#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1uza s THR 3 N 0.00 4.65 -0.02 6.66 -4.23 -0.26 -4.89 115.64 117.55 1uza s THR 3 Ca 0.00 -0.08 -0.30 0.00 -1.18 0.00 0.00 61.69 60.13 1uza s THR 3 Cb 0.00 -3.12 -0.04 0.00 1.34 0.00 0.00 72.50 70.68 1uza s THR 3 CO 0.00 0.42 1.21 -1.58 -0.54 0.00 0.00 174.62 174.13 1uza s GLN 4 N 0.72 4.37 0.00 3.99 -0.44 -1.26 -0.96 119.66 126.09 1uza s GLN 4 Ca 0.03 1.71 0.00 0.00 -2.50 0.00 0.00 55.36 54.61 1uza s GLN 4 Cb -0.13 -3.50 0.00 0.00 -1.64 0.00 0.00 33.01 27.74 1uza s GLN 4 CO 0.02 -0.39 0.00 0.41 0.50 0.00 0.00 175.29 175.83 1uza n GLY 5 N 3.33 2.17 3.46 2.59 0.00 0.36 -4.97 105.19 112.13 1uza n GLY 5 Ca 0.10 -1.51 -0.22 0.00 0.00 0.00 0.00 46.02 44.39 1uza n GLY 5 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1uza s ILE 6 N -0.70 1.56 0.66 -0.61 -4.36 -0.73 -4.76 121.20 112.26 1uza s ILE 6 Ca 0.00 -2.07 -0.14 0.00 -0.26 0.00 0.00 60.65 58.18 1uza s ILE 6 Cb 0.00 -2.64 -0.00 0.00 1.25 0.00 0.00 42.46 41.07 1uza s ILE 6 CO 0.00 -0.16 1.10 -0.94 0.24 0.00 0.00 174.94 175.17 1uza s SER 7 N -3.50 5.18 0.29 4.36 1.04 -1.26 -4.55 113.70 115.27 1uza s SER 7 Ca 0.33 1.93 -0.01 0.00 0.48 0.00 0.00 55.95 58.68 1uza s SER 7 Cb 0.06 -2.54 0.43 0.00 0.10 0.00 0.00 66.02 64.07 1uza s SER 7 CO 0.14 -1.58 1.85 -0.33 0.98 0.00 0.00 173.24 174.30 1uza h GLU 8 N -0.05 0.82 -0.42 4.02 5.08 -1.98 -1.01 114.58 121.03 1uza h GLU 8 Ca -0.46 -0.15 -0.02 0.00 -1.00 0.00 0.00 59.36 57.73 1uza h GLU 8 Cb 1.24 -0.13 -0.02 0.00 0.50 0.00 0.00 28.75 30.34 1uza h GLU 8 CO 0.55 0.72 0.19 -0.44 -1.00 0.00 0.00 179.01 179.02 1uza h ASP 9 N 0.80 0.56 -0.24 1.42 3.32 -1.99 -0.40 116.42 119.88 1uza h ASP 9 Ca 0.18 -0.14 -0.03 0.00 0.02 0.00 0.00 57.03 57.06 1uza h ASP 9 Cb 0.24 -0.14 -0.01 0.00 0.22 0.00 0.00 39.33 39.64 1uza h ASP 9 CO -0.01 0.55 0.05 0.25 -1.72 0.00 0.00 179.24 178.36 1uza h LEU 10 N 0.53 0.38 -0.69 1.55 5.85 -1.90 -2.27 115.31 118.76 1uza h LEU 10 Ca 0.14 -0.25 0.10 0.00 0.84 0.00 0.00 57.88 58.71 1uza h LEU 10 Cb 0.15 -0.10 -0.07 0.00 0.37 0.00 0.00 40.66 41.00 1uza h LEU 10 CO -0.02 0.54 0.32 0.22 -0.34 0.00 0.00 178.44 179.16 1uza h TYR 11 N 0.21 0.56 -0.62 1.25 3.20 -1.01 -0.22 116.97 120.35 1uza h TYR 11 Ca 0.07 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.96 1uza h TYR 11 Cb 0.31 -0.15 -0.03 0.00 1.54 0.00 0.00 36.73 38.41 1uza h TYR 11 CO 0.02 0.18 0.31 -0.91 -1.64 0.00 0.00 178.16 176.12 1uza h ASN 12 N 0.53 0.79 -0.54 -2.11 2.35 -0.95 -0.24 115.58 115.42 1uza h ASN 12 Ca 0.35 -0.12 0.01 0.00 -0.55 0.00 0.00 56.30 55.99 1uza h ASN 12 Cb 0.40 -0.20 -0.03 0.00 0.05 0.00 0.00 38.32 38.54 1uza h ASN 12 CO -0.29 0.68 0.35 -0.09 -1.65 0.00 0.00 177.43 176.43 1uza h ARG 13 N 0.84 0.69 -0.77 0.81 9.65 -0.75 -0.49 114.38 124.37 1uza h ARG 13 Ca 0.21 -0.04 -0.02 0.00 -1.10 0.00 0.00 59.98 59.03 1uza h ARG 13 Cb 0.09 -0.16 -0.04 0.00 -1.39 0.00 0.00 29.97 28.48 1uza h ARG 13 CO -0.03 0.46 0.39 -0.07 2.80 0.00 0.00 179.97 183.51 1uza h LEU 14 N 0.71 0.99 -0.70 3.80 3.38 -0.66 -1.70 115.31 121.13 1uza h LEU 14 Ca 0.20 -0.12 -0.02 0.00 0.09 0.00 0.00 57.88 58.03 1uza h LEU 14 Cb -0.06 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 40.41 1uza h LEU 14 CO -0.06 0.83 0.35 0.58 0.09 0.00 0.00 178.44 180.24 1uza h VAL 15 N 1.07 1.23 -0.13 1.22 2.07 -0.89 0.15 116.25 120.97 1uza h VAL 15 Ca 0.27 -0.61 0.00 0.00 0.82 0.00 0.00 66.70 67.17 1uza h VAL 15 Cb 0.09 0.34 -0.01 0.00 -1.52 0.00 0.00 31.29 30.20 1uza h VAL 15 CO -0.04 0.26 0.08 -0.08 0.02 0.00 0.00 177.57 177.82 1uza h GLU 16 N 0.97 0.18 -0.30 1.57 4.81 -0.81 0.56 114.58 121.56 1uza h GLU 16 Ca 0.24 -0.01 -0.12 0.00 -0.13 0.00 0.00 59.36 59.34 1uza h GLU 16 Cb 0.09 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.42 1uza h GLU 16 CO -0.03 0.14 -0.31 0.52 -0.73 0.00 0.00 179.01 178.60 1uza h MET 17 N 0.16 0.64 -0.78 1.92 2.86 -1.12 -2.07 114.93 116.55 1uza h MET 17 Ca 0.05 -0.29 0.03 0.00 -2.06 0.00 0.00 59.70 57.43 1uza h MET 17 Cb 0.01 -0.02 -0.05 0.00 0.06 0.00 0.00 31.60 31.60 1uza h MET 17 CO -0.01 0.87 0.50 0.00 1.06 0.00 0.00 176.91 179.33 1uza h ALA 18 N 1.11 1.01 -0.23 6.32 0.00 -0.70 -0.84 119.26 125.94 1uza h ALA 18 Ca 0.06 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 1uza h ALA 18 Cb 0.80 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.31 1uza h ALA 18 CO 0.07 0.32 0.13 1.15 0.00 0.00 0.00 179.25 180.92 1uza h THR 19 N 0.98 1.10 -0.46 0.00 2.02 -0.44 0.20 112.91 116.31 1uza h THR 19 Ca 0.31 -0.25 -0.00 0.00 0.77 0.00 0.00 66.41 67.24 