#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uha n PRO 2 N 0.00 0.45 0.00 0.00 -0.02 -1.26 -4.90 135.00 129.27 1uha n PRO 2 Ca 0.00 0.16 0.02 0.00 -2.02 0.00 0.00 63.50 61.66 1uha n PRO 2 Cb 0.00 -1.45 -0.01 0.00 -0.02 0.00 0.00 33.50 32.02 1uha n PRO 2 CO 0.00 0.00 0.00 -0.85 1.98 0.00 0.00 175.50 176.63 1uha n GLU 3 N 1.30 3.52 -3.81 -0.52 0.28 -0.08 -4.79 120.64 116.54 1uha n GLU 3 Ca 0.17 -0.27 -0.10 0.00 -0.16 0.00 0.00 57.16 56.80 1uha n GLU 3 Cb 0.21 -0.83 -0.05 0.00 1.43 0.00 0.00 31.44 32.21 1uha n GLU 3 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1uha n GLY 5 N -0.28 -1.85 0.32 0.00 0.00 -0.49 -4.04 105.19 98.85 1uha n GLY 5 Ca -0.10 -1.65 0.17 0.00 0.00 0.00 0.00 46.02 44.44 1uha n GLY 5 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1uha h GLU 6 N 0.00 0.00 -0.02 1.61 4.11 -1.93 0.11 114.58 118.47 1uha h GLU 6 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1uha h GLU 6 Cb 0.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.25 1uha h GLU 6 CO 0.00 0.00 -0.03 0.54 0.07 0.00 0.00 179.01 179.59 1uha n ARG 7 N -3.71 1.61 -1.70 1.06 5.12 -1.26 -3.86 116.66 113.91 1uha n ARG 7 Ca -0.01 -0.97 -0.08 0.00 -1.93 0.00 0.00 57.85 54.86 1uha n ARG 7 Cb 0.19 -1.48 0.08 0.00 -1.16 0.00 0.00 32.46 30.08 1uha n ARG 7 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1uha n ALA 8 N 0.15 3.87 -1.87 7.54 0.00 0.02 -4.88 120.51 125.34 1uha n ALA 8 Ca 0.18 -3.29 -0.19 0.00 0.00 0.00 0.00 53.44 50.13 1uha n ALA 8 Cb 0.37 -0.48 -0.06 0.00 0.00 0.00 0.00 19.45 19.28 1uha n ALA 8 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1uha n SER 9 N -0.66 -5.28 0.00 0.00 7.64 -1.18 -1.92 113.62 112.23 1uha n SER 9 Ca 0.26 0.31 0.00 0.00 1.01 0.00 0.00 58.87 60.45 1uha n SER 9 Cb 0.88 -4.58 0.00 0.00 -1.01 0.00 0.00 64.21 59.50 1uha n SER 9 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1uha n GLY 10 N -0.58 0.72 3.78 0.23 0.00 0.18 -5.01 105.19 104.51 1uha n GLY 10 Ca -0.21 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.41 1uha n GLY 10 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1uha s LYS 11 N -0.43 4.00 0.15 1.61 1.02 -0.81 -4.68 119.74 120.61 1uha s LYS 11 Ca 0.00 2.53 0.04 0.00 0.02 0.00 0.00 55.97 58.56 1uha s LYS 11 Cb 0.00 -2.89 -0.04 0.00 -0.52 0.00 0.00 37.83 34.39 1uha s LYS 11 CO 0.00 -0.60 0.22 1.03 -0.92 0.00 0.00 175.35 175.07 1uha s ARG 12 N -2.19 