.29 1uuh s ARG 90 Cb -0.21 -1.21 -0.17 0.00 -0.45 0.00 0.00 34.95 32.91 1uuh s ARG 90 CO 0.27 -0.16 -0.15 -0.89 -0.68 0.00 0.00 175.30 173.69 1uuh n ILE 91 N 4.49 1.54 -4.61 1.52 5.41 -1.26 0.11 119.36 126.57 1uuh n ILE 91 Ca -0.17 -0.50 -0.33 0.00 1.00 0.00 0.00 62.75 62.74 1uuh n ILE 91 Cb 0.51 -1.62 -0.13 0.00 -0.71 0.00 0.00 39.64 37.69 1uuh n ILE 91 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 176.55 175.55 1uuh s HIS 92 N -2.51 2.91 0.17 1.39 3.76 -1.26 -4.85 115.29 114.89 1uuh s HIS 92 Ca -0.34 -0.42 -0.32 0.00 -0.15 0.00 0.00 55.06 53.84 1uuh s HIS 92 Cb 0.10 -1.87 -0.11 0.00 1.11 0.00 0.00 32.58 31.81 1uuh s HIS 92 CO 0.60 -0.07 1.65 -2.14 -0.85 0.00 0.00 174.74 173.92 1uuh s PRO 93 N 0.20 4.18 -0.03 8.40 0.02 -1.26 -4.94 135.00 141.57 1uuh s PRO 93 Ca -0.05 2.46 0.01 0.00 0.02 0.00 0.00 61.00 63.44 1uuh s PRO 93 Cb -0.15 -3.19 0.01 0.00 0.02 0.00 0.00 34.50 31.19 1uuh s PRO 93 CO 0.04 -0.68 -0.06 1.21 -0.33 0.00 0.00 177.00 177.18 1uuh s ASN 94 N 1.37 0.94 0.60 2.53 3.84 -1.26 -5.04 114.94 117.92 1uuh s ASN 94 Ca 0.73 -0.14 0.37 0.00 0.21 0.00 0.00 52.86 54.03 1uuh s ASN 94 Cb -0.46 -0.37 1.83 0.00 -0.55 0.00 0.00 41.25 41.70 1uuh s ASN 94 CO 0.32 -0.01 2.16 0.77 -2.79 0.00 0.00 177.10 177.55 1uuh h SER 95 N 6.81 0.00 0.57 -4.21 4.64 -1.93 -0.51 113.55 118.92 1uuh h SER 95 Ca -0.36 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.96 1uuh h SER 95 Cb 1.16 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.25 1uuh h SER 95 CO 0.48 0.02 -0.10 -0.38 -0.87 0.00 0.00 176.83 175.98 1uuh n ILE 96 N -3.17 0.00 -4.25 0.95 2.08 -1.26 -4.22 119.36 109.49 1uuh n ILE 96 Ca -0.01 -0.02 -0.27 0.00 0.56 0.00 0.00 62.75 63.01 1uuh n ILE 96 Cb 0.20 -0.25 -0.17 0.00 -0.75 0.00 0.00 39.64 38.68 1uuh n ILE 96 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1uuh n ALA 98 N 4.41 -1.34 -2.48 0.00 0.00 -1.26 -1.24 120.51 118.59 1uuh n ALA 98 Ca -0.18 0.08 -0.21 0.00 0.00 0.00 0.00 53.44 53.13 1uuh n ALA 98 Cb 0.51 -3.83 -0.00 0.00 0.00 0.00 0.00 19.45 16.13 1uuh n ALA 98 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1uuh n ALA 99 N -4.54 -0.65 -0.94 0.00 0.00 -1.26 -0.83 120.51 112.28 1uuh n ALA 99 Ca 0.02 0.18 0.00 0.00 0.00 0.00 0.00 53.44 53.64 1uuh n ALA 99 Cb 0.53 -2.41 0.00 0.00 0.00 0.00 0.00 19.45 17.56 1uuh n ALA 99 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1uuh n ASN 100 N -1.97 -3.03 -4.83 0.00 4.05 -0.37 -4.98 115.26 104.13 1uuh n ASN 100 Ca -0.22 0.00 -0.30 0.00 0.45 0.00 0.00 54.58 54.51 1uuh n ASN 100 Cb 0.67 -1.51 0.07 0.00 1.23 0.00 0.00 39.78 40.24 1uuh n ASN 100 