1uza h THR 19 Cb -0.01 0.85 -0.02 0.00 -1.74 0.00 0.00 68.15 67.23 1uza h THR 19 CO -0.10 0.10 0.28 0.40 0.37 0.00 0.00 175.52 176.57 1uza h ILE 20 N 0.27 1.14 -0.91 3.11 2.04 -1.23 0.14 117.51 122.07 1uza h ILE 20 Ca 0.08 -0.29 -0.02 0.00 1.00 0.00 0.00 64.86 65.63 1uza h ILE 20 Cb 0.04 0.51 -0.04 0.00 -0.74 0.00 0.00 36.82 36.58 1uza h ILE 20 CO -0.01 0.14 0.49 0.28 0.00 0.00 0.00 178.15 179.04 1uza h SER 21 N 0.61 1.13 1.38 1.72 0.02 -0.89 -2.33 113.55 115.20 1uza h SER 21 Ca 0.17 -0.10 -0.11 0.00 -0.84 0.00 0.00 61.79 60.90 1uza h SER 21 Cb -0.03 -0.29 -0.02 0.00 0.14 0.00 0.00 62.40 62.21 1uza h SER 21 CO -0.03 0.91 -0.63 1.56 -1.14 0.00 0.00 176.83 177.49 1uza h GLN 22 N 1.27 0.00 0.00 3.45 1.08 -0.62 -3.06 115.11 117.23 1uza h GLN 22 Ca 0.32 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.52 1uza h GLN 22 Cb 0.03 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.46 1uza h GLN 22 CO -0.05 0.48 0.00 0.00 -0.95 0.00 0.00 178.83 178.31 1uza h ALA 23 N 1.48 1.00 0.00 3.87 0.00 -0.47 -1.28 119.26 123.85 1uza h ALA 23 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1uza h ALA 23 Cb 1.42 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.21 1uza h ALA 23 CO 0.06 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.31 1uza h ALA 24 N 2.07 1.00 -0.00 0.00 0.00 -1.31 0.95 119.26 121.97 1uza h ALA 24 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1uza h ALA 24 Cb 0.67 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.46 1uza h ALA 24 CO 0.00 0.00 -0.10 0.66 0.00 0.00 0.00 179.25 179.81 1uza n TYR 25 N -2.34 0.00 -2.70 0.00 4.02 -1.12 -4.17 117.16 110.85 1uza n TYR 25 Ca 0.01 0.00 -0.07 0.00 -0.01 0.00 0.00 57.90 57.83 1uza n TYR 25 Cb 0.19 -0.26 0.04 0.00 -0.02 0.00 0.00 39.34 39.28 1uza n TYR 25 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1uza n ALA 26 N -1.18 3.15 -2.97 -0.72 0.00 -0.54 -4.74 120.51 113.51 1uza n ALA 26 Ca 0.12 -2.96 -0.22 0.00 0.00 0.00 0.00 53.44 50.39 1uza n ALA 26 Cb 0.28 -0.93 0.02 0.00 0.00 0.00 0.00 19.45 18.83 1uza n ALA 26 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1uza n ASP 27 N -0.21 -5.61 -3.63 0.00 8.00 -1.20 -2.21 116.55 111.70 1uza n ASP 27 Ca 0.08 -0.25 -0.24 0.00 0.71 0.00 0.00 54.79 55.09 1uza n ASP 27 Cb 0.82 -4.57 0.07 0.00 -0.02 0.00 0.00 41.12 37.42 1uza n ASP 27 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1uza n LEU 28 N -3.81 -3.35 -4.68 0.64 4.77 0.22 -4.94 117.00 105.85 1uza n LEU 28 Ca -0.12 -0.58 -0.44 0.00 -0.03 0.00 0.00 56.01 54.85 1uza n LEU 28 Cb 0.62 -2.99 -0.02 0.00 -2.33 0.00 0.00 43.42 38.70 1uza n LEU 28 CO 0.44 0.61 1.04 0.00 -1.33 0.00 0.00 177.39 178.16 1uza n ASN 30 N 2.08 -3.31 -4.82 0.00 4.13 -1.26 -4.79 115.26 107.28 1uza n ASN 30 Ca 0.11 -0.95 -0.30 0.00 1.68 0.00 0.00 54.58 55.11 1uza n ASN 30 Cb 0.32 -3.07 0.06 0.00 -1.54 0.00 0.00 39.78 35.56 1uza n ASN 30 CO 0.00 0.00 0.00 0.27 0.28 0.00 0.00 177.26 177.81 1uza s ILE 31 N -3.37 3.64 0.30 2.41 -4.36 -1.23 -4.80 121.20 113.79 1uza s ILE 31 Ca 0.63 0.53 -0.28 0.00 -0.26 0.00 0.00 60.65 61.28 1uza s ILE 31 Cb -0.34 -3.32 -0.14 0.00 1.25 0.00 0.00 42.46 39.92 1uza s ILE 31 CO 0.90 -0.69 1.05 -2.65 0.24 0.00 0.00 174.94 173.79 1uza n PRO 32 N -3.21 1.47 0.17 0.37 -0.02 -1.26 -4.85 135.00 127.66 1uza n PRO 32 Ca 0.07 0.51 0.12 0.00 -2.02 0.00 0.00 63.50 62.18 1uza n PRO 32 Cb 0.55 -1.92 0.60 0.00 -0.02 0.00 0.00 33.50 32.72 1uza n PRO 32 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1uza h SER 33 N 2.06 0.00 0.11 2.55 4.64 -2.04 -2.08 113.55 118.79 1uza h SER 33 Ca -0.41 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.91 1uza h SER 33 Cb 1.33 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.42 1uza h SER 33 CO 0.61 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.92 1uza n THR 34 N -2.31 0.02 -4.35 2.95 -2.24 -1.26 -4.83 114.28 102.26 1uza n THR 34 Ca -0.01 0.00 -0.34 0.00 -2.27 0.00 0.00 64.05 61.44 1uza n THR 34 Cb 0.07 -0.54 -0.11 0.00 -2.10 0.00 0.00 70.33 67.65 1uza n THR 34 CO 0.00 0.00 0.00 -0.63 -0.57 0.00 0.00 175.07 173.87 1uza s ILE 35 N -2.11 4.10 -0.20 2.28 1.01 -0.79 -3.97 121.20 121.52 1uza s ILE 35 Ca 0.41 -0.29 -0.12 0.00 0.00 0.00 0.00 60.65 60.64 1uza s ILE 35 Cb 0.20 -2.78 -0.05 0.00 0.01 0.00 0.00 42.46 39.84 1uza s ILE 35 CO 0.36 0.52 0.22 -0.63 0.00 0.00 0.00 174.94 175.41 1uza s ILE 36 N 0.06 5.34 -0.12 2.92 1.01 0.29 -4.94 121.20 125.75 1uza s ILE 36 Ca 0.01 0.37 -0.26 0.00 0.00 0.00 0.00 60.65 60.77 1uza s ILE 36 Cb -0.13 -3.56 -0.02 0.00 0.01 0.00 