#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uz0 s VAL 2 N 0.00 4.72 -0.11 1.12 1.01 -1.26 -0.98 120.40 124.90 1uz0 s VAL 2 Ca 0.00 2.00 -0.24 0.00 0.00 0.00 0.00 61.98 63.74 1uz0 s VAL 2 Cb 0.00 -4.29 -0.27 0.00 0.00 0.00 0.00 36.38 31.82 1uz0 s VAL 2 CO 0.00 -0.02 0.73 0.40 0.00 0.00 0.00 175.10 176.21 1uz0 h ILE 3 N 5.14 1.52 -1.86 2.22 1.08 -1.20 -3.48 117.51 120.94 1uz0 h ILE 3 Ca -0.29 -2.40 -0.01 0.00 -0.39 0.00 0.00 64.86 61.76 1uz0 h ILE 3 Cb 1.14 3.13 -0.21 0.00 -3.07 0.00 0.00 36.82 37.81 1uz0 h ILE 3 CO 0.88 0.63 0.29 0.00 -0.69 0.00 0.00 178.15 179.25 1uz0 s ALA 4 N -2.34 -1.83 -0.26 1.87 0.00 -1.15 -5.02 121.76 113.03 1uz0 s ALA 4 Ca -0.18 1.58 -0.08 0.00 0.00 0.00 0.00 51.96 53.28 1uz0 s ALA 4 Cb 0.00 -0.54 -0.02 0.00 0.00 0.00 0.00 23.12 22.56 1uz0 s ALA 4 CO 0.74 -0.34 0.08 0.99 0.00 0.00 0.00 175.76 177.23 1uz0 s THR 5 N -0.72 4.33 -0.27 0.00 2.01 -1.26 -1.08 115.64 118.64 1uz0 s THR 5 Ca -0.05 -0.24 -0.06 0.00 0.31 0.00 0.00 61.69 61.65 1uz0 s THR 5 Cb -0.02 -3.06 0.00 0.00 0.01 0.00 0.00 72.50 69.43 1uz0 s THR 5 CO 0.05 0.29 0.06 -0.63 -0.69 0.00 0.00 174.62 173.69 1uz0 s ILE 6 N 1.61 3.91 0.14 1.82 1.01 0.66 -4.96 121.20 125.39 1uz0 s ILE 6 Ca 0.06 -0.58 -0.31 0.00 0.00 0.00 0.00 60.65 59.81 1uz0 s ILE 6 Cb -0.15 -2.95 -0.09 0.00 0.01 0.00 0.00 42.46 39.28 1uz0 s ILE 6 CO 0.04 0.18 1.47 -1.10 0.00 0.00 0.00 174.94 175.53 1uz0 s GLN 7 N 1.51 4.27 0.34 2.79 -1.52 -1.26 -0.39 119.66 125.40 1uz0 s GLN 7 Ca 0.04 2.21 0.07 0.00 -1.95 0.00 0.00 55.36 55.72 1uz0 s GLN 7 Cb -0.16 -3.20 0.75 0.00 -0.22 0.00 0.00 33.01 30.18 1uz0 s GLN 7 CO 0.02 -0.52 1.87 0.00 -0.25 0.00 0.00 175.29 176.41 1uz0 h ALA 8 N 6.80 1.76 0.00 6.09 0.00 -1.52 -1.51 119.26 130.88 1uz0 h ALA 8 Ca -0.42 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.50 1uz0 h ALA 8 Cb 1.21 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.85 1uz0 h ALA 8 CO 0.89 0.01 0.00 -0.85 0.00 0.00 0.00 179.25 179.30 1uz0 n GLU 9 N -4.56 0.35 -0.79 0.00 0.00 -1.26 -3.36 120.64 111.01 1uz0 n GLU 9 Ca 0.17 0.08 -0.13 0.00 0.00 0.00 0.00 57.16 57.29 1uz0 n GLU 9 Cb 0.42 -1.50 0.15 0.00 0.00 0.00 0.00 31.44 30.51 1uz0 n GLU 9 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.13 176.88 1uz0 n ASP 10 N -1.22 3.62 -4.76 -1.84 8.00 -0.57 -4.96 116.55 114.82 1uz0 n ASP 10 Ca 0.10 -3.01 -0.36 0.00 0.71 0.00 0.00 54.79 52.23 1uz0 n ASP 10 Cb 0.13 -0.71 0.03 0.00 -0.02 0.00 0.00 41.12 40.55 1uz0 n ASP 10 CO 0.00 0.00 0.00 -1.38 -0.39 0.00 0.00 177.20 175.43 1uz0 s HIS 11 N -2.22 2.42 -0.04 1.24 -3.43 -1.21 -4.92 115.29 107.13 1uz0 s HIS 11 Ca 0.38 1.51 0.13 0.00 -0.80 0.00 0.00 55.06 56.28 1uz0 s HIS 11 Cb 0.32 -3.47 -0.21 0.00 -1.43 0.00 0.00 32.58 27.78 1uz0 s HIS 11 CO 0.08 -2.16 0.75 0.66 -2.00 0.00 0.00 174.74 172.07 1uz0 h SER 12 N 0.96 0.00 -4.99 7.38 4.64 -1.27 -3.47 113.55 116.80 1uz0 h SER 12 Ca -0.50 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 60.69 1uz0 h SER 12 Cb 1.29 0.00 -0.20 0.00 -0.31 0.00 0.00 62.40 63.18 1uz0 h SER 12 CO 0.55 0.93 -0.34 -1.10 -0.87 0.00 0.00 176.83 176.01 1uz0 s GLN 13 N -2.66 0.62 0.21 4.77 1.11 -1.20 -5.00 119.66 117.51 1uz0 s GLN 13 Ca -0.04 -0.27 -0.14 0.00 0.01 0.00 0.00 55.36 54.93 1uz0 s GLN 13 Cb 0.08 0.27 0.01 0.00 -1.01 0.00 0.00 33.01 32.36 1uz0 s GLN 13 CO 0.82 -0.17 0.45 1.14 0.01 0.00 0.00 175.29 177.54 1uz0 s GLN 14 N -1.40 1.38 -0.05 2.91 1.03 -1.26 -0.72 119.66 121.56 1uz0 s GLN 14 Ca -0.14 -1.09 -0.01 0.00 0.04 0.00 0.00 55.36 54.17 1uz0 s GLN 14 Cb -0.06 0.47 0.03 0.00 0.03 0.00 0.00 33.01 33.48 1uz0 s GLN 14 CO 0.03 -0.57 0.02 0.45 -2.54 0.00 0.00 175.29 172.69 1uz0 s SER 15 N -2.95 1.09 0.00 12.60 0.15 -0.16 -4.94 113.70 119.50 1uz0 s SER 15 Ca 0.16 -0.02 0.00 0.00 0.70 0.00 0.00 55.95 56.79 1uz0 s SER 15 Cb 0.00 -0.28 0.00 0.00 -1.71 0.00 0.00 66.02 64.03 1uz0 s SER 15 CO 0.02 -0.18 0.00 0.61 1.20 0.00 0.00 173.24 174.89 1uz0 n GLY 16 N 4.88 0.79 3.89 9.45 0.00 -1.26 -2.03 105.19 120.90 1uz0 n GLY 16 Ca -0.12 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.66 1uz0 n GLY 16 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1uz0 s THR 17 N -2.95 2.04 0.01 2.61 -4.23 -1.26 -4.75 115.64 107.11 1uz0 s THR 17 Ca 0.00 -1.44 -0.09 0.00 -1.18 0.00 0.00 61.69 58.99 1uz0 s THR 17 Cb 0.00 -2.48 0.00 