CO 0.00 0.00 0.00 0.20 -3.05 0.00 0.00 177.26 174.41 1uuh s ASN 101 N -2.17 4.96 0.21 1.20 0.01 -0.01 -4.46 114.94 114.67 1uuh s ASN 101 Ca 0.00 1.34 0.10 0.00 -0.71 0.00 0.00 52.86 53.59 1uuh s ASN 101 Cb 0.00 -2.13 -0.05 0.00 0.41 0.00 0.00 41.25 39.48 1uuh s ASN 101 CO 0.00 -1.68 -0.19 0.28 -1.51 0.00 0.00 177.10 174.00 1uuh s THR 102 N -3.18 2.10 0.00 1.60 -1.32 -1.26 -4.56 115.64 109.02 1uuh s THR 102 Ca 0.59 -2.13 0.00 0.00 -1.21 0.00 0.00 61.69 58.95 1uuh s THR 102 Cb -0.13 -2.06 0.00 0.00 -1.51 0.00 0.00 72.50 68.79 1uuh s THR 102 CO 0.54 -0.34 0.00 0.61 -2.21 0.00 0.00 174.62 173.22 1uuh n GLY 103 N -0.07 -1.82 3.40 6.08 0.00 0.12 -4.72 105.19 108.17 1uuh n GLY 103 Ca -0.10 -1.87 -0.45 0.00 0.00 0.00 0.00 46.02 43.60 1uuh n GLY 103 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1uuh s VAL 104 N 0.00 5.07 -0.11 1.61 1.01 -1.26 -0.16 120.40 126.56 1uuh s VAL 104 Ca 0.00 -1.86 -0.30 0.00 0.00 0.00 0.00 61.98 59.83 1uuh s VAL 104 Cb 0.00 -4.63 -0.02 0.00 0.00 0.00 0.00 36.38 31.73 1uuh s VAL 104 CO 0.00 -1.29 1.14 -0.47 0.00 0.00 0.00 175.10 174.48 1uuh s TYR 105 N 1.73 3.22 -0.27 5.22 5.04 -0.53 -4.90 117.35 126.87 1uuh s TYR 105 Ca 0.25 1.30 -0.13 0.00 -2.44 0.00 0.00 57.07 56.05 1uuh s TYR 105 Cb -0.09 -3.36 -0.04 0.00 0.35 0.00 0.00 41.96 38.82 1uuh s TYR 105 CO -0.08 -1.01 0.27 0.42 -1.34 0.00 0.00 175.55 173.82 1uuh s ILE 106 N 2.57 5.25 0.18 3.14 1.01 -1.26 -1.75 121.20 130.34 1uuh s ILE 106 Ca 0.52 0.35 -0.30 0.00 0.00 0.00 0.00 60.65 61.23 1uuh s ILE 106 Cb -0.21 -3.61 -0.08 0.00 0.01 0.00 0.00 42.46 38.58 1uuh s ILE 106 CO 0.17 0.21 0.99 -0.22 0.00 0.00 0.00 174.94 176.09 1uuh s LEU 107 N 1.87 4.56 -0.02 2.97 2.96 -0.27 -4.99 118.68 125.75 1uuh s LEU 107 Ca 0.11 1.95 -0.16 0.00 -0.22 0.00 0.00 54.13 55.80 1uuh s LEU 107 Cb -0.16 -3.60 -0.09 0.00 0.50 0.00 0.00 46.19 42.84 1uuh s LEU 107 CO 0.10 -0.02 0.75 0.74 -1.32 0.00 0.00 176.35 176.60 1uuh h THR 108 N 3.58 0.00 -2.36 3.68 2.02 -1.97 -3.42 112.91 114.44 1uuh h THR 108 Ca -0.44 -0.42 -0.72 0.00 0.77 0.00 0.00 66.41 65.60 1uuh h THR 108 Cb 1.21 0.00 -0.18 0.00 -1.74 0.00 0.00 68.15 67.43 1uuh h THR 108 CO 0.70 0.00 1.09 -0.94 0.37 0.00 0.00 175.52 176.74 1uuh s SER 109 N -4.40 6.91 -0.24 4.18 1.04 -1.26 -4.86 113.70 115.07 1uuh s SER 109 Ca -0.09 -2.67 0.11 0.00 0.48 0.00 0.00 55.95 53.79 1uuh s SER 109 Cb 0.01 -2.39 0.46 0.00 0.10 0.00 0.00 66.02 64.20 1uuh s SER 109 CO 0.26 -0.84 1.35 -0.46 0.98 0.00 0.00 173.24 174.53 1uuh n ASN 110 N 5.81 2.36 0.25 7.02 0.23 -1.26 -4.42 115.26 125.24 1uuh n ASN 110 Ca 0.31 -3.67 0.14 0.00 -0.53 