0.00 42.46 38.75 1uza s ILE 36 CO 0.02 0.38 0.85 -0.54 0.00 0.00 0.00 174.94 175.65 1uza s LYS 37 N 0.68 4.38 0.00 2.79 1.02 -1.26 -1.09 119.74 126.26 1uza s LYS 37 Ca 0.12 1.10 0.00 0.00 0.02 0.00 0.00 55.97 57.21 1uza s LYS 37 Cb -0.13 -3.53 0.00 0.00 -0.52 0.00 0.00 37.83 33.65 1uza s LYS 37 CO 0.03 -0.21 0.00 0.41 -0.92 0.00 0.00 175.35 174.65 1uza n GLY 38 N 3.26 2.20 3.77 -3.33 0.00 0.38 -4.98 105.19 106.49 1uza n GLY 38 Ca 0.04 -1.84 -0.39 0.00 0.00 0.00 0.00 46.02 43.83 1uza n GLY 38 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1uza s GLU 39 N 4.21 4.35 0.23 1.61 0.41 -1.25 -4.67 118.70 123.59 1uza s GLU 39 Ca 0.00 1.80 -0.30 0.00 -0.41 0.00 0.00 54.97 56.06 1uza s GLU 39 Cb 0.00 -2.90 -0.09 0.00 -1.78 0.00 0.00 34.13 29.36 1uza s GLU 39 CO 0.00 -0.05 1.20 0.21 -0.49 0.00 0.00 175.26 176.12 1uza s LYS 40 N -1.94 4.50 -0.19 1.61 2.47 -1.26 -2.04 119.74 122.89 1uza s LYS 40 Ca 0.51 1.92 -0.07 0.00 -1.56 0.00 0.00 55.97 56.77 1uza s LYS 40 Cb -0.30 -3.20 -0.04 0.00 -1.46 0.00 0.00 37.83 32.83 1uza s LYS 40 CO 0.39 -0.04 0.06 0.42 0.16 0.00 0.00 175.35 176.34 1uza s ILE 41 N -0.47 4.72 -0.26 5.43 1.01 0.79 -4.96 121.20 127.45 1uza s ILE 41 Ca 0.50 -0.06 -0.21 0.00 0.00 0.00 0.00 60.65 60.89 1uza s ILE 41 Cb -0.34 -3.13 0.07 0.00 0.01 0.00 0.00 42.46 39.07 1uza s ILE 41 CO 0.40 0.45 0.67 -0.47 0.00 0.00 0.00 174.94 175.99 1uza s TYR 42 N 0.48 -0.81 -0.02 3.97 5.04 -1.26 -0.93 117.35 123.82 1uza s TYR 42 Ca 0.03 1.86 0.03 0.00 -2.44 0.00 0.00 57.07 56.55 1uza s TYR 42 Cb -0.13 0.34 -0.00 0.00 0.35 0.00 0.00 41.96 42.53 1uza s TYR 42 CO 0.01 -0.40 -0.10 1.21 -1.34 0.00 0.00 175.55 174.93 1uza s ASN 43 N 0.70 1.27 0.26 4.32 3.84 -0.95 -4.98 114.94 119.39 1uza s ASN 43 Ca -0.03 -0.20 0.14 0.00 0.21 0.00 0.00 52.86 52.99 1uza s ASN 43 Cb -0.05 -0.28 0.05 0.00 -0.55 0.00 0.00 41.25 40.42 1uza s ASN 43 CO -0.04 0.09 1.43 0.00 -2.79 0.00 0.00 177.10 175.79 1uza h ALA 44 N 6.22 0.64 0.10 1.71 0.00 -1.92 -0.38 119.26 125.63 1uza h ALA 44 Ca -0.33 -0.51 -0.27 0.00 0.00 0.00 0.00 54.91 53.80 1uza h ALA 44 Cb 1.17 -0.09 0.01 0.00 0.00 0.00 0.00 17.79 18.88 1uza h ALA 44 CO 0.49 0.70 -1.18 1.96 0.00 0.00 0.00 179.25 181.22 1uza h GLN 45 N 0.00 0.38 0.00 0.00 7.50 -1.97 -3.36 115.11 117.67 1uza h GLN 45 Ca -0.01 -0.55 0.00 0.00 0.50 0.00 0.00 58.65 58.59 1uza h GLN 45 Cb 1.42 0.19 0.00 0.00 0.05 0.00 0.00 27.48 29.14 1uza h GLN 45 CO 0.07 1.23 -1.15 0.25 -1.50 0.00 0.00 178.83 177.73 1uza n THR 46 N -3.65 0.00 -3.21 -0.54 -2.24 -1.23 -4.99 114.28 98.42 1uza n THR 46 Ca -0.09 -0.16 -0.23 0.00 -2.27 0.00 0.00 64.05 61.29 1uza n THR 46 Cb 0.97 0.75 0.02 0.00 -2.10 0.00 0.00 70.33 69.97 1uza n THR 46 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 1uza n ASP 47 N -1.64 -5.16 -4.70 3.42 2.03 -0.16 -4.25 116.55 106.10 1uza n ASP 47 Ca 0.02 -0.35 -0.42 0.00 0.52 0.00 0.00 54.79 54.55 1uza n ASP 47 Cb 0.35 -4.19 -0.03 0.00 -0.72 0.00 0.00 41.12 36.53 1uza n ASP 47 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1uza s ILE 48 N -3.09 4.55 -0.09 5.18 -1.09 -1.20 -4.86 121.20 120.59 1uza s ILE 48 Ca 0.37 1.83 0.04 0.00 -2.23 0.00 0.00 60.65 60.66 1uza s ILE 48 Cb -0.18 -4.17 0.00 0.00 -1.58 0.00 0.00 42.46 36.53 1uza s ILE 48 CO 0.45 0.10 -0.22 0.20 -1.23 0.00 0.00 174.94 174.24 1uza s ASN 49 N 1.11 2.86 0.28 3.58 0.01 -1.26 -2.25 114.94 119.27 1uza s ASN 49 Ca 0.54 -0.51 -0.06 0.00 -0.71 0.00 0.00 52.86 52.12 1uza s ASN 49 Cb -0.23 -1.25 0.02 0.00 0.41 0.00 0.00 41.25 40.20 1uza s ASN 49 CO 0.26 0.15 0.46 0.61 -1.51 0.00 0.00 177.10 177.07 1uza n GLY 50 N 3.51 1.87 3.15 0.66 0.00 -0.11 -0.53 105.19 113.74 1uza n GLY 50 Ca -0.19 -1.40 -0.09 0.00 0.00 0.00 0.00 46.02 44.34 1uza n GLY 50 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1uza s TRP 51 N -3.66 0.20 -0.11 1.61 0.51 -0.28 -0.15 118.94 117.05 1uza s TRP 51 Ca 0.17 -0.56 -0.09 0.00 -2.12 0.00 0.00 56.10 53.50 1uza s TRP 51 Cb -0.02 -0.13 -0.04 0.00 -0.81 0.00 0.00 33.47 32.47 1uza s TRP 51 CO 0.13 -0.44 0.19 -1.50 -0.51 0.00 0.00 176.95 174.81 1uza s ILE 52 N -3.20 5.42 0.20 2.03 2.07 -0.87 -1.37 121.20 125.48 1uza s ILE 52 Ca -0.00 0.32 0.03 0.00 -1.41 0.00 0.00 60.65 59.59 1uza s ILE 52 Cb 0.02 -3.47 -0.05 0.00 0.13 0.00 0.00 42.46 39.10 1uza s ILE 52 CO -0.07 0.58 -0.01 -0.76 -1.91 0.00 0.00 174.94 172.76 1uza s LEU 53 N -0.79 2.20 -0.04 8.50 1.43 0.11 -0.47 118.68 129.61 1uza s LEU 53 Ca 0.16 -1.18 -0.01 0.00 -1.03 0.00 0.00 54.13 52.06 1uza s LEU 53 Cb -0.13 -0.20 0.03 0.00 0.03 0.00 0.00 46.19 45.92 1uza