0.00 1.34 0.00 0.00 72.50 71.36 1uz0 s THR 17 CO 0.00 0.00 0.17 -1.58 -0.54 0.00 0.00 174.62 172.67 1uz0 s GLN 18 N -4.22 0.55 0.27 3.99 2.00 -0.95 -5.02 119.66 116.27 1uz0 s GLN 18 Ca 0.41 -0.43 -0.10 0.00 -2.00 0.00 0.00 55.36 53.24 1uz0 s GLN 18 Cb -0.02 0.23 -0.07 0.00 0.80 0.00 0.00 33.01 33.95 1uz0 s GLN 18 CO 0.24 -0.14 0.59 -0.65 -0.50 0.00 0.00 175.29 174.84 1uz0 s GLN 19 N -1.63 3.80 0.12 1.67 -0.21 -1.26 -0.42 119.66 121.73 1uz0 s GLN 19 Ca -0.13 0.31 -0.13 0.00 0.02 0.00 0.00 55.36 55.44 1uz0 s GLN 19 Cb -0.06 -2.59 0.02 0.00 1.00 0.00 0.00 33.01 31.37 1uz0 s GLN 19 CO 0.01 0.25 0.32 -1.83 -2.12 0.00 0.00 175.29 171.91 1uz0 s GLU 20 N -3.03 1.01 0.26 2.91 -1.05 -0.61 -4.90 118.70 113.29 1uz0 s GLU 20 Ca 0.48 -0.86 -0.30 0.00 -0.15 0.00 0.00 54.97 54.14 1uz0 s GLU 20 Cb -0.11 0.41 -0.10 0.00 -0.44 0.00 0.00 34.13 33.90 1uz0 s GLU 20 CO 0.23 -0.37 1.41 0.99 0.95 0.00 0.00 175.26 178.47 1uz0 s THR 21 N -3.85 2.70 0.04 1.83 2.01 -1.26 -0.70 115.64 116.41 1uz0 s THR 21 Ca 0.05 0.60 0.01 0.00 0.31 0.00 0.00 61.69 62.67 1uz0 s THR 21 Cb 0.03 -3.38 -0.04 0.00 0.01 0.00 0.00 72.50 69.12 1uz0 s THR 21 CO -0.10 0.10 0.12 0.28 -0.69 0.00 0.00 174.62 174.33 1uz0 s THR 22 N -0.19 4.85 -2.10 -0.82 -1.32 -0.43 -4.66 115.64 110.97 1uz0 s THR 22 Ca 0.57 -0.53 0.20 0.00 -1.21 0.00 0.00 61.69 60.73 1uz0 s THR 22 Cb -0.41 -3.30 0.39 0.00 -1.51 0.00 0.00 72.50 67.67 1uz0 s THR 22 CO 0.45 0.21 1.33 0.35 -2.21 0.00 0.00 174.62 174.75 1uz0 n THR 23 N 0.67 0.56 -0.69 5.08 -2.24 -1.26 -4.29 114.28 112.12 1uz0 n THR 23 Ca -0.09 -0.78 -0.31 0.00 -2.27 0.00 0.00 64.05 60.59 1uz0 n THR 23 Cb 0.52 0.91 0.16 0.00 -2.10 0.00 0.00 70.33 69.82 1uz0 n THR 23 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1uz0 n ASP 24 N 1.29 -1.10 -4.65 3.42 2.03 -1.26 -4.83 116.55 111.44 1uz0 n ASP 24 Ca 0.17 0.25 -0.47 0.00 0.52 0.00 0.00 54.79 55.26 1uz0 n ASP 24 Cb 0.55 -1.30 -0.05 0.00 -0.72 0.00 0.00 41.12 39.61 1uz0 n ASP 24 CO 0.00 0.00 0.00 0.41 -1.92 0.00 0.00 177.20 175.69 1uz0 n THR 25 N -4.14 0.01 0.00 5.18 -1.04 -1.26 -1.75 114.28 111.28 1uz0 n THR 25 Ca 0.08 -0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.09 1uz0 n THR 25 Cb 0.54 -1.37 0.00 0.00 -1.82 0.00 0.00 70.33 67.68 1uz0 n THR 25 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1uz0 n GLY 26 N 3.19 2.20 7.00 3.41 0.00 -1.26 -4.99 105.19 114.74 1uz0 n GLY 26 Ca 0.17 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.19 1uz0 n GLY 26 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1uz0 n GLY 27 N -2.00 0.34 6.28 -0.02 0.00 -0.72 -5.01 105.19 104.06 1uz0 n GLY 27 Ca 0.00 -0.88 0.00 0.00 0.00 0.00 0.00 46.02 45.14 1uz0 n GLY 27 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1uz0 n GLY 28 N 0.00 0.38 3.29 -0.02 0.00 -1.26 -4.80 105.19 102.78 1uz0 n GLY 28 Ca 0.00 -0.89 -0.16 0.00 0.00 0.00 0.00 46.02 44.98 1uz0 n GLY 28 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1uz0 s LYS 29 N 0.00 1.21 0.21 1.61 1.02 -1.26 -1.31 119.74 121.21 1uz0 s LYS 29 Ca 0.00 -1.57 0.08 0.00 0.02 0.00 0.00 55.97 54.50 1uz0 s LYS 29 Cb 0.00 -0.65 -0.05 0.00 -0.52 0.00 0.00 37.83 36.61 1uz0 s LYS 29 CO 0.00 -0.00 -0.14 0.54 -0.92 0.00 0.00 175.35 174.82 1uz0 s ASN 30 N -3.24 2.60 -0.10 2.83 2.20 0.12 -4.67 114.94 114.68 1uz0 s ASN 30 Ca 0.23 -1.02 -0.23 0.00 -0.94 0.00 0.00 52.86 50.90 1uz0 s ASN 30 Cb 0.04 -0.14 -0.03 0.00 -2.00 0.00 0.00 41.25 39.11 1uz0 s ASN 30 CO 0.05 -0.17 0.67 -0.69 -2.94 0.00 0.00 177.10 174.03 1uz0 s VAL 31 N -2.96 5.04 0.00 3.54 1.01 -0.17 -1.57 120.40 125.30 1uz0 s VAL 31 Ca 0.23 1.36 0.00 0.00 0.00 0.00 0.00 61.98 63.57 1uz0 s VAL 31 Cb -0.01 -4.01 0.00 0.00 0.00 0.00 0.00 36.38 32.36 1uz0 s VAL 31 CO 0.07 0.22 0.00 0.61 0.00 0.00 0.00 175.10 176.00 1uz0 n GLY 32 N 3.27 5.53 3.85 4.51 0.00 0.44 -1.08 105.19 121.72 1uz0 n GLY 32 Ca -0.01 -1.88 -0.26 0.00 0.00 0.00 0.00 46.02 43.86 1uz0 n GLY 32 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1uz0 n TYR 33 N 0.00 -2.04 -3.34 1.61 4.02 -1.26 -2.23 117.16 113.92 1uz0 n TYR 33 Ca 0.00 0.86 -0.39 0.00 -0.01 0.00 0.00 57.90 58.36 1uz0 n TYR 33 Cb 0.00 -4.06 -0.08 0.00 -0.02 0.00 0.00 39.34 35.19 1uz0 n TYR 33 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 176.86 176.27 1uz0 s ILE 34 N -3.53 5.16 0.23 -0.72 1.01 -1.26 -4.35 121.20 117.74 1uz0 s ILE 34 Ca 0.33 0.75 0.11 0.00 0.00 0.00 0.00 60.65 61.84 1uz0 s ILE 34 Cb -0.16 -3.76 -0.05 0.00 0.01 0.00 0.00 42.46 38.50 1uz0 s ILE 34 CO 0.84 0.20 -0.21 -1.81 0.00 0.00 0.00 174.94 173.96 1uz0 s ASP 35 N 1.21 3.41 -0.02 3.58 1.01 -1.26 -2.45 116.67 122.14 1uz0 s ASP 35 Ca 0.20 -0.95 -0.39 0.00 0.71 0.00 0.00 52.55 52.12 1uz0 s ASP 35 Cb -0.15 -0.26 -0.18 0.00 1.01 0.00 0.00 42.92 43.33 1uz0 s ASP 35 CO 0.09 0.06 1.26 0.00 0.21 0.00 0.00 175.17 176.78 1uz0 n ALA 36 N -0.17 -2.22 0.00 5.23 0.00 -1.26 -0.62 120.51 121.47 1uz0 n ALA 36 Ca -0.09 0.55 0.00 0.00 0.00 0.00 0.00 53.44 53.90 1uz0 n ALA 36 Cb 0.58 -1.93 0.00 0.00 0.00 0.00 0.00 19.45 18.11 1uz0 n ALA 36 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1uz0 n GLY 37 N 2.25 2.74 3.71 0.00 0.00 0.64 -4.97 105.19 109.56 1uz0 n GLY 37 Ca 0.21 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.91 1uz0 n GLY 37 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1uz0 s ASP 38 N -1.89 3.63 0.10 1.61 1.01 0.21 -4.81 116.67 116.53 1uz0 s ASP 38 Ca 0.00 2.09 -0.23 0.00 0.71 0.00 0.00 52.55 55.12 1uz0 s ASP 38 Cb 0.00 -2.56 0.06 0.00 1.01 0.00 0.00 42.92 41.44 1uz0 s ASP 38 CO 0.00 -2.63 0.57 -1.66 0.21 0.00 0.00 175.17 171.65 1uz0 s TRP 39 N -2.64 -0.48 -0.01 4.23 1.48 -0.86 -1.20 118.94 119.46 1uz0 s TRP 39 Ca 0.66 0.41 0.04 0.00 -1.06 0.00 0.00 56.10 56.15 1uz0 s TRP 39 Cb -0.22 0.45 -0.01 0.00 -1.16 0.00 0.00 33.47 32.53 1uz0 s TRP 39 CO 0.55 -0.75 -0.12 -0.51 -4.06 0.00 0.00 176.95 172.06 1uz0 s LEU 40 N -2.37 2.00 -0.04 -4.66 1.43 -0.36 -0.98 118.68 113.71 1uz0 s LEU 40 Ca -0.02 -0.22 0.07 0.00 -1.03 0.00 0.00 54.13 52.93 1uz0 s LEU 40 Cb -0.00 -0.63 -0.02 0.00 0.03 0.00 0.00 46.19 45.56 1uz0 s LEU 40 CO -0.07 0.15 -0.24 -0.55 0.23 0.00 0.00 176.35 175.86 1uz0 s SER 41 N -0.25 3.18 -0.26 2.29 0.15 0.11 -1.10 113.70 117.82 1uz0 s SER 41 Ca 0.04 -0.45 0.09 0.00 0.70 0.00 0.00 55.95 56.34 1uz0 s SER 41 Cb -0.05 -0.56 0.47 0.00 -1.71 0.00 0.00 66.02 64.16 1uz0 s SER 41 CO -0.00 0.30 1.36 -1.22 1.20 0.00 0.00 173.24 174.87 1uz0 n TYR 42 N 2.59 0.68 0.26 3.44 4.02 0.49 -0.72 117.16 127.92 1uz0 n TYR 42 Ca -0.17 -1.60 0.10 0.00 -0.01 0.00 0.00 57.90 56.23 1uz0 n TYR 42 Cb 0.51 -0.39 0.69 0.00 -0.02 0.00 0.00 39.34 40.13 1uz0 n TYR 42 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1uz0 h ALA 43 N 1.04 1.56 0.00 -0.72 0.00 -1.90 -1.33 119.26 117.91 1uz0 h ALA 43 Ca 0.14 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.95 1uz0 h ALA 43 Cb 1.37 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.15 1uz0 h ALA 43 CO 0.24 0.12 0.00 0.41 0.00 0.00 0.00 179.25 180.03 1uz0 n GLY 44 N -1.04 -1.35 2.62 0.00 0.00 -1.26 -3.91 105.19 100.25 1uz0 n GLY 44 Ca -0.02 0.08 -0.28 0.00 0.00 0.00 0.00 46.02 45.80 1uz0 n GLY 44 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1uz0 s THR 45 N -3.31 1.44 0.53 2.61 -4.23 -0.50 -5.07 115.64 107.12 1uz0 s THR 45 Ca 0.05 -3.29 -0.21 0.00 -1.18 0.00 0.00 61.69 57.06 1uz0 s THR 45 Cb 0.10 -1.97 -0.06 0.00 1.34 0.00 0.00 72.50 71.90 1uz0 s THR 45 CO 0.43 -1.11 1.17 -2.65 -0.54 0.00 0.00 174.62 171.91 1uz0 n PRO 46 N 2.56 1.39 -4.34 3.99 -0.02 -1.25 -4.82 135.00 132.52 1uz0 n PRO 46 Ca 0.24 0.52 -0.32 0.00 -2.02 0.00 0.00 63.50 61.92 1uz0 n PRO 46 Cb 0.42 -2.34 -0.16 0.00 -0.02 0.00 0.00 33.50 31.39 1uz0 n PRO 46 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1uz0 s VAL 47 N -1.35 1.87 -0.11 -1.45 1.01 0.42 -4.94 120.40 115.84 1uz0 s VAL 47 Ca 0.71 -0.84 -0.29 0.00 0.00 0.00 0.00 61.98 61.55 1uz0 s VAL 47 Cb -0.45 -1.69 -0.01 0.00 0.00 0.00 0.00 36.38 34.23 1uz0 s VAL 47 CO 0.50 0.51 1.00 0.20 0.00 0.00 0.00 175.10 177.32 1uz0 s ASN 48 N 1.12 7.23 -0.34 3.32 0.01 -1.26 -0.73 114.94 124.30 1uz0 s ASN 48 Ca -0.01 1.52 -0.13 0.00 -0.71 0.00 0.00 52.86 53.53 1uz0 s ASN 48 Cb -0.14 -2.55 -0.02 0.00 0.41 0.00 0.00 41.25 38.95 1uz0 s ASN 48 CO -0.07 -0.46 0.23 -0.63 -1.51 0.00 0.00 177.10 174.66 1uz0 s ILE 49 N 2.08 5.22 0.28 0.60 -1.09 0.12 -4.96 121.20 123.44 1uz0 s ILE 49 Ca 0.48 -0.23 0.12 0.00 -2.23 0.00 0.00 60.65 58.79 1uz0 s ILE 49 Cb -0.18 -3.68 0.01 0.00 -1.58 0.00 0.00 42.46 37.03 1uz0 s ILE 49 CO 0.17 0.00 1.66 1.55 -1.23 0.00 0.00 174.94 177.09 1uz0 h PRO 50 N 8.47 0.00 -2.80 2.79 0.13 -1.92 0.11 