0.00 0.00 54.58 50.82 1uuh n ASN 110 Cb 0.45 -0.57 0.56 0.00 -2.08 0.00 0.00 39.78 38.14 1uuh n ASN 110 CO 0.00 0.00 0.00 0.74 -0.93 0.00 0.00 177.26 177.07 1uuh h THR 111 N 0.97 0.27 -3.76 5.53 2.02 -2.00 -3.46 112.91 112.48 1uuh h THR 111 Ca 0.11 -0.81 -0.43 0.00 0.77 0.00 0.00 66.41 66.04 1uuh h THR 111 Cb 1.36 1.65 0.18 0.00 -1.74 0.00 0.00 68.15 69.60 1uuh h THR 111 CO 0.21 0.10 0.29 -0.55 0.37 0.00 0.00 175.52 175.95 1uuh s SER 112 N -5.96 2.02 0.11 4.18 0.15 -1.26 -5.05 113.70 107.90 1uuh s SER 112 Ca 0.01 0.39 -0.04 0.00 0.70 0.00 0.00 55.95 57.01 1uuh s SER 112 Cb 0.09 -0.49 -0.05 0.00 -1.71 0.00 0.00 66.02 63.86 1uuh s SER 112 CO 0.59 -3.42 0.33 -1.10 1.20 0.00 0.00 173.24 170.84 1uuh s GLN 113 N -5.70 3.58 0.00 5.44 -0.21 -1.26 -4.89 119.66 116.61 1uuh s GLN 113 Ca 0.73 -0.16 0.00 0.00 0.02 0.00 0.00 55.36 55.96 1uuh s GLN 113 Cb -0.06 -2.92 0.00 0.00 1.00 0.00 0.00 33.01 31.03 1uuh s GLN 113 CO 0.54 0.52 0.00 0.66 -2.12 0.00 0.00 175.29 174.89 1uuh n TYR 114 N 0.26 -0.01 -2.08 0.91 4.02 -0.01 -4.62 117.16 115.63 1uuh n TYR 114 Ca -0.04 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.85 1uuh n TYR 114 Cb 0.52 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.84 1uuh n TYR 114 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 176.86 175.60 1uuh n ASP 115 N -0.17 0.00 -4.15 7.72 8.00 -0.55 -0.73 116.55 126.67 1uuh n ASP 115 Ca 0.00 -0.90 -0.10 0.00 0.71 0.00 0.00 54.79 54.50 1uuh n ASP 115 Cb 0.00 0.00 -0.10 0.00 -0.02 0.00 0.00 41.12 41.00 1uuh n ASP 115 CO 0.00 0.00 0.00 0.28 -0.39 0.00 0.00 177.20 177.09 1uuh s THR 116 N 0.28 0.61 0.17 -3.53 -1.32 -0.75 -2.20 115.64 108.90 1uuh s THR 116 Ca 0.00 -1.84 0.07 0.00 -1.21 0.00 0.00 61.69 58.71 1uuh s THR 116 Cb 0.00 -1.56 -0.04 0.00 -1.51 0.00 0.00 72.50 69.39 1uuh s THR 116 CO 0.00 -0.85 0.02 -0.31 -2.21 0.00 0.00 174.62 171.28 1uuh s TYR 117 N -3.45 2.90 0.03 9.09 1.51 -0.66 -0.95 117.35 125.81 1uuh s TYR 117 Ca 0.09 -0.11 0.00 0.00 -1.01 0.00 0.00 57.07 56.04 1uuh s TYR 117 Cb 0.04 -1.40 -0.02 0.00 -0.11 0.00 0.00 41.96 40.47 1uuh s TYR 117 CO -0.05 0.52 -0.04 0.00 -1.11 0.00 0.00 175.55 174.87 1uuh s PHE 119 N -1.74 2.41 -0.31 0.00 5.36 0.19 -1.11 117.98 122.78 1uuh s PHE 119 Ca -0.13 -1.27 -0.10 0.00 -0.96 0.00 0.00 56.93 54.48 1uuh s PHE 119 Cb -0.08 -1.69 -0.01 0.00 -0.34 0.00 0.00 43.02 40.90 1uuh s PHE 119 CO -0.02 -0.63 0.15 1.21 -1.46 0.00 0.00 175.22 174.47 1uuh s ASN 120 N 1.09 5.54 0.60 6.13 3.84 0.74 -0.86 114.94 132.02 1uuh s ASN 120 Ca -0.02 -0.50 0.38 0.00 0.21 0.00 0.00 52.86 52.93 1uuh s ASN 120 Cb -0.14 -2.00 1.85 