3.19 0.40 1.68 0.52 -1.26 -1.40 118.95 119.90 1uha s ARG 12 Ca 0.55 -0.72 -0.25 0.00 -0.52 0.00 0.00 55.73 54.79 1uha s ARG 12 Cb -0.46 -2.82 -0.09 0.00 0.52 0.00 0.00 34.95 32.11 1uha s ARG 12 CO 0.61 0.51 1.12 0.00 0.02 0.00 0.00 175.30 177.56 1uha s PRO 14 N -2.35 2.39 -1.39 0.00 0.04 -1.26 -3.44 135.00 128.99 1uha s PRO 14 Ca 0.57 1.15 -0.03 0.00 0.04 0.00 0.00 61.00 62.74 1uha s PRO 14 Cb -0.27 -1.91 0.01 0.00 0.04 0.00 0.00 34.50 32.37 1uha s PRO 14 CO 0.34 -1.54 0.23 0.09 0.04 0.00 0.00 177.00 176.17 1uha n ASN 15 N -3.38 -4.88 -1.20 6.66 4.13 -1.26 -2.47 115.26 112.86 1uha n ASN 15 Ca 0.09 -0.08 -0.15 0.00 1.68 0.00 0.00 54.58 56.12 1uha n ASN 15 Cb 0.53 -4.04 -0.07 0.00 -1.54 0.00 0.00 39.78 34.66 1uha n ASN 15 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1uha n GLY 16 N -1.09 1.46 3.74 7.41 0.00 -1.22 -4.96 105.19 110.53 1uha n GLY 16 Ca -0.14 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.57 1uha n GLY 16 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1uha s LYS 17 N -3.28 2.00 0.31 1.61 1.02 -1.03 -4.72 119.74 115.64 1uha s LYS 17 Ca 0.00 1.35 -0.27 0.00 0.02 0.00 0.00 55.97 57.07 1uha s LYS 17 Cb 0.00 -1.85 -0.09 0.00 -0.52 0.00 0.00 37.83 35.36 1uha s LYS 17 CO 0.00 -1.86 0.99 0.00 -0.92 0.00 0.00 175.35 173.55 1uha s SER 20 N 1.67 2.66 0.53 0.00 1.04 0.31 -0.17 113.70 119.73 1uha s SER 20 Ca 0.06 1.36 0.24 0.00 0.48 0.00 0.00 55.95 58.08 1uha s SER 20 Cb -0.16 -2.04 1.38 0.00 0.10 0.00 0.00 66.02 65.29 1uha s SER 20 CO 0.08 -3.13 2.02 -0.61 0.98 0.00 0.00 173.24 172.58 1uha h GLN 21 N -1.89 0.00 -0.57 4.02 4.15 -1.78 -1.59 115.11 117.45 1uha h GLN 21 Ca -0.54 0.00 0.00 0.00 0.77 0.00 0.00 58.65 58.88 1uha h GLN 21 Cb 1.31 0.00 0.00 0.00 0.21 0.00 0.00 27.48 29.00 1uha h GLN 21 CO 0.55 0.00 0.00 0.91 -1.93 0.00 0.00 178.83 178.36 1uha n TRP 22 N -4.40 0.75 -1.21 3.99 7.02 -1.26 -4.96 117.44 117.37 1uha n TRP 22 Ca 0.07 -0.38 0.00 0.00 -1.02 0.00 0.00 57.50 56.18 1uha n TRP 22 Cb 0.51 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.40 1uha n TRP 22 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 1uha n GLY 23 N 1.47 0.97 3.31 6.99 0.00 -0.60 -4.82 105.19 112.52 1uha n GLY 23 Ca 0.20 -0.56 -0.25 0.00 0.00 0.00 0.00 46.02 45.41 1uha n GLY 23 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1uha s TYR 24 N -2.00 1.92 0.00 1.61 2.02 -1.26 -0.90 117.35 118.74 