132.00 138.78 1uz0 h PRO 50 Ca -0.31 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.71 1uz0 h PRO 50 Cb 1.16 0.00 -0.20 0.00 0.13 0.00 0.00 31.00 32.09 1uz0 h PRO 50 CO 0.63 0.55 -0.17 -1.54 -0.23 0.00 0.00 178.00 177.24 1uz0 s SER 51 N -6.81 -0.30 -0.05 1.44 1.04 -1.26 -4.81 113.70 102.95 1uz0 s SER 51 Ca -0.01 0.24 -0.30 0.00 0.48 0.00 0.00 55.95 56.36 1uz0 s SER 51 Cb 0.13 0.37 -0.03 0.00 0.10 0.00 0.00 66.02 66.59 1uz0 s SER 51 CO 0.75 -0.48 1.13 -0.44 0.98 0.00 0.00 173.24 175.19 1uz0 s SER 52 N -1.26 7.13 0.00 7.02 0.01 -1.26 -4.22 113.70 121.12 1uz0 s SER 52 Ca -0.13 1.75 0.00 0.00 1.31 0.00 0.00 55.95 58.88 1uz0 s SER 52 Cb -0.04 -2.56 0.00 0.00 0.21 0.00 0.00 66.02 63.63 1uz0 s SER 52 CO 0.05 -0.51 0.00 0.61 0.41 0.00 0.00 173.24 173.80 1uz0 n GLY 53 N 3.24 -0.58 3.74 3.44 0.00 -0.62 -4.91 105.19 109.51 1uz0 n GLY 53 Ca 0.10 -1.25 -0.40 0.00 0.00 0.00 0.00 46.02 44.46 1uz0 n GLY 53 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1uz0 s SER 54 N -4.00 7.38 -0.04 1.61 1.04 -1.26 -1.35 113.70 117.09 1uz0 s SER 54 Ca 0.00 1.65 0.04 0.00 0.48 0.00 0.00 55.95 58.12 1uz0 s SER 54 Cb 0.00 -2.53 -0.00 0.00 0.10 0.00 0.00 66.02 63.58 1uz0 s SER 54 CO 0.00 -0.01 -0.14 -0.31 0.98 0.00 0.00 173.24 173.76 1uz0 s TYR 55 N -0.15 1.45 -0.24 5.02 1.51 0.83 -2.51 117.35 123.27 1uz0 s TYR 55 Ca 0.42 -0.40 -0.21 0.00 -1.01 0.00 0.00 57.07 55.88 1uz0 s TYR 55 Cb -0.22 -0.99 -0.02 0.00 -0.11 0.00 0.00 41.96 40.62 1uz0 s TYR 55 CO 0.27 -0.14 0.64 -1.17 -1.11 0.00 0.00 175.55 174.03 1uz0 s LEU 56 N 0.10 4.08 -0.20 -1.29 2.96 0.05 -0.75 118.68 123.63 1uz0 s LEU 56 Ca -0.04 0.75 -0.06 0.00 -0.22 0.00 0.00 54.13 54.56 1uz0 s LEU 56 Cb -0.11 -2.87 -0.03 0.00 0.50 0.00 0.00 46.19 43.68 1uz0 s LEU 56 CO 0.02 -0.36 0.03 -0.63 -1.32 0.00 0.00 176.35 174.09 1uz0 s ILE 57 N 2.40 4.27 -0.08 6.68 -1.09 -0.04 -0.97 121.20 132.38 1uz0 s ILE 57 Ca 0.27 -0.21 0.01 0.00 -2.23 0.00 0.00 60.65 58.50 1uz0 s ILE 57 Cb -0.16 -2.94 -0.03 0.00 -1.58 0.00 0.00 42.46 37.76 1uz0 s ILE 57 CO 0.09 0.42 -0.11 -1.61 -1.23 0.00 0.00 174.94 172.50 1uz0 s GLU 58 N 0.89 2.84 -0.09 2.79 2.02 0.31 -1.90 118.70 125.55 1uz0 s GLU 58 Ca 0.02 -0.63 0.02 0.00 0.02 0.00 0.00 54.97 54.40 1uz0 s GLU 58 Cb -0.14 -2.54 0.01 0.00 0.10 0.00 0.00 34.13 31.56 1uz0 s GLU 58 CO 0.02 0.53 -0.14 0.71 0.02 0.00 0.00 175.26 176.41 1uz0 s TYR 59 N -0.48 1.78 -0.45 1.61 1.51 -0.14 -0.42 117.35 120.76 1uz0 s TYR 59 Ca 0.07 -0.76 -0.19 0.00 -1.01 0.00 0.00 57.07 55.17 1uz0 s TYR 59 Cb -0.12 -1.29 0.03 0.00 -0.11 0.00 0.00 41.96 40.48 1uz0 s TYR 59 CO 0.02 -0.39 0.57 0.50 -1.11 0.00 0.00 175.55 175.14 1uz0 s ARG 60 N 0.84 3.17 0.13 -0.62 6.06 -0.71 -1.24 118.95 126.58 1uz0 s ARG 60 Ca -0.10 -0.64 0.05 0.00 -2.50 0.00 0.00 55.73 52.54 1uz0 s ARG 60 Cb -0.15 -4.00 -0.04 0.00 0.06 0.00 0.00 34.95 30.82 1uz0 s ARG 60 CO 0.01 -1.02 -0.12 0.14 -2.50 0.00 0.00 175.30 171.82 1uz0 s VAL 61 N 2.55 1.21 -0.01 7.11 -7.23 -0.14 -0.24 120.40 123.64 1uz0 s VAL 61 Ca 0.17 -1.84 -0.03 0.00 -1.81 0.00 0.00 61.98 58.48 1uz0 s VAL 61 Cb -0.16 -1.62 0.00 0.00 0.56 0.00 0.00 36.38 35.16 1uz0 s VAL 61 CO 0.15 -0.57 0.06 0.00 -0.31 0.00 0.00 175.10 174.43 1uz0 s ALA 62 N -2.64 -0.14 -0.21 1.32 0.00 -1.03 -1.10 121.76 117.96 1uz0 s ALA 62 Ca 0.11 -0.01 -0.07 0.00 0.00 0.00 0.00 51.96 51.99 1uz0 s ALA 62 Cb -0.02 -0.03 0.09 0.00 0.00 0.00 0.00 23.12 23.17 1uz0 s ALA 62 CO 0.02 -0.08 0.45 0.45 0.00 0.00 0.00 175.76 176.59 1uz0 s SER 63 N -0.48 -0.37 0.11 0.00 0.15 -1.21 -0.17 113.70 111.72 1uz0 s SER 63 Ca -0.05 1.06 -0.24 0.00 0.70 0.00 0.00 55.95 57.42 1uz0 s SER 63 Cb -0.03 1.44 -0.09 0.00 -1.71 0.00 0.00 66.02 65.63 1uz0 s SER 63 CO 0.00 -0.23 1.68 -0.61 1.20 0.00 0.00 173.24 175.29 1uz0 h GLN 64 N 8.11 -0.22 0.00 5.44 4.15 -1.73 0.24 115.11 131.10 1uz0 h GLN 64 Ca -0.17 0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.27 1uz0 h GLN 64 Cb 1.11 0.05 0.00 0.00 0.21 0.00 0.00 27.48 28.85 1uz0 h GLN 64 CO 0.12 -0.15 0.00 0.09 -1.93 0.00 0.00 178.83 176.97 1uz0 n ASN 65 N -5.26 0.55 -0.11 -0.69 3.02 -1.26 -3.47 115.26 108.04 1uz0 n ASN 65 Ca -0.06 -0.78 0.00 0.00 -0.03 0.00 0.00 54.58 53.72 1uz0 n ASN 65 Cb 0.18 0.42 -0.00 0.00 -0.61 0.00 0.00 39.78 39.77 1uz0 n ASN 65 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1uz0 