0.00 -0.55 0.00 0.00 41.25 40.41 1uuh s ASN 120 CO -0.06 -0.18 2.16 0.00 -2.79 0.00 0.00 177.10 176.23 1uuh h ALA 121 N 8.35 1.02 -0.01 1.71 0.00 -1.87 -2.87 119.26 125.58 1uuh h ALA 121 Ca -0.32 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1uuh h ALA 121 Cb 1.15 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1uuh h ALA 121 CO 0.61 0.01 -0.30 0.43 0.00 0.00 0.00 179.25 180.00 1uuh n SER 122 N -3.12 1.53 -4.80 0.00 7.64 -1.26 -4.94 113.62 108.67 1uuh n SER 122 Ca -0.01 -1.22 -0.33 0.00 1.01 0.00 0.00 58.87 58.31 1uuh n SER 122 Cb 0.20 0.24 0.01 0.00 -1.01 0.00 0.00 64.21 63.65 1uuh n SER 122 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1uuh s ALA 123 N -2.42 2.69 0.67 -0.43 0.00 -1.09 -5.04 121.76 116.15 1uuh s ALA 123 Ca 0.24 0.45 -0.16 0.00 0.00 0.00 0.00 51.96 52.49 1uuh s ALA 123 Cb 0.19 -3.25 0.01 0.00 0.00 0.00 0.00 23.12 20.06 1uuh s ALA 123 CO 0.51 -0.87 1.17 -2.14 0.00 0.00 0.00 175.76 174.43 1uuh s PRO 124 N -4.00 2.56 -0.00 0.00 0.02 -1.26 -4.63 135.00 127.69 1uuh s PRO 124 Ca 0.65 1.64 0.00 0.00 0.02 0.00 0.00 61.00 63.31 1uuh s PRO 124 Cb -0.17 -1.90 0.01 0.00 0.02 0.00 0.00 34.50 32.46 1uuh s PRO 124 CO 0.36 -1.48 1.03 -0.35 -0.33 0.00 0.00 177.00 176.23 1uuh n PRO 125 N -2.35 1.01 -1.82 5.54 -0.04 -1.26 -3.76 135.00 132.32 1uuh n PRO 125 Ca 0.12 -0.03 0.00 0.00 -0.04 0.00 0.00 63.50 63.55 1uuh n PRO 125 Cb 0.51 -1.01 0.00 0.00 -0.04 0.00 0.00 33.50 32.95 1uuh n PRO 125 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1uuh n GLU 126 N 0.50 0.61 -2.90 0.54 4.71 -1.26 -4.56 120.64 118.28 1uuh n GLU 126 Ca 0.01 0.00 -0.41 0.00 -0.01 0.00 0.00 57.16 56.75 1uuh n GLU 126 Cb 0.51 0.00 -0.04 0.00 -1.01 0.00 0.00 31.44 30.90 1uuh n GLU 126 CO 0.00 0.00 0.00 -2.00 0.09 0.00 0.00 177.13 175.22 1uuh s GLU 127 N -1.73 4.50 -0.20 3.49 2.12 -1.25 -1.85 118.70 123.77 1uuh s GLU 127 Ca 0.00 1.12 -0.01 0.00 0.36 0.00 0.00 54.97 56.44 1uuh s GLU 127 Cb 0.00 -3.43 0.06 0.00 0.26 0.00 0.00 34.13 31.01 1uuh s GLU 127 CO 0.00 0.07 -0.01 0.34 -0.54 0.00 0.00 175.26 175.12 1uuh s ASP 128 N 0.68 3.24 -0.02 -1.70 2.15 0.18 -4.97 116.67 116.24 1uuh s ASP 128 Ca 0.43 -0.93 0.20 0.00 0.43 0.00 0.00 52.55 52.68 1uuh s ASP 128 Cb -0.20 -0.86 0.59 0.00 -0.30 0.00 0.00 42.92 42.15 1uuh s ASP 128 CO 0.23 -0.26 1.49 0.00 -0.17 0.00 0.00 175.17 176.46 1uuh n THR 130 N 1.34 0.05 -1.88 0.00 -1.04 -1.26 -4.84 114.28 106.64 1uuh n THR 130 Ca 0.22 -0.01 -0.42 0.00 -2.04 0.00 0.00 64.05 61.81 1uuh n THR 130 Cb 0.62 -0.59 -0.02 0.00 -1.82 0.00 0.00 70.33 68.52 1uuh n THR 130 CO 0.00 0.00 0.00 -0.44 -0.64 0.00 