s LEU 53 CO 0.05 -0.51 0.08 -0.60 0.23 0.00 0.00 176.35 175.60 1uza s ARG 54 N -3.87 0.03 -0.37 1.70 3.52 -0.25 -0.88 118.95 118.84 1uza s ARG 54 Ca 0.25 0.26 -0.02 0.00 -0.13 0.00 0.00 55.73 56.09 1uza s ARG 54 Cb 0.05 -0.20 0.09 0.00 -1.56 0.00 0.00 34.95 33.34 1uza s ARG 54 CO 0.06 -0.16 0.13 0.34 -0.81 0.00 0.00 175.30 174.86 1uza s ASP 55 N 1.04 5.12 0.24 -2.12 -1.08 0.14 -0.55 116.67 119.45 1uza s ASP 55 Ca -0.08 -1.77 0.04 0.00 -0.52 0.00 0.00 52.55 50.22 1uza s ASP 55 Cb -0.11 -1.78 0.25 0.00 -1.46 0.00 0.00 42.92 39.81 1uza s ASP 55 CO -0.04 -0.44 1.56 0.44 0.52 0.00 0.00 175.17 177.21 1uza h ASP 56 N 8.01 0.27 -0.60 -0.34 3.32 -1.82 -0.59 116.42 124.68 1uza h ASP 56 Ca -0.15 -0.15 0.01 0.00 0.02 0.00 0.00 57.03 56.76 1uza h ASP 56 Cb 1.05 -0.08 -0.03 0.00 0.22 0.00 0.00 39.33 40.49 1uza h ASP 56 CO 0.63 0.81 0.38 0.74 -1.72 0.00 0.00 179.24 180.09 1uza h THR 57 N 0.17 1.12 -0.36 0.35 2.02 -1.93 -2.37 112.91 111.90 1uza h THR 57 Ca -0.01 -0.26 0.00 0.00 0.77 0.00 0.00 66.41 66.91 1uza h THR 57 Cb 1.11 0.28 0.00 0.00 -1.74 0.00 0.00 68.15 67.80 1uza h THR 57 CO 0.09 0.14 0.00 -1.54 0.37 0.00 0.00 175.52 174.58 1uza n SER 58 N -4.70 3.17 -3.54 4.18 3.41 -1.21 -4.98 113.62 109.96 1uza n SER 58 Ca 0.05 -1.95 -0.22 0.00 -0.26 0.00 0.00 58.87 56.48 1uza n SER 58 Cb 0.04 -0.23 0.05 0.00 -0.26 0.00 0.00 64.21 63.81 1uza n SER 58 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1uza n LYS 59 N 1.30 -3.01 -4.01 4.33 5.02 -0.31 -4.86 118.16 116.62 1uza n LYS 59 Ca 0.19 0.66 -0.12 0.00 -2.02 0.00 0.00 58.31 57.02 1uza n LYS 59 Cb 0.56 -5.09 -0.13 0.00 -0.02 0.00 0.00 35.03 30.35 1uza n LYS 59 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 1uza s GLU 60 N -5.44 0.32 -0.27 1.97 -1.05 -0.72 -0.97 118.70 112.54 1uza s GLU 60 Ca 0.30 -0.42 -0.09 0.00 -0.15 0.00 0.00 54.97 54.60 1uza s GLU 60 Cb -0.07 -0.13 -0.03 0.00 -0.44 0.00 0.00 34.13 33.45 1uza s GLU 60 CO 0.80 0.02 0.13 0.42 0.95 0.00 0.00 175.26 177.58 1uza s ILE 61 N -0.82 4.69 -0.15 1.83 1.01 0.62 -0.69 121.20 127.69 1uza s ILE 61 Ca -0.07 -0.11 -0.02 0.00 0.00 0.00 0.00 60.65 60.45 1uza s ILE 61 Cb -0.06 -3.25 -0.02 0.00 0.01 0.00 0.00 42.46 39.14 1uza s ILE 61 CO -0.00 0.26 -0.07 -0.63 0.00 0.00 0.00 174.94 174.50 1uza s ILE 62 N 1.66 3.53 -0.19 2.92 1.01 -0.06 -0.70 121.20 129.37 1uza s ILE 62 Ca 0.06 -0.48 -0.04 0.00 0.00 0.00 0.00 60.65 60.20 1uza s ILE 62 Cb -0.16 -2.53 -0.02 0.00 0.01 0.00 0.00 42.46 39.76 1uza s ILE 62 CO 0.07 0.49 -0.05 -0.89 0.00 0.00 0.00 174.94 174.56 1uza s THR 63 N 0.50 3.51 -0.01 2.92 2.01 0.30 0.05 115.64 124.93 1uza s THR 63 Ca -0.05 -0.46 0.07 0.00 0.31 0.00 0.00 61.69 61.56 1uza s THR 63 Cb -0.15 -2.57 -0.02 0.00 0.01 0.00 0.00 72.50 69.77 1uza s THR 63 CO 0.03 0.45 -0.24 0.54 -0.69 0.00 0.00 174.62 174.71 1uza s VAL 64 N 1.07 2.27 -0.05 3.82 0.11 -0.47 -1.08 120.40 126.07 1uza s VAL 64 Ca 0.01 -1.10 0.06 0.00 -2.93 0.00 0.00 61.98 58.02 1uza s VAL 64 Cb -0.15 -1.83 -0.02 0.00 -1.53 0.00 0.00 36.38 32.86 1uza s VAL 64 CO 0.00 0.53 -0.23 -0.36 -3.33 0.00 0.00 175.10 171.71 1uza s PHE 65 N -0.68 2.46 0.49 1.54 0.08 -0.75 -1.13 117.98 120.00 1uza s PHE 65 Ca 0.11 -0.55 -0.21 0.00 0.12 0.00 0.00 56.93 56.40 1uza s PHE 65 Cb -0.10 -1.58 -0.07 0.00 -0.57 0.00 0.00 43.02 40.69 1uza s PHE 65 CO 0.00 -0.10 1.09 0.50 -0.10 0.00 0.00 175.22 176.61 1uza s ARG 66 N -0.37 3.68 0.00 0.44 3.52 0.31 -4.07 118.95 122.46 1uza s ARG 66 Ca 0.03 1.51 0.00 0.00 -0.13 0.00 0.00 55.73 57.14 1uza s ARG 66 Cb -0.12 -2.15 0.00 0.00 -1.56 0.00 0.00 34.95 31.12 1uza s ARG 66 CO 0.02 -0.56 0.00 0.41 -0.81 0.00 0.00 175.30 174.36 1uza n GLY 67 N 0.04 0.76 3.68 8.12 0.00 -1.21 -3.47 105.19 113.11 1uza n GLY 67 Ca 0.09 -1.68 -0.42 0.00 0.00 0.00 0.00 46.02 44.01 1uza n GLY 67 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1uza s THR 68 N 0.84 4.04 0.00 2.61 2.01 -1.26 -4.75 115.64 119.13 1uza s THR 68 Ca 0.00 1.36 0.06 0.00 0.31 0.00 0.00 61.69 63.41 1uza s THR 68 Cb 0.00 -3.87 0.09 0.00 0.01 0.00 0.00 72.50 68.73 1uza s THR 68 CO 0.00 -0.03 0.99 0.61 -0.69 0.00 0.00 174.62 175.50 1uza n GLY 69 N 3.56 0.66 3.57 4.40 0.00 -1.26 -5.05 105.19 111.06 1uza n GLY 69 Ca 0.13 -0.19 -0.06 0.00 0.00 0.00 0.00 46.02 45.90 1uza n GLY 69 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1uza s SER 70 N -1.13 -0.21 0.30 1.61 1.04 -1.26 -5.00 113.70 109.05 1uza s SER 70 Ca 0.07 0.02 -0.02 0.00 0.48 0.00 0.00 55.95 56.51 1uza s SER 70 Cb 0.09 0.22 0.45 0.00 0.10 0.00 0.00 66.02 66.88 1uza s SER 70 CO -0.04 -0.34 1.95 -0.78 0.98 0.00 0.00 173.24 175.01 1uza h ASP 71 N 2.03 0.95 -0.42 7.02 3.58 -1.99 -1.78 116.42 125.81 1uza h ASP 71 Ca -0.13 -0.02 0.01 0.00 0.42 0.00 0.00 57.03 57.31 1uza h ASP 71 Cb 1.19 -0.23 -0.02 0.00 1.72 0.00 0.00 39.33 41.99 1uza h ASP 71 CO 0.25 0.67 0.28 0.74 -2.88 0.00 0.00 179.24 178.30 1uza h THR 72 N 1.11 1.10 -0.89 2.25 2.02 -1.95 -1.24 112.91 115.31 1uza h THR 72 Ca 0.33 -0.19 0.02 0.00 0.77 0.00 0.00 66.41 67.34 1uza h THR 72 Cb -0.04 0.49 -0.05 0.00 -1.74 0.00 0.00 68.15 66.81 1uza h THR 72 CO -0.09 0.10 0.58 0.78 0.37 0.00 0.00 175.52 177.27 1uza h ASN 73 N 0.57 0.99 -0.55 4.18 -0.26 -1.64 -2.19 115.58 116.68 1uza h ASN 73 Ca 0.16 -0.02 -0.01 0.00 -0.56 0.00 0.00 56.30 55.87 1uza h ASN 73 Cb -0.06 -0.24 -0.03 0.00 -1.06 0.00 0.00 38.32 36.94 1uza h ASN 73 CO -0.04 0.70 0.32 -0.07 -1.06 0.00 0.00 177.43 177.28 1uza h LEU 74 N 1.17 0.70 -0.48 1.61 3.38 -0.85 -1.23 115.31 119.60 1uza h LEU 74 Ca 0.34 -0.05 -0.03 0.00 0.09 0.00 0.00 57.88 58.23 1uza h LEU 74 Cb -0.08 -0.18 -0.02 0.00 0.09 0.00 0.00 40.66 40.48 1uza h LEU 74 CO -0.09 0.56 0.17 1.56 0.09 0.00 0.00 178.44 180.73 1uza h GLN 75 N 0.79 0.73 -0.61 1.13 4.20 -0.71 -2.68 115.11 117.97 1uza h GLN 75 Ca 0.20 -0.14 0.03 0.00 0.06 0.00 0.00 58.65 58.80 1uza h GLN 75 Cb 0.02 -0.11 -0.04 0.00 0.30 0.00 0.00 27.48 27.64 1uza h GLN 75 CO -0.03 0.67 0.36 -0.07 -0.67 0.00 0.00 178.83 179.10 1uza h LEU 76 N 0.64 0.58 -1.54 1.46 3.38 -0.79 -2.51 115.31 116.54 1uza h LEU 76 Ca 0.16 0.01 0.18 0.00 0.09 0.00 0.00 57.88 58.31 1uza h LEU 76 Cb 0.23 -0.11 -0.06 0.00 0.09 0.00 0.00 40.66 40.81 1uza h LEU 76 CO -0.01 0.40 0.55 0.44 0.09 0.00 0.00 178.44 179.91 1uza h ASP 77 N 0.71 0.41 0.52 -0.43 3.32 -0.91 -2.35 116.42 117.68 1uza h ASP 77 Ca 0.25 0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.33 1uza h ASP 77 Cb 0.06 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 39.56 1uza h ASP 77 CO -0.12 0.19 -0.22 0.35 -1.72 0.00 0.00 179.24 177.72 1uza n THR 78 N -4.49 0.00 -2.74 0.35 -2.24 -0.95 -4.64 114.28 99.56 1uza n THR 78 Ca 0.17 -0.04 -0.42 0.00 -2.27 0.00 0.00 64.05 61.49 1uza n THR 78 Cb 0.61 -0.02 -0.03 0.00 -2.10 0.00 0.00 70.33 68.79 1uza n THR 78 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1uza s ASN 79 N -2.74 6.51 0.00 3.42 3.84 -0.88 -4.81 114.94 120.27 1uza s ASN 79 Ca 0.20 -1.62 0.16 0.00 0.21 0.00 0.00 52.86 51.81 1uza s ASN 79 Cb 0.19 -2.48 0.64 0.00 -0.55 0.00 0.00 41.25 39.05 1uza s ASN 79 CO 0.56 -1.33 1.46 -1.22 -2.79 0.00 0.00 177.10 173.78 1uza n TYR 80 N 7.81 0.22 -2.09 0.43 4.02 -1.26 -1.98 117.16 124.30 1uza n TYR 80 Ca 0.25 -0.11 -0.42 0.00 -0.01 0.00 0.00 57.90 57.60 1uza n TYR 80 Cb 0.50 0.00 -0.03 0.00 -0.02 0.00 0.00 39.34 39.79 1uza n TYR 80 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 176.86 176.84 1uza s THR 81 N -1.78 3.17 0.14 -0.72 2.01 -1.26 -4.67 115.64 112.54 1uza s THR 81 Ca 0.27 0.79 -0.30 0.00 0.31 0.00 0.00 61.69 62.75 1uza s THR 81 Cb 0.14 -3.50 -0.07 0.00 0.01 0.00 0.00 72.50 69.07 1uza s THR 81 CO 0.21 0.04 1.18 -0.76 -0.69 0.00 0.00 174.62 174.60 1uza s LEU 82 N 1.50 4.43 -0.06 4.42 1.43 -1.26 -0.21 118.68 128.94 1uza s LEU 82 Ca 0.67 2.14 0.03 0.00 -1.03 0.00 0.00 54.13 55.94 1uza s LEU 82 Cb -0.38 -3.60 0.01 0.00 0.03 0.00 0.00 46.19 42.25 1uza s LEU 82 CO 0.30 -0.38 -0.15 -0.89 0.23 0.00 0.00 176.35 175.47 1uza s THR 83 N 0.29 1.29 0.17 5.49 2.01 -0.23 -4.89 115.64 119.77 1uza s THR 83 Ca 0.54 -0.59 -0.33 0.00 0.31 0.00 0.00 61.69 61.62 1uza s THR 83 Cb -0.31 -1.14 -0.15 0.00 0.01 0.00 0.00 72.50 70.91 1uza s THR 83 CO 0.34 0.38 1.32 -2.65 -0.69 0.00 0.00 174.62 173.32 1uza n PRO 84 N 3.53 1.53 -2.37 4.92 -0.02 -1.26 -0.74 135.00 140.59 1uza n PRO 84 Ca -0.21 0.55 -0.43 0.00 -2.02 0.00 0.00 63.50 61.39 1uza n PRO 84 Cb 0.52 -2.15 0.00 0.00 -0.02 0.00 0.00 33.50 31.86 1uza n PRO 84 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1uza n PHE 85 N 2.06 3.79 0.37 6.00 7.35 -0.36 -4.78 117.46 131.89 1uza n PHE 85 Ca 0.15 -2.97 0.13 0.00 -0.76 0.00 0.00 57.45 54.01 1uza n PHE 85 Cb 0.26 -2.25 0.54 0.00 0.35 0.00 0.00 39.48 38.38 1uza n PHE 85 CO 0.00 0.00 0.00 -0.44 -0.76 0.00 0.00 176.76 175.56 1uza h ASP 86 N 6.38 0.00 -0.89 -2.13 3.32 -1.89 -1.85 116.42 119.36 1uza h ASP 86 Ca 0.43 0.00 0.23 0.00 0.02 0.00 0.00 57.03 57.71 1uza h ASP 86 Cb 0.72 0.00 -0.16 0.00 0.22 0.00 0.00 39.33 40.12 1uza h ASP 86 CO 1.58 0.00 0.10 0.74 -1.72 0.00 0.00 179.24 179.94 1uza h THR 87 N 0.00 0.20 -3.30 0.35 2.02 -2.01 -3.30 112.91 106.88 