n GLY 66 N 0.42 -2.01 1.07 7.41 0.00 -1.26 -4.80 105.19 106.03 1uz0 n GLY 66 Ca 0.00 -1.40 0.00 0.00 0.00 0.00 0.00 46.02 44.62 1uz0 n GLY 66 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1uz0 n GLY 67 N -0.18 0.70 3.88 -0.02 0.00 -1.25 -4.80 105.19 103.51 1uz0 n GLY 67 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 1uz0 n GLY 67 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1uz0 s GLY 68 N -1.43 1.84 -0.15 -0.02 0.00 -1.22 -4.58 107.32 101.76 1uz0 s GLY 68 Ca 0.00 -0.23 -0.13 0.00 0.00 0.00 0.00 44.72 44.36 1uz0 s GLY 68 CO 0.00 -0.03 0.39 -0.45 0.00 0.00 0.00 173.10 173.00 1uz0 s SER 69 N -3.43 -0.41 0.09 1.64 0.15 -1.03 -0.93 113.70 109.77 1uz0 s SER 69 Ca 0.51 0.79 0.05 0.00 0.70 0.00 0.00 55.95 58.00 1uz0 s SER 69 Cb -0.10 0.78 -0.03 0.00 -1.71 0.00 0.00 66.02 64.95 1uz0 s SER 69 CO 0.36 -0.14 -0.14 -1.48 1.20 0.00 0.00 173.24 173.04 1uz0 s LEU 70 N 0.36 2.33 -0.12 3.45 0.05 -0.61 -0.53 118.68 123.62 1uz0 s LEU 70 Ca -0.01 -0.70 0.00 0.00 0.05 0.00 0.00 54.13 53.47 1uz0 s LEU 70 Cb -0.04 -0.53 -0.02 0.00 -2.05 0.00 0.00 46.19 43.56 1uz0 s LEU 70 CO -0.01 -0.11 -0.13 -0.89 -0.55 0.00 0.00 176.35 174.66 1uz0 s THR 71 N -1.67 3.11 -0.24 5.48 2.01 0.19 -1.05 115.64 123.46 1uz0 s THR 71 Ca 0.03 -0.65 -0.16 0.00 0.31 0.00 0.00 61.69 61.22 1uz0 s THR 71 Cb -0.08 -2.29 -0.04 0.00 0.01 0.00 0.00 72.50 70.10 1uz0 s THR 71 CO 0.02 0.53 0.40 0.12 -0.69 0.00 0.00 174.62 175.01 1uz0 s PHE 72 N 0.19 3.30 0.30 4.92 5.36 0.65 -1.23 117.98 131.47 1uz0 s PHE 72 Ca -0.07 0.52 0.00 0.00 -0.96 0.00 0.00 56.93 56.42 1uz0 s PHE 72 Cb -0.15 -2.57 -0.02 0.00 -0.34 0.00 0.00 43.02 39.94 1uz0 s PHE 72 CO 0.05 -0.14 0.33 -1.83 -1.46 0.00 0.00 175.22 172.17 1uz0 s GLU 73 N 1.76 1.66 0.17 10.12 -1.05 -0.59 -0.30 118.70 130.48 1uz0 s GLU 73 Ca 0.17 -1.77 -0.29 0.00 -0.15 0.00 0.00 54.97 52.93 1uz0 s GLU 73 Cb -0.15 0.37 -0.08 0.00 -0.44 0.00 0.00 34.13 33.83 1uz0 s GLU 73 CO 0.09 -0.64 0.90 -2.00 0.95 0.00 0.00 175.26 174.56 1uz0 s GLU 74 N -3.53 4.73 0.01 -4.83 2.56 -0.58 -0.91 118.70 116.16 1uz0 s GLU 74 Ca 0.35 1.38 -0.36 0.00 0.00 0.00 0.00 54.97 56.35 1uz0 s GLU 74 Cb 0.02 -3.31 -0.15 0.00 2.00 0.00 0.00 34.13 32.70 1uz0 s GLU 74 CO 0.20 0.42 1.60 0.00 -0.56 0.00 0.00 175.26 176.93 1uz0 n ALA 75 N 1.98 0.30 0.00 6.30 0.00 1.00 -0.97 120.51 129.12 1uz0 n ALA 75 Ca -0.01 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.85 1uz0 n ALA 75 Cb 0.48 -2.28 0.00 0.00 0.00 0.00 0.00 19.45 17.65 1uz0 n ALA 75 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1uz0 n GLY 76 N 3.50 2.59 0.00 0.00 0.00 -1.26 -4.67 105.19 105.35 1uz0 n GLY 76 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.22 1uz0 n GLY 76 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1uz0 n GLY 77 N -0.72 0.60 3.53 -0.02 0.00 -0.15 -5.08 105.19 103.35 1uz0 n GLY 77 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 1uz0 n GLY 77 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uz0 s ALA 78 N -2.00 -1.55 0.86 4.61 0.00 -1.22 -4.39 121.76 118.07 1uz0 s ALA 78 Ca 0.00 1.81 -0.11 0.00 0.00 0.00 0.00 51.96 53.66 1uz0 s ALA 78 Cb 0.00 -1.06 0.11 0.00 0.00 0.00 0.00 23.12 22.17 1uz0 s ALA 78 CO 0.00 -0.30 1.09 -1.25 0.00 0.00 0.00 175.76 175.30 1uz0 s PRO 79 N 0.51 1.51 0.07 0.00 0.04 -1.26 -4.64 135.00 131.22 1uz0 s PRO 79 Ca -0.01 0.95 -0.17 0.00 0.04 0.00 0.00 61.00 61.81 1uz0 s PRO 79 Cb -0.05 -1.83 -0.06 0.00 0.04 0.00 0.00 34.50 32.60 1uz0 s PRO 79 CO -0.02 -2.10 0.51 0.08 0.04 0.00 0.00 177.00 175.51 1uz0 s VAL 80 N -2.91 4.86 -0.22 -0.36 1.01 -1.26 -1.52 120.40 120.00 1uz0 s VAL 80 Ca 0.63 1.00 0.01 0.00 0.00 0.00 0.00 61.98 63.61 1uz0 s VAL 80 Cb -0.18 -3.80 -0.14 0.00 0.00 0.00 0.00 36.38 32.26 1uz0 s VAL 80 CO 0.57 0.49 -0.20 1.41 0.00 0.00 0.00 175.10 177.37 1uz0 n HIS 81 N 1.53 0.00 -3.59 5.22 8.25 0.58 -4.97 115.22 122.25 1uz0 n HIS 81 Ca -0.10 0.00 0.01 0.00 -0.26 0.00 0.00 57.72 57.37 1uz0 n HIS 81 Cb 0.51 -0.85 -0.01 0.00 1.12 0.00 0.00 29.99 30.77 1uz0 n HIS 81 CO 0.00 0.00 0.00 0.20 0.64 0.00 0.00 176.34 177.18 1uz0 s GLY 82 N -6.08 -0.40 0.13 -1.41 0.00 -0.86 -4.65 107.32 94.05 1uz0 s GLY 82 Ca -0.30 1.11 0.08 0.00 0.00 0.00 0.00 44.72 45.62 1uz0 s GLY 82 CO 0.50 0.28 -0.19 -0.51 0.00 0.00 0.00 173.10 173.18 1uz0 s THR 83 N -2.19 1.71 -0.12 0.90 -4.23 -1.26 -0.25 115.64 110.20 1uz0 s THR 83 Ca 0.14 -1.69 -0.12 0.00 -1.18 0.00 0.00 61.69 58.83 1uz0 s THR 83 Cb 0.04 -1.65 0.03 0.00 1.34 0.00 0.00 72.50 72.26 1uz0 s THR 83 CO -0.05 -0.19 0.33 -0.51 -0.54 0.00 0.00 174.62 173.66 1uz0 s ILE 84 N -1.57 0.01 0.26 2.99 2.07 -0.22 -5.00 121.20 119.73 1uz0 s ILE 84 Ca 0.10 -0.04 -0.24 0.00 -1.41 0.00 0.00 60.65 59.06 1uz0 s ILE 84 Cb -0.08 -0.48 -0.09 0.00 0.13 0.00 0.00 42.46 41.94 1uz0 s ILE 84 CO 0.05 -0.02 0.84 0.00 -1.91 0.00 0.00 174.94 173.90 1uz0 s ALA 85 N 0.05 3.33 -0.27 1.50 0.00 -1.26 -1.57 121.76 123.53 1uz0 s ALA 85 Ca -0.01 0.38 -0.10 0.00 0.00 0.00 0.00 51.96 52.23 1uz0 s ALA 85 Cb -0.03 -3.02 -0.04 0.00 0.00 0.00 0.00 23.12 20.03 1uz0 s ALA 85 CO 0.01 0.25 0.15 0.42 0.00 0.00 0.00 175.76 176.59 1uz0 s ILE 86 N -1.48 4.98 0.69 0.00 1.09 -0.10 -4.96 121.20 121.42 1uz0 s ILE 86 Ca 0.45 0.06 -0.11 0.00 -1.10 0.00 0.00 60.65 59.94 1uz0 s ILE 86 Cb -0.19 -3.36 0.00 0.00 -1.06 0.00 0.00 42.46 37.85 1uz0 s ILE 86 CO 0.24 0.28 1.07 -2.16 -0.10 0.00 0.00 174.94 174.27 1uz0 s PRO 87 N 1.69 3.00 0.21 2.79 0.04 -1.26 -3.69 135.00 137.78 1uz0 s PRO 87 Ca 0.07 0.61 -0.30 0.00 0.04 0.00 0.00 61.00 61.42 1uz0 s PRO 87 Cb -0.16 -2.02 -0.09 0.00 0.04 0.00 0.00 34.50 32.27 1uz0 s PRO 87 CO 0.08 -0.97 1.31 0.00 0.04 0.00 0.00 177.00 177.47 1uz0 s ALA 88 N -3.25 3.53 -0.91 8.56 0.00 -1.26 -4.51 121.76 123.91 1uz0 s ALA 88 Ca 0.57 1.12 0.15 0.00 0.00 0.00 0.00 51.96 53.81 1uz0 s ALA 88 Cb -0.12 -3.48 -0.13 0.00 0.00 0.00 0.00 23.12 19.39 1uz0 s ALA 88 CO 0.53 -0.54 0.70 0.25 0.00 0.00 0.00 175.76 176.70 1uz0 n THR 89 N 2.52 0.00 -0.35 0.00 -2.24 0.79 -4.94 114.28 110.05 1uz0 n THR 89 Ca 0.06 -0.19 0.00 0.00 -2.27 0.00 0.00 64.05 61.65 1uz0 n THR 89 Cb 0.43 1.05 0.00 0.00 -2.10 0.00 0.00 70.33 69.70 1uz0 n THR 89 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1uz0 n GLY 90 N 1.31 1.01 3.45 3.38 0.00 -0.74 -4.88 105.19 108.73 1uz0 n GLY 90 Ca 0.04 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.89 1uz0 n GLY 90 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1uz0 s GLY 91 N -1.67 -0.48 0.63 -0.02 0.00 -1.24 -4.80 107.32 99.74 1uz0 s GLY 91 Ca 0.00 1.02 0.40 0.00 0.00 0.00 0.00 44.72 46.14 1uz0 s GLY 91 CO 0.00 0.70 2.27 1.49 0.00 0.00 0.00 173.10 177.56 1uz0 h TRP 92 N 3.10 0.00 -0.21 1.90 -0.00 -1.92 -2.53 115.95 116.29 1uz0 h TRP 92 Ca -0.28 0.00 -0.18 0.00 -0.00 0.00 0.00 58.89 58.43 1uz0 h TRP 92 Cb 1.16 0.00 -0.21 0.00 -0.00 0.00 0.00 29.16 30.11 1uz0 h TRP 92 CO 0.40 0.01 -0.74 1.04 -0.00 0.00 0.00 178.44 179.15 1uz0 n GLN 93 N -3.20 1.73 -3.66 0.49 1.13 -1.26 -4.75 117.38 107.86 1uz0 n GLN 93 Ca -0.02 -3.26 -0.39 0.00 -1.94 0.00 0.00 57.00 51.39 1uz0 n GLN 93 Cb 0.13 -1.44 -0.12 0.00 0.11 0.00 0.00 30.24 28.92 1uz0 n GLN 93 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 1uz0 s THR 94 N -2.94 4.24 0.00 5.09 2.01 -0.96 -4.76 115.64 118.32 1uz0 s THR 94 Ca 0.39 -0.98 -0.01 0.00 0.31 0.00 0.00 61.69 61.41 1uz0 s THR 94 Cb 0.38 -3.38 -0.04 0.00 0.01 0.00 0.00 72.50 69.47 1uz0 s THR 94 CO -0.06 -0.21 0.11 0.26 -0.69 0.00 0.00 174.62 174.02 1uz0 s TRP 95 N 1.49 3.35 0.08 4.92 0.52 -1.26 -4.26 118.94 123.77 1uz0 s TRP 95 Ca 0.00 0.24 -0.09 0.00 0.02 0.00 0.00 56.10 56.27 1uz0 s TRP 95 Cb -0.19 -1.75 -0.00 0.00 -1.15 0.00 0.00 33.47 30.37 1uz0 s TRP 95 CO 0.05 0.57 0.19 -0.08 0.02 0.00 0.00 176.95 177.71 1uz0 s THR 96 N -1.25 0.14 -0.23 2.01 -1.32 -0.26 -4.99 115.64 109.73 1uz0 s THR 96 Ca 0.25 -1.12 -0.07 0.00 -1.21 0.00 0.00 61.69 59.54 1uz0 s THR 96 Cb -0.12 -1.25 -0.03 0.00 -1.51 0.00 0.00 72.50 69.59 1uz0 s THR 96 CO 0.16 -0.62 0.05 -0.89 -2.21 0.00 0.00 174.62 171.11 1uz0 s THR 97 N -3.58 4.21 0.28 5.08 2.01 -1.26 -0.97 115.64 121.40 1uz0 s THR 97 Ca 0.03 -0.21 0.07 0.00 0.31 0.00 0.00 61.69 61.89 1uz0 s THR 97 Cb 0.04 -2.95 -0.03 0.00 0.01 0.00 0.00 72.50 69.56 1uz0 s THR 97 CO -0.09 0.37 0.22 0.27 -0.69 0.00 0.00 174.62 174.69 1uz0 s ILE 98 N 1.43 4.15 -0.06 1.82 -4.36 -0.38 -4.95 121.20 118.85 1uz0 s ILE 98 Ca 0.05 -1.41 -0.06 0.00 -0.26 0.00 0.00 60.65 58.97 1uz0 s ILE 98 Cb -0.15 -3.32 0.02 0.00 1.25 0.00 0.00 42.46 40.26 1uz0 s ILE 98 CO 0.03 -0.30 0.18 -1.10 0.24 0.00 0.00 174.94 173.99 1uz0 s GLN 99 N -3.88 0.24 0.09 0.37 -0.21 -1.26 -0.96 119.66 