1uha s TYR 24 Ca 0.00 -0.41 -0.17 0.00 -0.37 0.00 0.00 57.07 56.12 1uha s TYR 24 Cb 0.00 -1.05 -0.06 0.00 -0.40 0.00 0.00 41.96 40.46 1uha s TYR 24 CO 0.00 0.24 0.49 0.00 -1.57 0.00 0.00 175.55 174.72 1uha s GLY 26 N -0.71 -0.01 0.00 0.00 0.00 -0.54 -4.99 107.32 101.08 1uha s GLY 26 Ca 0.27 -0.14 0.00 0.00 0.00 0.00 0.00 44.72 44.85 1uha s GLY 26 CO 0.15 3.60 0.27 -1.30 0.00 0.00 0.00 173.10 175.82 1uha n THR 27 N -0.77 0.00 -2.01 0.90 -2.24 -1.26 -1.55 114.28 107.35 1uha n THR 27 Ca -0.01 -0.30 -0.28 0.00 -2.27 0.00 0.00 64.05 61.19 1uha n THR 27 Cb 0.59 1.35 0.10 0.00 -2.10 0.00 0.00 70.33 70.27 1uha n THR 27 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1uha s THR 28 N -0.07 2.08 0.63 4.28 -4.23 -1.26 -4.74 115.64 112.33 1uha s THR 28 Ca 0.00 -0.10 0.36 0.00 -1.18 0.00 0.00 61.69 60.78 1uha s THR 28 Cb 0.00 -2.98 0.39 0.00 1.34 0.00 0.00 72.50 71.25 1uha s THR 28 CO 0.00 0.00 2.25 0.44 -0.54 0.00 0.00 174.62 176.77 1uha h ASP 29 N -1.01 0.00 0.64 3.99 3.32 -1.97 0.53 116.42 121.91 1uha h ASP 29 Ca -0.45 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.60 1uha h ASP 29 Cb 1.31 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.86 1uha h ASP 29 CO 0.59 0.00 0.00 0.59 -1.72 0.00 0.00 179.24 178.70 1uha n ASN 30 N -3.41 0.00 -0.03 6.45 3.02 -1.26 -0.38 115.26 119.64 1uha n ASN 30 Ca -0.02 0.22 -0.05 0.00 -0.03 0.00 0.00 54.58 54.70 1uha n ASN 30 Cb 0.14 -0.39 -0.03 0.00 -0.61 0.00 0.00 39.78 38.89 1uha n ASN 30 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1uha n TYR 31 N -1.39 0.00 0.34 3.10 4.01 0.06 -4.74 117.16 118.53 1uha n TYR 31 Ca 0.09 0.00 0.11 0.00 -0.16 0.00 0.00 57.90 57.94 1uha n TYR 31 Cb 0.23 -0.25 -0.04 0.00 -0.31 0.00 0.00 39.34 38.98 1uha n TYR 31 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1uha n GLY 33 N 1.30 0.19 3.74 0.00 0.00 0.49 -4.67 105.19 106.24 1uha n GLY 33 Ca 0.00 -1.14 -0.42 0.00 0.00 0.00 0.00 46.02 44.46 1uha n GLY 33 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1uha s GLN 34 N 0.00 4.16 0.00 1.61 -0.44 -1.26 -2.20 119.66 121.53 1uha s GLN 34 Ca 0.00 2.50 0.00 0.00 -2.50 0.00 0.00 55.36 55.36 1uha s GLN 34 Cb 0.00 -3.08 0.00 0.00 -1.64 0.00 0.00 33.01 28.29 1uha s GLN 34 CO 0.00 -0.62 0.00 0.41 0.50 0.00 0.00 175.29 175.58 1uha n GLY 35 N 2.93 1.10 3.68 2.59 0.00 -1.26 -4.79 105.19 109.44 1uha n GLY 35 Ca 0.11 0.00 -0.45 0.00 0.00 0.00 