0.00 175.07 173.99 1uuh s SER 131 N 1.07 6.51 -0.32 8.00 0.01 -1.26 -4.97 113.70 122.74 1uuh s SER 131 Ca 0.91 2.78 -0.16 0.00 1.31 0.00 0.00 55.95 60.78 1uuh s SER 131 Cb -1.13 -2.62 -0.02 0.00 0.21 0.00 0.00 66.02 62.47 1uuh s SER 131 CO 0.57 -0.83 0.44 -0.69 0.41 0.00 0.00 173.24 173.13 1uuh s VAL 132 N 0.36 5.10 -0.40 3.43 1.01 -1.26 -4.96 120.40 123.69 1uuh s VAL 132 Ca 0.65 0.35 0.23 0.00 0.00 0.00 0.00 61.98 63.20 1uuh s VAL 132 Cb -0.45 -3.85 0.28 0.00 0.00 0.00 0.00 36.38 32.35 1uuh s VAL 132 CO 0.41 -0.07 1.51 0.74 0.00 0.00 0.00 175.10 177.69 1uuh h THR 133 N 5.52 0.02 -2.23 3.92 2.02 -1.97 -3.46 112.91 116.73 1uuh h THR 133 Ca -0.29 -1.03 0.23 0.00 0.77 0.00 0.00 66.41 66.09 1uuh h THR 133 Cb 1.14 1.92 -0.06 0.00 -1.74 0.00 0.00 68.15 69.41 1uuh h THR 133 CO 0.71 0.01 0.69 1.51 0.37 0.00 0.00 175.52 178.81 1uuh s ASP 134 N -6.07 -0.03 -0.61 4.18 1.47 -1.26 -4.73 116.67 109.61 1uuh s ASP 134 Ca 0.06 -0.44 -0.23 0.00 1.18 0.00 0.00 52.55 53.12 1uuh s ASP 134 Cb 0.06 0.36 0.06 0.00 -0.34 0.00 0.00 42.92 43.06 1uuh s ASP 134 CO 0.69 -0.70 0.94 -0.22 0.68 0.00 0.00 175.17 176.57 1uuh s LEU 135 N -3.37 4.29 0.20 2.11 2.96 -1.26 -4.93 118.68 118.68 1uuh s LEU 135 Ca 0.21 -0.75 0.25 0.00 -0.22 0.00 0.00 54.13 53.62 1uuh s LEU 135 Cb -0.01 -2.57 0.90 0.00 0.50 0.00 0.00 46.19 45.02 1uuh s LEU 135 CO 0.02 -1.34 1.74 -0.81 -1.32 0.00 0.00 176.35 174.64 1uuh n PRO 136 N 7.57 0.20 -1.06 0.98 -0.04 -1.19 -3.01 135.00 138.45 1uuh n PRO 136 Ca -0.02 0.28 0.05 0.00 -0.04 0.00 0.00 63.50 63.77 1uuh n PRO 136 Cb 0.46 -1.79 0.12 0.00 -0.04 0.00 0.00 33.50 32.25 1uuh n PRO 136 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1uuh n ASN 137 N -2.14 1.41 -4.66 3.54 4.05 0.08 -5.00 115.26 112.55 1uuh n ASN 137 Ca 0.04 -2.99 -0.29 0.00 0.45 0.00 0.00 54.58 51.79 1uuh n ASN 137 Cb 0.33 -0.42 0.15 0.00 1.23 0.00 0.00 39.78 41.07 1uuh n ASN 137 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1uuh s ALA 138 N -1.72 1.68 0.46 5.20 0.00 -1.16 -4.42 121.76 121.79 1uuh s ALA 138 Ca 0.36 -0.60 0.06 0.00 0.00 0.00 0.00 51.96 51.77 1uuh s ALA 138 Cb 0.38 -3.00 -0.03 0.00 0.00 0.00 0.00 23.12 20.47 1uuh s ALA 138 CO -0.12 -2.42 0.19 -0.59 0.00 0.00 0.00 175.76 172.82 1uuh s PHE 139 N -3.29 2.26 0.44 0.00 -0.12 -0.11 -4.96 117.98 112.19 1uuh s PHE 139 Ca 0.65 -0.71 -0.25 0.00 -0.05 0.00 0.00 56.93 56.57 1uuh s PHE 139 Cb -0.14 -1.88 -0.08 0.00 -0.63 0.00 0.00 43.02 40.30 1uuh s PHE 139 CO 0.54 0.07 1.28 -0.51 -0.05 0.00 0.00 175.22 176.54 1uuh s ASP 140 N -3.97 6.12 -0.02 1.98 1.01 -1.26 -0.68 116.67 119.85 1uuh s ASP 140 