114.03 1uz0 s GLN 99 Ca 0.35 0.21 -0.11 0.00 0.02 0.00 0.00 55.36 55.83 1uz0 s GLN 99 Cb -0.07 0.11 0.01 0.00 1.00 0.00 0.00 33.01 34.06 1uz0 s GLN 99 CO 0.25 -0.03 0.25 -3.38 -2.12 0.00 0.00 175.29 170.26 1uz0 s HIS 100 N -0.01 0.04 -0.09 0.91 -3.43 -0.80 -5.01 115.29 106.90 1uz0 s HIS 100 Ca -0.01 -0.41 -0.04 0.00 -0.80 0.00 0.00 55.06 53.80 1uz0 s HIS 100 Cb -0.02 0.03 -0.04 0.00 -1.43 0.00 0.00 32.58 31.12 1uz0 s HIS 100 CO 0.00 -0.57 0.05 0.95 -2.00 0.00 0.00 174.74 173.18 1uz0 s THR 101 N -3.63 4.75 0.30 -5.38 -4.23 -1.26 -0.86 115.64 105.34 1uz0 s THR 101 Ca 0.03 -0.09 0.05 0.00 -1.18 0.00 0.00 61.69 60.50 1uz0 s THR 101 Cb 0.03 -3.03 -0.06 0.00 1.34 0.00 0.00 72.50 70.78 1uz0 s THR 101 CO -0.10 0.60 -0.00 0.68 -0.54 0.00 0.00 174.62 175.26 1uz0 s VAL 102 N -0.95 1.46 -0.16 2.29 -7.23 0.07 -4.95 120.40 110.93 1uz0 s VAL 102 Ca 0.14 -2.06 0.00 0.00 -1.81 0.00 0.00 61.98 58.25 1uz0 s VAL 102 Cb -0.12 -2.62 -0.00 0.00 0.56 0.00 0.00 36.38 34.20 1uz0 s VAL 102 CO 0.03 -0.16 -0.15 0.20 -0.31 0.00 0.00 175.10 174.71 1uz0 s ASN 103 N -3.47 3.67 0.05 4.85 0.01 -1.26 -0.12 114.94 118.67 1uz0 s ASN 103 Ca 0.33 -0.47 0.09 0.00 -0.71 0.00 0.00 52.86 52.09 1uz0 s ASN 103 Cb 0.06 -1.57 -0.03 0.00 0.41 0.00 0.00 41.25 40.13 1uz0 s ASN 103 CO 0.14 0.08 -0.26 -0.76 -1.51 0.00 0.00 177.10 174.78 1uz0 s LEU 104 N 0.87 2.17 0.29 0.60 1.43 -0.45 -4.93 118.68 118.66 1uz0 s LEU 104 Ca -0.04 -0.59 -0.28 0.00 -1.03 0.00 0.00 54.13 52.19 1uz0 s LEU 104 Cb -0.15 -1.25 -0.09 0.00 0.03 0.00 0.00 46.19 44.73 1uz0 s LEU 104 CO -0.01 0.25 0.99 -0.94 0.23 0.00 0.00 176.35 176.87 1uz0 s SER 105 N -1.25 7.36 0.41 2.29 1.04 -1.26 -1.58 113.70 120.71 1uz0 s SER 105 Ca 0.11 2.00 -0.26 0.00 0.48 0.00 0.00 55.95 58.28 1uz0 s SER 105 Cb -0.10 -2.60 -0.10 0.00 0.10 0.00 0.00 66.02 63.32 1uz0 s SER 105 CO 0.02 -0.05 1.33 0.00 0.98 0.00 0.00 173.24 175.51 1uz0 n ALA 106 N 0.96 1.55 0.00 5.32 0.00 -1.26 -4.79 120.51 122.28 1uz0 n ALA 106 Ca 0.00 0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.72 1uz0 n ALA 106 Cb 0.48 -2.30 0.00 0.00 0.00 0.00 0.00 19.45 17.62 1uz0 n ALA 106 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1uz0 n GLY 107 N 0.73 0.71 3.66 0.00 0.00 0.39 -4.95 105.19 105.73 1uz0 n GLY 107 Ca 0.06 -2.06 -0.42 0.00 0.00 0.00 0.00 46.02 43.60 1uz0 n GLY 107 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1uz0 s SER 108 N -4.00 6.98 0.11 1.61 0.15 -1.26 -0.71 113.70 116.58 1uz0 s SER 108 Ca 0.00 1.21 0.07 0.00 0.70 0.00 0.00 55.95 57.93 1uz0 s SER 108 Cb 0.00 -2.48 -0.04 0.00 -1.71 0.00 0.00 66.02 61.79 1uz0 s SER 108 CO 0.00 -0.51 -0.07 -1.00 1.20 0.00 0.00 173.24 172.87 1uz0 s HIS 109 N 2.63 2.80 -0.22 3.44 4.02 0.10 -4.95 115.29 123.10 1uz0 s HIS 109 Ca 0.39 -0.13 0.01 0.00 1.02 0.00 0.00 55.06 56.35 1uz0 s HIS 109 Cb -0.16 -1.44 0.03 0.00 -1.02 0.00 0.00 32.58 29.99 1uz0 s HIS 109 CO 0.10 0.45 -0.14 -0.65 1.02 0.00 0.00 174.74 175.52 1uz0 s GLN 110 N -2.35 2.74 0.19 1.40 -0.21 -1.26 -0.44 119.66 119.72 1uz0 s GLN 110 Ca 0.23 -1.01 0.01 0.00 0.02 0.00 0.00 55.36 54.61 1uz0 s GLN 110 Cb -0.11 -2.77 -0.04 0.00 1.00 0.00 0.00 33.01 31.09 1uz0 s GLN 110 CO 0.15 -0.36 0.34 -0.06 -2.12 0.00 0.00 175.29 173.25 1uz0 s PHE 111 N 1.25 3.48 0.09 0.91 2.99 -1.26 -0.00 117.98 125.43 1uz0 s PHE 111 Ca -0.00 0.21 -0.02 0.00 0.00 0.00 0.00 56.93 57.11 1uz0 s PHE 111 Cb -0.16 -1.74 -0.03 0.00 0.00 0.00 0.00 43.02 41.08 1uz0 s PHE 111 CO -0.08 0.44 0.05 0.20 -0.00 0.00 0.00 175.22 175.82 1uz0 s GLY 112 N -3.30 0.59 -0.05 4.36 0.00 -0.09 -0.38 107.32 108.45 1uz0 s GLY 112 Ca 0.36 -1.20 0.02 0.00 0.00 0.00 0.00 44.72 43.91 1uz0 s GLY 112 CO 0.29 -1.24 -0.09 -0.42 0.00 0.00 0.00 173.10 171.64 1uz0 s ILE 113 N -3.96 0.89 -0.10 0.90 1.01 -0.26 -1.54 121.20 118.15 1uz0 s ILE 113 Ca 0.13 -0.35 0.03 0.00 0.00 0.00 0.00 60.65 60.46 1uz0 s ILE 113 Cb 0.07 -0.83 -0.01 0.00 0.01 0.00 0.00 42.46 41.70 1uz0 s ILE 113 CO -0.06 0.30 -0.21 -0.75 0.00 0.00 0.00 174.94 174.22 1uz0 s LYS 114 N 0.65 3.00 -0.40 2.79 2.47 -0.37 -1.22 119.74 126.67 1uz0 s LYS 114 Ca -0.12 -0.83 -0.28 0.00 -1.56 0.00 0.00 55.97 53.18 1uz0 s LYS 114 Cb -0.14 -2.35 0.02 0.00 -1.46 0.00 0.00 37.83 33.90 1uz0 s LYS 114 CO 0.02 0.25 1.06 0.00 0.16 0.00 0.00 175.35 176.84 1uz0 s ALA 115 N 0.19 3.32 0.12 