0.00 46.02 45.68 1uha n GLY 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uha h GLN 37 N 5.47 0.00 -4.02 0.00 4.20 -0.76 -3.47 115.11 116.54 1uha h GLN 37 Ca -0.45 0.00 -0.11 0.00 0.06 0.00 0.00 58.65 58.15 1uha h GLN 37 Cb 1.25 0.00 -0.15 0.00 0.30 0.00 0.00 27.48 28.88 1uha h GLN 37 CO 0.85 0.70 -0.56 -1.54 -0.67 0.00 0.00 178.83 177.62 1uha s SER 38 N -6.35 0.31 -1.50 1.46 1.04 -1.24 -4.88 113.70 102.53 1uha s SER 38 Ca -0.21 -0.79 -0.11 0.00 0.48 0.00 0.00 55.95 55.32 1uha s SER 38 Cb 0.02 0.24 0.07 0.00 0.10 0.00 0.00 66.02 66.46 1uha s SER 38 CO 0.48 -0.61 0.90 0.00 0.98 0.00 0.00 173.24 174.98 1uha n GLN 39 N 0.23 -5.14 0.01 4.02 6.02 -1.26 -1.81 117.38 119.45 1uha n GLN 39 Ca -0.16 0.57 0.12 0.00 -0.01 0.00 0.00 57.00 57.53 1uha n GLN 39 Cb 0.61 -5.36 0.54 0.00 1.02 0.00 0.00 30.24 27.04 1uha n GLN 39 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1uha n ASP 41 N -1.58 3.92 -0.32 0.00 10.43 -1.26 -4.61 116.55 123.12 1uha n ASP 41 Ca 0.06 -2.89 0.13 0.00 2.57 0.00 0.00 54.79 54.66 1uha n ASP 41 Cb 0.31 -0.69 0.31 0.00 1.84 0.00 0.00 41.12 42.90 1uha n ASP 41 CO 0.00 0.00 0.00 0.22 -1.07 0.00 0.00 177.20 176.35 1uha h TYR 42 N 1.73 0.78 -0.01 1.24 5.03 -1.84 -1.39 116.97 122.51 1uha h TYR 42 Ca 0.23 0.04 0.00 0.00 2.58 0.00 0.00 58.73 61.57 1uha h TYR 42 Cb 1.93 -0.20 0.00 0.00 1.55 0.00 0.00 36.73 40.01 1uha h TYR 42 CO 0.95 0.03 -0.16 0.91 -1.32 0.00 0.00 178.16 178.57 1uha n TRP 43 N -4.97 0.00 -4.05 -3.82 7.02 -1.26 -4.77 117.44 105.60 1uha n TRP 43 Ca 0.23 0.00 -0.25 0.00 -1.02 0.00 0.00 57.50 56.46 1uha n TRP 43 Cb 0.64 -0.10 -0.04 0.00 -2.42 0.00 0.00 31.31 29.39 1uha n TRP 43 CO 0.00 0.00 0.00 1.03 -2.02 0.00 0.00 177.69 176.70 1uha s ARG 44 N -2.36 3.08 0.25 -0.99 1.81 -0.52 -0.88 118.95 119.34 1uha s ARG 44 Ca 0.29 -0.83 -0.20 0.00 -1.72 0.00 0.00 55.73 53.27 1uha s ARG 44 Cb 0.20 -2.73 0.07 0.00 -0.45 0.00 0.00 34.95 32.04 1uha s ARG 44 CO 0.46 0.47 0.93 0.00 -0.68 0.00 0.00 175.30 176.49 1uha n GLY 46 N -0.60 -1.76 0.29 0.00 0.00 -0.79 -4.33 105.19 98.00 1uha n GLY 46 Ca -0.05 -1.60 0.12 0.00 0.00 0.00 0.00 46.02 44.49 1uha n GLY 46 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 1uha h ARG 47 N 0.00 0.00 0.00 1.61 0.11 -1.91 0.30 114.38 114.49 1uha h ARG 47 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1uha h ARG 47 Cb 0.00 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.08 