Ca 0.33 2.58 -0.28 0.00 0.71 0.00 0.00 52.55 55.89 1uuh s ASP 140 Cb 0.03 -2.63 0.10 0.00 1.01 0.00 0.00 42.92 41.42 1uuh s ASP 140 CO 0.19 -0.97 1.28 -0.83 0.21 0.00 0.00 175.17 175.05 1uuh s GLY 141 N -0.93 -0.13 0.00 0.21 0.00 -1.25 -4.33 107.32 100.89 1uuh s GLY 141 Ca 0.61 0.05 0.28 0.00 0.00 0.00 0.00 44.72 45.66 1uuh s GLY 141 CO 0.45 5.41 1.75 -1.55 0.00 0.00 0.00 173.10 179.16 1uuh n PRO 142 N -0.89 1.27 -3.08 2.90 -0.04 -1.22 -3.11 135.00 130.82 1uuh n PRO 142 Ca 0.03 -0.67 -0.39 0.00 -0.04 0.00 0.00 63.50 62.43 1uuh n PRO 142 Cb 0.59 -1.49 -0.05 0.00 -0.04 0.00 0.00 33.50 32.51 1uuh n PRO 142 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1uuh s ILE 143 N -2.19 5.01 -0.40 0.52 -1.09 -0.63 -4.50 121.20 117.91 1uuh s ILE 143 Ca 0.34 1.40 -0.29 0.00 -2.23 0.00 0.00 60.65 59.87 1uuh s ILE 143 Cb 0.20 -4.02 0.01 0.00 -1.58 0.00 0.00 42.46 37.08 1uuh s ILE 143 CO 0.41 0.29 1.40 -0.89 -1.23 0.00 0.00 174.94 174.92 1uuh s THR 144 N 0.56 3.92 -0.24 2.92 2.01 -0.76 -1.00 115.64 123.05 1uuh s THR 144 Ca 0.36 0.95 -0.07 0.00 0.31 0.00 0.00 61.69 63.24 1uuh s THR 144 Cb -0.18 -4.20 -0.03 0.00 0.01 0.00 0.00 72.50 68.10 1uuh s THR 144 CO 0.18 -0.74 0.06 -0.63 -0.69 0.00 0.00 174.62 172.80 1uuh s ILE 145 N 5.35 4.24 -0.09 1.82 1.01 0.14 -0.85 121.20 132.82 1uuh s ILE 145 Ca 0.61 -0.20 -0.01 0.00 0.00 0.00 0.00 60.65 61.05 1uuh s ILE 145 Cb -0.14 -2.98 -0.03 0.00 0.01 0.00 0.00 42.46 39.32 1uuh s ILE 145 CO 0.32 0.35 -0.04 -0.89 0.00 0.00 0.00 174.94 174.68 1uuh s THR 146 N 1.55 3.96 -0.17 2.92 2.01 0.08 -1.08 115.64 124.91 1uuh s THR 146 Ca 0.06 -0.37 -0.01 0.00 0.31 0.00 0.00 61.69 61.68 1uuh s THR 146 Cb -0.15 -2.66 -0.00 0.00 0.01 0.00 0.00 72.50 69.70 1uuh s THR 146 CO 0.03 0.58 -0.12 -0.63 -0.69 0.00 0.00 174.62 173.79 1uuh s ILE 147 N -0.61 2.86 -0.21 1.82 1.01 0.06 0.17 121.20 126.28 1uuh s ILE 147 Ca 0.10 -0.70 -0.04 0.00 0.00 0.00 0.00 60.65 60.01 1uuh s ILE 147 Cb -0.12 -2.23 -0.01 0.00 0.01 0.00 0.00 42.46 40.11 1uuh s ILE 147 CO 0.02 0.50 -0.03 -0.69 0.00 0.00 0.00 174.94 174.74 1uuh s VAL 148 N 0.96 3.54 0.70 2.92 1.01 0.55 -1.42 120.40 128.66 1uuh s VAL 148 Ca -0.02 -0.44 0.03 0.00 0.00 0.00 0.00 61.98 61.55 1uuh s VAL 148 Cb -0.15 -2.61 0.13 0.00 0.00 0.00 0.00 36.38 33.76 1uuh s VAL 148 CO -0.01 0.42 0.97 0.20 0.00 0.00 0.00 175.10 176.68 1uuh s ASN 149 N 1.34 4.42 0.55 3.32 0.01 -1.25 -1.37 114.94 121.97 1uuh s ASN 149 Ca 0.04 -0.63 0.36 0.00 -0.71 0.00 0.00 52.86 51.92 1uuh s ASN 149 Cb -0.14 0.31 1.80 0.00 0.41 0.00 0.00 41.25 43.63 1uuh s ASN 149 CO -0.01 -1.83 2.10 0.08 -1.51 0.00 