3.13 0.00 -0.34 -0.64 121.76 127.55 1uz0 s ALA 115 Ca -0.13 -0.36 -0.00 0.00 0.00 0.00 0.00 51.96 51.47 1uz0 s ALA 115 Cb -0.16 -3.73 -0.14 0.00 0.00 0.00 0.00 23.12 19.08 1uz0 s ALA 115 CO 0.07 -1.86 1.27 -0.91 0.00 0.00 0.00 175.76 174.33 1uz0 h ASN 116 N 8.69 0.33 -5.00 0.00 2.35 -1.13 0.18 115.58 120.99 1uz0 h ASN 116 Ca -0.22 -0.30 -0.13 0.00 -0.55 0.00 0.00 56.30 55.10 1uz0 h ASN 116 Cb 1.07 -0.10 -0.20 0.00 0.05 0.00 0.00 38.32 39.14 1uz0 h ASN 116 CO 1.06 1.17 -0.39 0.00 -1.65 0.00 0.00 177.43 177.61 1uz0 s ALA 117 N -2.96 -0.49 0.53 -0.83 0.00 -1.11 -4.55 121.76 112.35 1uz0 s ALA 117 Ca -0.03 -0.01 0.00 0.00 0.00 0.00 0.00 51.96 51.92 1uz0 s ALA 117 Cb 0.09 0.14 0.00 0.00 0.00 0.00 0.00 23.12 23.35 1uz0 s ALA 117 CO 0.85 -0.26 0.00 0.41 0.00 0.00 0.00 175.76 176.76 1uz0 n GLY 118 N 1.22 0.40 0.63 0.00 0.00 -1.26 -2.48 105.19 103.70 1uz0 n GLY 118 Ca -0.22 -1.86 0.00 0.00 0.00 0.00 0.00 46.02 43.95 1uz0 n GLY 118 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1uz0 n GLY 119 N 5.00 0.81 3.05 -0.02 0.00 -1.03 -3.39 105.19 109.60 1uz0 n GLY 119 Ca 0.00 -0.33 -0.09 0.00 0.00 0.00 0.00 46.02 45.60 1uz0 n GLY 119 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1uz0 s TRP 120 N -2.00 0.25 0.23 1.61 1.48 -1.26 -4.19 118.94 115.06 1uz0 s TRP 120 Ca 0.00 -0.54 0.08 0.00 -1.06 0.00 0.00 56.10 54.58 1uz0 s TRP 120 Cb 0.00 -0.19 -0.04 0.00 -1.16 0.00 0.00 33.47 32.08 1uz0 s TRP 120 CO 0.00 -0.27 0.08 -0.80 -4.06 0.00 0.00 176.95 171.90 1uz0 s ASN 121 N -1.82 5.03 -0.08 -2.66 0.02 0.76 -4.24 114.94 111.95 1uz0 s ASN 121 Ca -0.10 -0.41 -0.01 0.00 -1.02 0.00 0.00 52.86 51.32 1uz0 s ASN 121 Cb -0.05 -1.13 0.03 0.00 0.02 0.00 0.00 41.25 40.11 1uz0 s ASN 121 CO -0.03 0.01 -0.02 -0.22 0.02 0.00 0.00 177.10 176.87 1uz0 s LEU 122 N -3.54 0.76 -0.19 0.60 2.96 -0.24 -2.46 118.68 116.58 1uz0 s LEU 122 Ca 0.31 -0.14 -0.22 0.00 -0.22 0.00 0.00 54.13 53.86 1uz0 s LEU 122 Cb -0.08 -0.53 -0.20 0.00 0.50 0.00 0.00 46.19 45.88 1uz0 s LEU 122 CO 0.22 -0.17 0.32 -1.13 -1.32 0.00 0.00 176.35 174.27 1uz0 h ASN 123 N 8.23 0.00 -5.03 3.68 -1.24 -0.91 -0.42 115.58 119.90 1uz0 h ASN 123 Ca -0.23 -0.59 0.08 0.00 0.71 0.00 0.00 56.30 56.27 1uz0 h ASN 123 Cb 1.13 0.00 -0.05 0.00 0.73 0.00 0.00 38.32 40.13 1uz0 h ASN 123 CO 0.30 1.33 0.25 -1.66 -1.29 0.00 0.00 177.43 176.37 1uz0 s TRP 124 N -2.31 -0.18 -0.01 0.67 1.48 -1.25 -1.45 118.94 115.88 1uz0 s TRP 124 Ca -0.26 -0.27 0.04 0.00 -1.06 0.00 0.00 56.10 54.55 1uz0 s TRP 124 Cb 0.04 0.71 -0.01 0.00 -1.16 0.00 0.00 33.47 33.04 1uz0 s TRP 124 CO 0.59 -1.21 -0.13 0.42 -4.06 0.00 0.00 176.95 172.56 1uz0 s ILE 125 N -3.83 1.02 -0.05 0.66 1.01 0.47 -1.74 121.20 118.74 1uz0 s ILE 125 Ca 0.11 -0.55 0.04 0.00 0.00 0.00 0.00 60.65 60.26 1uz0 s ILE 125 Cb -0.06 -0.86 -0.00 0.00 0.01 0.00 0.00 42.46 41.56 1uz0 s ILE 125 CO 0.07 0.29 -0.18 -0.60 0.00 0.00 0.00 174.94 174.52 1uz0 s ARG 126 N -0.26 1.98 -0.22 2.79 3.52 0.44 -0.24 118.95 126.96 1uz0 s ARG 126 Ca 0.04 -0.64 -0.05 0.00 -0.13 0.00 0.00 55.73 54.95 1uz0 s ARG 126 Cb -0.05 -1.68 -0.02 0.00 -1.56 0.00 0.00 34.95 31.64 1uz0 s ARG 126 CO -0.00 0.23 -0.00 0.42 -0.81 0.00 0.00 175.30 175.13 1uz0 s ILE 127 N 0.12 3.73 -0.06 4.11 1.01 -0.24 -0.53 121.20 129.35 1uz0 s ILE 127 Ca -0.07 -0.37 0.05 0.00 0.00 0.00 0.00 60.65 60.26 1uz0 s ILE 127 Cb -0.13 -2.71 -0.02 0.00 0.01 0.00 0.00 42.46 39.61 1uz0 s ILE 127 CO 0.03 0.40 -0.21 0.20 0.00 0.00 0.00 174.94 175.37 1uz0 s ASN 128 N 1.43 3.45 -0.11 3.58 0.01 -0.14 -0.57 114.94 122.59 1uz0 s ASN 128 Ca 0.05 -0.40 -0.30 0.00 -0.71 0.00 0.00 52.86 51.51 1uz0 s ASN 128 Cb -0.15 -0.88 -0.01 0.00 0.41 0.00 0.00 41.25 40.62 1uz0 s ASN 128 CO -0.00 0.27 1.06 -0.75 -1.51 0.00 0.00 177.10 176.16 1uz0 s LYS 129 N -0.31 4.39 -0.29 -0.60 2.20 -0.15 -0.77 119.74 124.21 1uz0 s LYS 129 Ca 0.01 1.45 0.15 0.00 -0.36 0.00 0.00 55.97 57.23 1uz0 s LYS 129 Cb -0.13 -3.56 0.48 0.00 -1.51 0.00 0.00 37.83 33.11 1uz0 s LYS 129 CO 0.02 -0.38 1.12 0.25 -0.36 0.00 0.00 175.35 176.00 1uz0 n THR 130 N 4.65 1.79 -1.29 3.43 -2.24 -1.04 -2.87 114.28 116.71 1uz0 n THR 130 Ca 0.10 -3.59 0.00 0.00 -2.27 0.00 0.00 64.05 58.29 1uz0 n THR 130 Cb 0.48 0.12 0.00 0.00 -2.10 0.00 0.00 70.33 68.83 1uz0 n THR 130 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50