1uha h ARG 47 CO 0.00 0.00 0.00 -0.25 0.10 0.00 0.00 179.97 179.82 1uha n ASP 48 N -4.32 0.59 -2.73 0.08 8.00 -1.26 -3.99 116.55 112.92 1uha n ASP 48 Ca -0.01 0.56 -0.22 0.00 0.71 0.00 0.00 54.79 55.84 1uha n ASP 48 Cb 0.19 -0.72 -0.01 0.00 -0.02 0.00 0.00 41.12 40.56 1uha n ASP 48 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1uha n PHE 49 N -2.06 2.65 -1.37 1.24 3.01 -0.51 -4.94 117.46 115.48 1uha n PHE 49 Ca 0.06 -3.37 -0.13 0.00 1.01 0.00 0.00 57.45 55.02 1uha n PHE 49 Cb 0.38 -0.30 -0.05 0.00 -0.01 0.00 0.00 39.48 39.50 1uha n PHE 49 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1uha n GLY 50 N -0.23 1.25 2.07 1.37 0.00 -1.23 -1.88 105.19 106.55 1uha n GLY 50 Ca 0.29 -0.05 -0.01 0.00 0.00 0.00 0.00 46.02 46.25 1uha n GLY 50 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1uha n GLY 51 N -0.12 0.50 3.69 -0.02 0.00 0.94 -4.99 105.19 105.19 1uha n GLY 51 Ca -0.13 -0.61 -0.42 0.00 0.00 0.00 0.00 46.02 44.86 1uha n GLY 51 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1uha n ARG 52 N -2.82 2.01 -3.82 1.61 0.63 -0.79 -4.58 116.66 108.91 1uha n ARG 52 Ca -0.01 0.71 -0.32 0.00 -0.92 0.00 0.00 57.85 57.31 1uha n ARG 52 Cb 0.06 -2.28 -0.04 0.00 0.45 0.00 0.00 32.46 30.64 1uha n ARG 52 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 1uha s LEU 53 N -0.94 4.33 0.55 6.15 1.43 -1.26 -1.88 118.68 127.06 1uha s LEU 53 Ca 0.56 0.41 -0.16 0.00 -1.03 0.00 0.00 54.13 53.91 1uha s LEU 53 Cb -0.57 -3.04 -0.06 0.00 0.03 0.00 0.00 46.19 42.54 1uha s LEU 53 CO 0.61 0.14 1.02 0.00 0.23 0.00 0.00 176.35 178.35 1uha s GLU 55 N -4.04 1.42 -1.11 0.00 0.41 -1.26 -4.30 118.70 109.82 1uha s GLU 55 Ca 0.61 -0.44 -0.02 0.00 -0.41 0.00 0.00 54.97 54.71 1uha s GLU 55 Cb -0.13 -2.04 0.02 0.00 -1.78 0.00 0.00 34.13 30.20 1uha s GLU 55 CO 0.33 -1.81 0.14 0.39 -0.49 0.00 0.00 175.26 173.83 1uha n GLU 56 N -3.30 -2.65 -2.30 1.61 -0.58 -1.26 -1.88 120.64 110.28 1uha n GLU 56 Ca 0.12 0.57 -0.18 0.00 -0.42 0.00 0.00 57.16 57.26 1uha n GLU 56 Cb 0.60 -5.21 -0.02 0.00 -0.57 0.00 0.00 31.44 26.24 1uha n GLU 56 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 1uha n ASP 57 N -1.95 -5.11 -4.81 1.62 4.64 -1.26 -4.96 116.55 104.72 1uha n ASP 57 Ca -0.11 0.11 -0.33 0.00 -1.38 0.00 0.00 54.79 53.08 1uha n ASP 57 Cb 0.59 -4.31 -0.06 0.00 -1.04 0.00 0.00 41.12 36.30 1uha n ASP 57 CO 0.00 0.00 0.00 -0.04 -0.82 0.00 0.00 177.20 176.34 1uha s MET 58 N -4.84 4.06 0.45 -0.67 -1.94 -0.79 -4.99 119.30 110.59 1uha s MET 58 Ca 0.00 1.19 -0.20 0.00 -1.71 0.00 0.00 55.69 54.97 1uha s MET 58 Cb 0.00 -2.15 -0.10 0.00 2.01 0.00 0.00 34.83 34.59 1uha s MET 58 CO 0.00 -0.19 0.96 0.00 -0.01 0.00 0.00 175.02 175.78 1uha s SER 61 N 1.57 2.41 0.63 0.00 1.04 -0.03 0.10 113.70 119.43 1uha s SER 61 Ca 0.04 1.30 0.40 0.00 0.48 0.00 0.00 55.95 58.17 1uha s SER 61 Cb -0.17 -1.99 2.07 0.00 0.10 0.00 0.00 66.02 66.03 1uha s SER 61 CO 0.05 -3.28 2.25 0.07 0.98 0.00 0.00 173.24 173.32 1uha h LYS 62 N -1.99 0.00 -0.41 4.02 2.10 -1.82 -0.94 116.57 117.52 1uha h LYS 62 Ca -0.55 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.10 1uha h LYS 62 Cb 1.32 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.65 1uha h LYS 62 CO 0.56 0.01 0.00 0.66 -2.00 0.00 0.00 179.45 178.67 1uha n TYR 63 N -3.15 0.54 -1.81 0.07 4.01 -1.26 -4.96 117.16 110.59 1uha n TYR 63 Ca -0.02 -0.27 0.00 0.00 -0.16 0.00 0.00 57.90 57.45 1uha n TYR 63 Cb 0.14 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.17 1uha n TYR 63 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1uha n GLY 64 N 1.48 0.61 3.40 2.72 0.00 -0.36 -4.97 105.19 108.07 1uha n GLY 64 Ca 0.20 -0.77 -0.32 0.00 0.00 0.00 0.00 46.02 45.13 1uha n GLY 64 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1uha s TRP 65 N -2.09 2.52 0.08 1.61 0.52 -1.26 -1.37 118.94 118.96 1uha s TRP 65 Ca 0.00 -0.29 -0.25 0.00 0.02 0.00 0.00 56.10 55.58 1uha s TRP 65 Cb 0.00 -1.56 -0.06 0.00 -1.15 0.00 0.00 33.47 30.70 1uha s TRP 65 CO 0.00 0.09 0.76 0.00 0.02 0.00 0.00 176.95 177.82 1uha n GLY 67 N 2.11 0.24 0.02 0.00 0.00 -0.52 -4.96 105.19 102.09 1uha n GLY 67 Ca -0.04 -1.05 0.01 0.00 0.00 0.00 0.00 46.02 44.94 1uha n GLY 67 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1uha n TYR 68 N -0.89 0.00 -1.23 1.61 4.01 -1.26 -0.04 117.16 119.36 1uha n TYR 68 Ca 0.04 0.00 -0.30 0.00 -0.16 0.00 0.00 57.90 57.48 1uha n TYR 68 Cb 0.57 0.00 0.14 0.00 -0.31 0.00 0.00 39.34 39.74 1uha n TYR 68 CO 0.00 0.00 0.00 -1.54 -0.46 0.00 0.00 176.86 174.86 1uha s SER 69 N -0.86 3.47 0.41 7.72 1.04 -1.26 -4.77 113.70 119.45 1uha s SER 69 Ca 0.01 1.44 0.08 0.00 0.48 0.00 0.00 55.95 57.97 1uha s SER 69 Cb 0.01 -2.13 0.88 0.00 0.10 0.00 0.00 66.02 64.89 1uha s SER 69 CO 0.05 -2.64 2.04 0.44 0.98 0.00 0.00 173.24 174.12 