1uza h THR 87 Ca 0.00 -0.03 -0.65 0.00 0.77 0.00 0.00 66.41 66.49 1uza h THR 87 Cb 0.44 0.09 -0.39 0.00 -1.74 0.00 0.00 68.15 66.55 1uza h THR 87 CO 0.00 0.02 -0.47 -0.22 0.37 0.00 0.00 175.52 175.22 1uza s LEU 88 N -10.82 4.87 0.56 2.58 2.96 -0.70 -4.95 118.68 113.19 1uza s LEU 88 Ca -0.13 -3.41 0.26 0.00 -0.22 0.00 0.00 54.13 50.64 1uza s LEU 88 Cb 0.26 -1.72 1.65 0.00 0.50 0.00 0.00 46.19 46.88 1uza s LEU 88 CO 0.77 -0.19 2.20 1.55 -1.32 0.00 0.00 176.35 179.36 1uza h PRO 89 N 6.12 0.00 0.00 0.98 0.13 -1.75 -0.04 132.00 137.43 1uza h PRO 89 Ca 0.05 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.18 1uza h PRO 89 Cb 0.84 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.97 1uza h PRO 89 CO 0.73 0.03 0.00 0.00 -0.23 0.00 0.00 178.00 178.53 1uza n GLN 90 N -3.95 0.13 -2.67 0.86 10.64 -1.26 -4.41 117.38 116.71 1uza n GLN 90 Ca -0.03 0.26 -0.42 0.00 -1.83 0.00 0.00 57.00 54.98 1uza n GLN 90 Cb 0.11 -1.70 -0.03 0.00 -0.86 0.00 0.00 30.24 27.76 1uza n GLN 90 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1uza s ASN 92 N 4.41 6.21 -1.53 0.00 3.04 -1.26 -2.15 114.94 123.66 1uza s ASN 92 Ca 0.40 1.97 0.00 0.00 0.04 0.00 0.00 52.86 55.27 1uza s ASN 92 Cb -0.03 -2.53 0.00 0.00 -1.54 0.00 0.00 41.25 37.15 1uza s ASN 92 CO -0.05 -1.34 0.00 0.47 -3.04 0.00 0.00 177.10 173.13 1uza n ASP 93 N 8.87 -4.74 -4.73 -4.21 8.00 -1.26 -4.86 116.55 113.61 1uza n ASP 93 Ca 0.21 0.32 -0.41 0.00 0.71 0.00 0.00 54.79 55.63 1uza n ASP 93 Cb 0.44 -3.58 -0.05 0.00 -0.02 0.00 0.00 41.12 37.92 1uza n ASP 93 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1uza s GLU 95 N -0.21 0.65 0.20 0.00 2.02 -1.26 -1.23 118.70 118.87 1uza s GLU 95 Ca 0.47 -0.77 0.06 0.00 0.02 0.00 0.00 54.97 54.75 1uza s GLU 95 Cb -0.25 -0.52 -0.05 0.00 0.10 0.00 0.00 34.13 33.41 1uza s GLU 95 CO 0.31 0.11 -0.10 0.14 0.02 0.00 0.00 175.26 175.74 1uza s VAL 96 N -1.19 1.47 -0.03 2.63 -7.23 0.08 -1.09 120.40 115.04 1uza s VAL 96 Ca -0.06 -2.13 -0.37 0.00 -1.81 0.00 0.00 61.98 57.61 1uza s VAL 96 Cb -0.09 -2.09 -0.16 0.00 0.56 0.00 0.00 36.38 34.60 1uza s VAL 96 CO 0.01 -0.56 1.54 1.57 -0.31 0.00 0.00 175.10 177.35 1uza n HIS 97 N -0.36 1.85 -0.21 2.82 -0.00 -0.42 -1.07 115.22 117.83 1uza n HIS 97 Ca -0.08 0.50 -0.09 0.00 0.46 0.00 0.00 57.72 58.51 1uza n HIS 97 Cb 0.61 -2.43 0.02 0.00 -0.12 0.00 0.00 29.99 28.08 1uza n HIS 97 CO 0.00 0.00 0.00 0.78 0.46 0.00 0.00 176.34 177.58 1uza h GLY 98 N 5.94 1.15 0.93 1.57 0.00 -0.50 -0.92 103.07 111.25 1uza h GLY 98 Ca -0.47 -0.86 -0.03 0.00 0.00 0.00 0.00 47.33 45.96 1uza h GLY 98 CO 0.86 0.79 0.11 -1.33 0.00 0.00 0.00 176.54 176.97 1uza h GLY 99 N 0.96 0.65 2.00 4.60 0.00 -1.55 -2.35 103.07 107.38 1uza h GLY 99 Ca 0.17 -0.39 -0.05 0.00 0.00 0.00 0.00 47.33 47.05 1uza h GLY 99 CO 0.03 0.37 -0.25 -0.97 0.00 0.00 0.00 176.54 175.72 1uza h TYR 100 N 0.47 0.00 -0.71 5.60 0.05 -1.70 -1.52 116.97 119.16 1uza h TYR 100 Ca 0.12 0.00 -0.07 0.00 0.05 0.00 0.00 58.73 58.84 1uza h TYR 100 Cb 0.28 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 37.99 1uza h TYR 100 CO 0.01 0.25 0.19 -0.92 -1.05 0.00 0.00 178.16 176.64 1uza h TYR 101 N 0.00 1.18 -0.45 4.88 3.20 -0.91 0.37 116.97 125.23 1uza h TYR 101 Ca -0.00 -0.14 -0.02 0.00 3.14 0.00 0.00 58.73 61.71 1uza h TYR 101 Cb 0.56 -0.34 -0.02 0.00 1.54 0.00 0.00 36.73 38.47 1uza h TYR 101 CO 0.00 0.95 0.21 0.82 -1.64 0.00 0.00 178.16 178.50 1uza h ILE 102 N 1.07 1.19 -0.31 1.81 2.04 -0.87 0.29 117.51 122.73 1uza h ILE 102 Ca 0.23 -0.54 0.07 0.00 1.00 0.00 0.00 64.86 65.61 1uza h ILE 102 Cb 0.36 0.71 -0.07 0.00 -0.74 0.00 0.00 36.82 37.08 1uza h ILE 102 CO -0.00 0.21 -0.14 1.23 0.00 0.00 0.00 178.15 179.45 1uza h GLY 103 N 0.59 0.12 0.85 5.37 0.00 -0.85 0.24 103.07 109.40 1uza h GLY 103 Ca 0.15 0.17 0.00 0.00 0.00 0.00 0.00 47.33 47.66 1uza h GLY 103 CO -0.02 -0.16 -0.12 -0.25 0.00 0.00 0.00 176.54 176.00 1uza h TRP 104 N -0.08 -0.30 -1.00 5.60 2.91 -0.70 -2.58 115.95 119.80 1uza h TRP 104 Ca 0.16 0.00 0.05 0.00 1.13 0.00 0.00 58.89 60.23 1uza h TRP 104 Cb 0.33 0.12 -0.06 0.00 -0.51 0.00 0.00 29.16 29.03 1uza h TRP 104 CO -0.34 -0.18 0.65 0.82 -1.03 0.00 0.00 178.44 178.36 1uza h ILE 105 N -0.26 1.15 0.00 2.65 1.08 -0.68 0.14 117.51 121.59 1uza h ILE 105 Ca 0.00 -0.42 -0.00 0.00 -0.39 0.00 0.00 64.86 64.05 1uza h ILE 105 Cb 0.25 -0.20 -0.00 0.00 -3.07 0.00 0.00 36.82 33.80 1uza h ILE 105 CO -0.03 0.23 -0.01 0.77 -0.69 0.00 0.00 178.15 178.41 1uza h SER 106 N 1.24 0.00 -0.00 1.72 4.64 -0.55 -2.98 113.55 117.62 1uza h SER 106 Ca 0.41 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.73 1uza h SER 106 Cb 0.