0.00 177.10 175.92 1uuh h ARG 150 N -0.40 0.00 -0.00 -0.60 -0.00 -1.92 -1.47 114.38 109.99 1uuh h ARG 150 Ca -0.32 0.00 0.00 0.00 -0.00 0.00 0.00 59.98 59.66 1uuh h ARG 150 Cb 1.27 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 31.24 1uuh h ARG 150 CO 0.38 0.00 -0.04 -0.40 -0.00 0.00 0.00 179.97 179.90 1uuh n ASP 151 N -2.90 0.06 0.00 0.08 5.75 -1.26 -4.93 116.55 113.35 1uuh n ASP 151 Ca -0.01 0.24 0.00 0.00 -0.01 0.00 0.00 54.79 55.00 1uuh n ASP 151 Cb 0.16 -0.37 0.00 0.00 -1.03 0.00 0.00 41.12 39.88 1uuh n ASP 151 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1uuh n GLY 152 N 1.44 1.05 3.72 6.12 0.00 -0.55 -5.04 105.19 111.93 1uuh n GLY 152 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 1uuh n GLY 152 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1uuh s THR 153 N -2.71 3.22 -0.40 2.61 2.01 -1.26 -4.89 115.64 114.22 1uuh s THR 153 Ca 0.00 0.93 -0.18 0.00 0.31 0.00 0.00 61.69 62.74 1uuh s THR 153 Cb 0.00 -3.59 0.01 0.00 0.01 0.00 0.00 72.50 68.93 1uuh s THR 153 CO 0.00 0.10 0.51 -0.13 -0.69 0.00 0.00 174.62 174.41 1uuh s ARG 154 N 0.60 3.33 -0.24 4.92 0.52 -1.26 -3.75 118.95 123.07 1uuh s ARG 154 Ca 0.62 -0.45 -0.14 0.00 -0.52 0.00 0.00 55.73 55.23 1uuh s ARG 154 Cb -0.37 -3.90 -0.04 0.00 0.52 0.00 0.00 34.95 31.15 1uuh s ARG 154 CO 0.34 -0.81 0.33 0.71 0.02 0.00 0.00 175.30 175.89 1uuh s TYR 155 N 2.39 3.30 -0.08 -0.53 1.51 -0.51 -4.94 117.35 118.49 1uuh s TYR 155 Ca 0.17 0.42 0.02 0.00 -1.01 0.00 0.00 57.07 56.67 1uuh s TYR 155 Cb -0.16 -2.49 -0.02 0.00 -0.11 0.00 0.00 41.96 39.19 1uuh s TYR 155 CO 0.15 -0.10 -0.15 0.08 -1.11 0.00 0.00 175.55 174.42 1uuh s VAL 156 N 1.61 2.97 0.20 0.71 1.01 -1.26 -0.77 120.40 124.87 1uuh s VAL 156 Ca 0.14 -0.73 -0.08 0.00 0.00 0.00 0.00 61.98 61.32 1uuh s VAL 156 Cb -0.15 -2.19 -0.02 0.00 0.00 0.00 0.00 36.38 34.02 1uuh s VAL 156 CO 0.08 0.56 0.29 0.00 0.00 0.00 0.00 175.10 176.03 1uuh s GLN 157 N -0.27 1.27 -0.13 2.72 -2.07 -0.24 -5.00 119.66 115.94 1uuh s GLN 157 Ca 0.02 -1.33 -0.02 0.00 -1.82 0.00 0.00 55.36 52.21 1uuh s GLN 157 Cb -0.13 0.37 -0.02 0.00 -1.09 0.00 0.00 33.01 32.13 1uuh s GLN 157 CO 0.03 -0.47 -0.07 0.21 -1.32 0.00 0.00 175.29 173.67 1uuh s LYS 158 N -4.04 3.39 0.00 9.60 2.20 -1.26 0.26 119.74 129.89 1uuh s LYS 158 Ca 0.25 -0.57 0.00 0.00 -0.36 0.00 0.00 55.97 55.29 1uuh s LYS 158 Cb 0.03 -2.77 0.00 0.00 -1.51 0.00 0.00 37.83 33.58 1uuh s LYS 158 CO 0.06 0.34 0.00 0.41 -0.36 0.00 0.00 175.35 175.80 1uuh n GLY 159 N 3.21 1.11 3.46 5.54 0.00 -0.17 -4.48 105.19 113.86 1uuh n GLY 159 Ca -0.18 -0.65 -0.15 0.00 0.00 0.00 0.00 