1uha h ASP 70 N -1.55 0.46 0.65 7.02 3.45 -1.97 -0.38 116.42 124.11 1uha h ASP 70 Ca -0.50 -0.01 -0.05 0.00 0.43 0.00 0.00 57.03 56.91 1uha h ASP 70 Cb 1.29 -0.11 -0.01 0.00 -0.56 0.00 0.00 39.33 39.94 1uha h ASP 70 CO 0.55 0.32 -0.22 -0.78 -1.57 0.00 0.00 179.24 177.54 1uha h ASP 71 N 0.54 0.00 0.40 6.45 1.82 -1.97 0.10 116.42 123.77 1uha h ASP 71 Ca 0.18 0.00 -0.31 0.00 -0.39 0.00 0.00 57.03 56.51 1uha h ASP 71 Cb 0.06 0.00 -0.02 0.00 0.68 0.00 0.00 39.33 40.05 1uha h ASP 71 CO -0.04 0.22 -1.68 0.45 -1.61 0.00 0.00 179.24 176.58 1uha h HIS 72 N 0.00 0.31 0.00 0.28 3.86 -1.47 -3.40 115.15 114.73 1uha h HIS 72 Ca -0.00 -0.23 0.00 0.00 -1.16 0.00 0.00 60.37 58.98 1uha h HIS 72 Cb 0.61 -0.01 0.00 0.00 1.06 0.00 0.00 27.41 29.07 1uha h HIS 72 CO 0.00 1.36 -1.41 0.00 0.86 0.00 0.00 177.93 178.73 1uha n GLU 74 N -2.21 3.65 -1.48 0.00 -0.58 0.33 -4.63 120.64 115.73 1uha n GLU 74 Ca -0.01 0.00 -0.58 0.00 -0.42 0.00 0.00 57.16 56.16 1uha n GLU 74 Cb 0.51 0.00 -0.08 0.00 -0.57 0.00 0.00 31.44 31.29 1uha n GLU 74 CO 0.00 0.00 0.00 -3.47 -0.48 0.00 0.00 177.13 173.18 1uha n ASP 75 N 0.00 0.89 0.00 1.62 2.03 -1.26 -0.93 116.55 118.91 1uha n ASP 75 Ca 0.00 1.03 0.00 0.00 0.52 0.00 0.00 54.79 56.34 1uha n ASP 75 Cb 0.00 -0.77 0.00 0.00 -0.72 0.00 0.00 41.12 39.63 1uha n ASP 75 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1uha n GLY 76 N 3.14 1.91 3.62 0.27 0.00 -1.26 -4.66 105.19 108.21 1uha n GLY 76 Ca 0.25 0.00 -0.46 0.00 0.00 0.00 0.00 46.02 45.81 1uha n GLY 76 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uha n GLN 78 N 1.65 0.63 -3.50 0.00 6.02 0.12 -4.90 117.38 117.39 1uha n GLN 78 Ca 0.12 0.20 -0.09 0.00 -0.01 0.00 0.00 57.00 57.22 1uha n GLN 78 Cb 0.29 -1.78 -0.02 0.00 1.02 0.00 0.00 30.24 29.74 1uha n GLN 78 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.06 174.51 1uha s SER 79 N -5.72 -0.40 -1.53 1.08 1.04 -1.25 -4.97 113.70 101.95 1uha s SER 79 Ca -0.03 0.04 -0.05 0.00 0.48 0.00 0.00 55.95 56.38 1uha s SER 79 Cb 0.09 0.41 0.05 0.00 0.10 0.00 0.00 66.02 66.66 1uha s SER 79 CO 0.82 -0.65 0.41 0.00 0.98 0.00 0.00 173.24 174.80 1uha n GLN 80 N -0.18 -2.58 0.18 4.02 6.02 -1.26 -2.02 117.38 121.55 1uha n GLN 80 Ca -0.10 0.31 0.13 0.00 -0.01 0.00 0.00 57.00 57.33 1uha n GLN 80 Cb 0.62 -4.44 0.31 0.00 1.02 0.00 0.00 30.24 27.75 1uha n GLN 80 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05