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.14 1uza h SER 106 CO -0.14 0.01 -0.02 1.33 -0.87 0.00 0.00 176.83 177.14 1uza n VAL 107 N -3.13 0.00 -0.15 0.95 0.24 -0.78 -4.68 118.33 110.78 1uza n VAL 107 Ca -0.01 -0.49 -0.04 0.00 -2.04 0.00 0.00 64.34 61.76 1uza n VAL 107 Cb 0.18 1.03 0.03 0.00 -1.47 0.00 0.00 33.84 33.61 1uza n VAL 107 CO 0.00 0.00 0.00 -0.61 -2.14 0.00 0.00 176.83 174.08 1uza h GLN 108 N 0.28 -0.03 -0.97 7.34 4.15 -0.59 -0.79 115.11 124.50 1uza h GLN 108 Ca 0.00 0.00 0.01 0.00 0.77 0.00 0.00 58.65 59.44 1uza h GLN 108 Cb 0.07 0.01 -0.05 0.00 0.21 0.00 0.00 27.48 27.72 1uza h GLN 108 CO 0.00 -0.02 0.64 -0.44 -1.93 0.00 0.00 178.83 177.09 1uza h ASP 109 N -0.03 1.11 0.06 -0.69 3.32 -1.87 -0.20 116.42 118.12 1uza h ASP 109 Ca 0.22 -0.03 -0.00 0.00 0.02 0.00 0.00 57.03 57.25 1uza h ASP 109 Cb 0.37 -0.27 0.00 0.00 0.22 0.00 0.00 39.33 39.65 1uza h ASP 109 CO -0.49 0.79 -0.03 1.56 -1.72 0.00 0.00 179.24 179.35 1uza h GLN 110 N 1.30 -0.08 -0.14 3.56 4.20 -1.65 -1.96 115.11 120.33 1uza h GLN 110 Ca 0.36 0.01 0.02 0.00 0.06 0.00 0.00 58.65 59.10 1uza h GLN 110 Cb -0.12 0.02 -0.02 0.00 0.30 0.00 0.00 27.48 27.66 1uza h GLN 110 CO -0.09 0.21 0.01 0.28 -0.67 0.00 0.00 178.83 178.58 1uza h VAL 111 N -0.37 0.92 -0.51 -0.54 2.07 -0.88 -0.97 116.25 115.98 1uza h VAL 111 Ca -0.01 -0.02 -0.09 0.00 0.82 0.00 0.00 66.70 67.40 1uza h VAL 111 Cb 0.32 0.85 -0.02 0.00 -1.52 0.00 0.00 31.29 30.92 1uza h VAL 111 CO 0.01 0.01 -0.04 -0.33 0.02 0.00 0.00 177.57 177.25 1uza h GLU 112 N 0.07 0.93 -0.32 1.57 5.08 -1.09 -0.70 114.58 120.12 1uza h GLU 112 Ca 0.06 -0.32 -0.10 0.00 -1.00 0.00 0.00 59.36 58.00 1uza h GLU 112 Cb 0.07 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 1uza h GLU 112 CO -0.10 0.97 -0.21 0.66 -1.00 0.00 0.00 179.01 179.33 1uza h SER 113 N 0.79 0.74 -0.17 1.42 4.64 -1.22 -1.20 113.55 118.55 1uza h SER 113 Ca 0.14 -0.43 -0.16 0.00 -0.47 0.00 0.00 61.79 60.87 1uza h SER 113 Cb 0.58 -0.21 -0.01 0.00 -0.31 0.00 0.00 62.40 62.46 1uza h SER 113 CO 0.03 1.01 -0.45 -0.07 -0.87 0.00 0.00 176.83 176.48 1uza h LEU 114 N 0.47 0.79 -0.44 5.97 3.38 -1.07 -1.50 115.31 122.91 1uza h LEU 114 Ca 0.06 -0.38 -0.06 0.00 0.09 0.00 0.00 57.88 57.60 1uza h LEU 114 Cb 0.76 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 41.27 1uza h LEU 114 CO 0.06 1.12 0.04 0.58 0.09 0.00 0.00 178.44 180.32 1uza h VAL 115 N 0.58 1.25 -0.82 1.22 2.07 -1.12 -2.40 116.25 117.03 1uza h VAL 115 Ca 0.04 -0.97 0.05 0.00 0.82 0.00 0.00 66.70 66.64 1uza h VAL 115 Cb 1.01 1.02 -0.05 0.00 -1.52 0.00 0.00 31.29 31.74 1uza h VAL 115 CO 0.10 0.33 0.52 0.50 0.02 0.00 0.00 177.57 179.04 1uza h LYS 116 N 0.60 0.94 -0.52 1.57 3.64 -1.09 0.78 116.57 122.49 1uza h LYS 116 Ca 0.13 -0.06 -0.04 0.00 -1.27 0.00 0.00 60.65 59.42 1uza h LYS 116 Cb 0.44 -0.21 -0.02 0.00 -0.41 0.00 0.00 32.23 32.02 1uza h LYS 116 CO 0.02 0.62 0.18 0.37 -2.27 0.00 0.00 179.45 178.37 1uza h GLN 117 N 0.97 0.79 -0.12 1.90 4.15 -1.05 -0.09 115.11 121.67 1uza h GLN 117 Ca 0.34 -0.16 -0.05 0.00 0.77 0.00 0.00 58.65 59.55 1uza h GLN 117 Cb 0.09 -0.12 -0.00 0.00 0.21 0.00 0.00 27.48 27.66 1uza h GLN 117 CO -0.14 0.72 -0.13 1.96 -1.93 0.00 0.00 178.83 179.30 1uza h GLN 118 N 0.70 0.30 -0.14 1.69 1.08 -1.10 -2.98 115.11 114.67 1uza h GLN 118 Ca 0.17 -0.17 -0.06 0.00 -1.45 0.00 0.00 58.65 57.14 1uza h GLN 118 Cb 0.24 0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.67 1uza h GLN 118 CO -0.01 0.71 -0.20 0.00 -0.95 0.00 0.00 178.83 178.38 1uza h ALA 119 N 0.59 1.40 -0.34 3.87 0.00 -0.73 0.04 119.26 124.09 1uza h ALA 119 Ca 0.02 -0.26 -0.07 0.00 0.00 0.00 0.00 54.91 54.60 1uza h ALA 119 Cb 0.66 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.35 1uza h ALA 119 CO 0.03 0.42 -0.08 0.77 0.00 0.00 0.00 179.25 180.38 1uza h SER 120 N 0.22 0.54 0.63 0.00 0.02 -1.00 -2.34 113.55 111.62 1uza h SER 120 Ca 0.04 -0.13 -0.27 0.00 -0.84 0.00 0.00 61.79 60.58 1uza h SER 120 Cb 0.49 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 62.86 1uza h SER 120 CO 0.03 0.67 -1.40 -0.61 -1.14 0.00 0.00 176.83 174.39 1uza h GLN 121 N 0.52 0.13 -2.20 3.45 5.75 -1.25 -3.38 115.11 118.13 1uza h GLN 121 Ca 0.10 -0.22 -0.60 0.00 -0.15 0.00 0.00 58.65 57.79 1uza h GLN 121 Cb 0.46 0.08 -0.42 0.00 1.07 0.00 0.00 27.48 28.68 1uza h GLN 121 CO 0.02 0.96 -0.62 0.66 -2.65 0.00 0.00 178.83 177.20 1uza n TYR 122 N -3.34 3.55 0.34 3.99 4.01 -0.06 -4.94 117.16 120.71 1uza n TYR 122 