46.02 45.05 1uuh n GLY 159 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1uuh s GLU 160 N 0.68 1.15 0.00 1.61 2.56 0.14 -1.60 118.70 123.23 1uuh s GLU 160 Ca 0.00 -0.12 0.00 0.00 0.00 0.00 0.00 54.97 54.85 1uuh s GLU 160 Cb 0.00 0.53 0.00 0.00 2.00 0.00 0.00 34.13 36.66 1uuh s GLU 160 CO 0.00 -0.43 0.00 2.48 -0.56 0.00 0.00 175.26 176.75 1uuh n TYR 161 N 0.29 0.00 -2.66 5.30 0.18 -1.26 -0.94 117.16 118.07 1uuh n TYR 161 Ca -0.18 0.00 -0.37 0.00 1.88 0.00 0.00 57.90 59.23 1uuh n TYR 161 Cb 0.61 0.00 -0.05 0.00 -0.38 0.00 0.00 39.34 39.51 1uuh n TYR 161 CO 0.00 0.00 0.00 1.03 -2.08 0.00 0.00 176.86 175.81 1uuh s ARG 162 N 0.00 4.46 0.00 -3.48 0.52 -1.26 -4.73 118.95 114.46 1uuh s ARG 162 Ca 0.00 1.45 0.00 0.00 -0.52 0.00 0.00 55.73 56.66 1uuh s ARG 162 Cb 0.00 -2.78 0.00 0.00 0.52 0.00 0.00 34.95 32.69 1uuh s ARG 162 CO 0.00 0.14 0.02 -2.37 0.02 0.00 0.00 175.30 173.11 1uuh n THR 163 N 0.46 0.00 -3.48 0.02 5.66 -1.26 -5.02 114.28 110.66 1uuh n THR 163 Ca 0.02 -0.20 -0.39 0.00 -3.05 0.00 0.00 64.05 60.43 1uuh n THR 163 Cb 0.49 1.05 -0.10 0.00 -1.55 0.00 0.00 70.33 70.22 1uuh n THR 163 CO 0.00 0.00 0.00 0.21 -3.05 0.00 0.00 175.07 172.23 1uuh s ASN 164 N -0.37 6.14 0.53 1.09 3.84 -1.26 -4.98 114.94 119.92 1uuh s ASN 164 Ca 0.00 0.04 0.27 0.00 0.21 0.00 0.00 52.86 53.39 1uuh s ASN 164 Cb 0.00 -2.17 1.50 0.00 -0.55 0.00 0.00 41.25 40.03 1uuh s ASN 164 CO 0.00 -0.16 2.10 1.55 -2.79 0.00 0.00 177.10 177.80 1uuh h PRO 165 N 8.32 0.00 0.00 0.43 0.13 -1.99 0.58 132.00 139.47 1uuh h PRO 165 Ca -0.33 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.80 1uuh h PRO 165 Cb 1.17 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.30 1uuh h PRO 165 CO 0.62 0.10 -0.04 0.93 -0.23 0.00 0.00 178.00 179.38 1uuh h GLU 166 N 0.00 0.00 0.12 0.86 5.08 -1.95 0.03 114.58 118.72 1uuh h GLU 166 Ca -0.00 0.00 -0.25 0.00 -1.00 0.00 0.00 59.36 58.11 1uuh h GLU 166 Cb 0.28 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.53 1uuh h GLU 166 CO 0.01 0.04 -1.23 -0.44 -1.00 0.00 0.00 179.01 176.38 1uuh h ASP 167 N 0.00 0.39 -0.20 1.42 3.32 -1.32 -3.39 116.42 116.64 1uuh h ASP 167 Ca -0.00 -0.87 -0.07 0.00 0.02 0.00 0.00 57.03 56.11 1uuh h ASP 167 Cb 0.55 -0.13 -0.00 0.00 0.22 0.00 0.00 39.33 39.97 1uuh h ASP 167 CO 0.00 1.55 -0.14 0.40 -1.72 0.00 0.00 179.24 179.33 1uuh h ILE 168 N -0.35 1.32 -0.00 0.35 2.04 -1.33 -3.51 117.51 116.03 1uuh h ILE 168 Ca -0.26 -1.25 0.00 0.00 1.00 0.00 0.00 64.86 64.35 1uuh h ILE 168 Cb 1.71 1.71 0.00 0.00 -0.74 0.00 0.00 36.82 39.50 1uuh h ILE 168 CO 0.08 0.38 0.00 0.00 0.00 0.00 0.00 178.15 178.61