Ca -0.11 -4.11 0.11 0.00 -0.16 0.00 0.00 57.90 53.63 1uza n TYR 122 Cb 1.01 -0.54 0.50 0.00 -0.31 0.00 0.00 39.34 40.00 1uza n TYR 122 CO 0.00 0.00 0.00 -0.35 -0.46 0.00 0.00 176.86 176.05 1uza n PRO 123 N 0.68 0.17 0.02 -0.72 -0.04 -0.89 -1.82 135.00 132.40 1uza n PRO 123 Ca 0.30 0.47 0.12 0.00 -0.04 0.00 0.00 63.50 64.35 1uza n PRO 123 Cb 0.41 -1.87 0.30 0.00 -0.04 0.00 0.00 33.50 32.30 1uza n PRO 123 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1uza n ASP 124 N -2.21 0.47 -4.81 3.54 5.75 -1.26 -4.95 116.55 113.08 1uza n ASP 124 Ca 0.01 0.00 -0.34 0.00 -0.01 0.00 0.00 54.79 54.46 1uza n ASP 124 Cb 0.18 0.06 -0.07 0.00 -1.03 0.00 0.00 41.12 40.26 1uza n ASP 124 CO 0.00 0.00 0.00 -0.31 -0.11 0.00 0.00 177.20 176.78 1uza s TYR 125 N -3.04 3.41 0.64 2.11 1.51 -0.75 -5.01 117.35 116.22 1uza s TYR 125 Ca 0.10 1.65 -0.11 0.00 -1.01 0.00 0.00 57.07 57.70 1uza s TYR 125 Cb 0.17 -2.86 -0.02 0.00 -0.11 0.00 0.00 41.96 39.13 1uza s TYR 125 CO 0.67 -0.02 1.04 0.00 -1.11 0.00 0.00 175.55 176.13 1uza s ALA 126 N -2.03 2.98 -0.20 3.71 0.00 -0.14 -4.83 121.76 121.25 1uza s ALA 126 Ca 0.59 -0.07 -0.03 0.00 0.00 0.00 0.00 51.96 52.45 1uza s ALA 126 Cb -0.12 -3.10 -0.01 0.00 0.00 0.00 0.00 23.12 19.90 1uza s ALA 126 CO 0.16 -0.85 -0.06 -0.51 0.00 0.00 0.00 175.76 174.50 1uza s LEU 127 N -5.28 2.87 -0.03 0.00 1.43 -0.39 -0.27 118.68 117.00 1uza s LEU 127 Ca 0.56 -0.38 0.07 0.00 -1.03 0.00 0.00 54.13 53.36 1uza s LEU 127 Cb -0.12 -1.72 -0.02 0.00 0.03 0.00 0.00 46.19 44.37 1uza s LEU 127 CO 0.54 0.01 -0.25 -0.89 0.23 0.00 0.00 176.35 175.99 1uza s THR 128 N 1.27 2.08 -0.03 5.49 2.01 0.12 -0.30 115.64 126.28 1uza s THR 128 Ca 0.03 -1.09 0.05 0.00 0.31 0.00 0.00 61.69 60.99 1uza s THR 128 Cb -0.14 -1.72 -0.01 0.00 0.01 0.00 0.00 72.50 70.64 1uza s THR 128 CO -0.02 0.58 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.63 1uza s VAL 129 N -0.49 1.39 0.09 3.82 1.01 -0.18 -0.54 120.40 125.49 1uza s VAL 129 Ca 0.06 -0.72 -0.09 0.00 0.00 0.00 0.00 61.98 61.24 1uza s VAL 129 Cb -0.11 -1.18 -0.00 0.00 0.00 0.00 0.00 36.38 35.09 1uza s VAL 129 CO 0.00 0.40 0.19 0.28 0.00 0.00 0.00 175.10 175.98 1uza s THR 130 N -0.13 0.14 0.00 3.92 -1.32 -0.24 -1.28 115.64 116.73 1uza s THR 130 Ca 0.00 -1.15 0.00 0.00 -1.21 0.00 0.00 61.69 59.33 1uza s THR 130 Cb -0.10 -1.31 0.00 0.00 -1.51 0.00 0.00 72.50 69.58 1uza s THR 130 CO 0.01 -0.63 0.00 0.61 -2.21 0.00 0.00 174.62 172.40 1uza n GLY 131 N -0.02 0.62 3.34 6.08 0.00 -1.19 -1.81 105.19 112.21 1uza n GLY 131 Ca -0.15 -0.94 -0.32 0.00 0.00 0.00 0.00 46.02 44.61 1uza n GLY 131 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1uza s HIS 132 N -2.00 2.55 0.00 1.61 2.46 -1.26 -1.89 115.29 116.77 1uza s HIS 132 Ca 0.00 -0.55 0.00 0.00 0.47 0.00 0.00 55.06 54.98 1uza s HIS 132 Cb 0.00 -1.63 0.00 0.00 -0.13 0.00 0.00 32.58 30.82 1uza s HIS 132 CO 0.00 -0.10 0.00 0.45 -2.47 0.00 0.00 174.74 172.62 1uza n SER 133 N 2.83 0.00 -0.29 9.88 2.88 -0.14 -0.86 113.62 127.91 1uza n SER 133 Ca -0.17 0.00 0.16 0.00 -1.33 0.00 0.00 58.87 57.53 1uza n SER 133 Cb 0.52 0.00 0.43 0.00 -0.75 0.00 0.00 64.21 64.41 1uza n SER 133 CO 0.00 0.00 0.00 0.25 -1.23 0.00 0.00 175.04 174.06 1uza h LEU 134 N 0.00 0.58 -1.58 2.46 6.46 -1.88 -0.04 115.31 121.31 1uza h LEU 134 Ca 0.00 0.06 -0.04 0.00 -0.12 0.00 0.00 57.88 57.78 1uza h LEU 134 Cb 0.00 -0.04 -0.01 0.00 -0.73 0.00 0.00 40.66 39.88 1uza h LEU 134 CO 0.00 0.22 -0.20 1.23 -0.62 0.00 0.00 178.44 179.07 1uza h GLY 135 N 0.57 0.01 0.91 3.75 0.00 -1.03 -1.12 103.07 106.16 1uza h GLY 135 Ca 0.52 -0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.76 1uza h GLY 135 CO -0.26 0.00 -0.14 0.00 0.00 0.00 0.00 176.54 176.14 1uza h ALA 136 N 1.79 0.42 -0.27 3.60 0.00 -0.94 -0.71 119.26 123.14 1uza h ALA 136 Ca -0.00 -0.32 -0.13 0.00 0.00 0.00 0.00 54.91 54.45 1uza h ALA 136 Cb 0.37 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1uza h ALA 136 CO 0.03 0.30 -0.37 0.77 0.00 0.00 0.00 179.25 179.98 1uza h SER 137 N 0.37 0.65 -0.86 0.00 0.02 -1.06 -0.35 113.55 112.31 1uza h SER 137 Ca 0.07 -0.28 0.07 0.00 -0.84 0.00 0.00 61.79 60.81 1uza h SER 137 Cb 0.66 -0.18 -0.06 0.00 0.14 0.00 0.00 62.40 62.95 1uza h SER 137 CO 0.04 0.96 0.53 0.24 -1.14 0.00 0.00 176.83 177.46 1uza h MET 138 N 0.52 0.92 -0.56 3.45 2.86 -1.18 -1.91 114.93 119.02 1uza h MET 138 Ca 0.05 -0.06 -0.06 0.00 -2.06 0.00 0.00 59.70 57.58 1uza h MET 138 Cb 0.87 -0.21 -0.02 0.00 0.06 0.00 0.00 31.60 32.30 1uza h MET 138 CO 0.08 0.61 0.13 0.00 1.06 0.00 0.00 176.91 178.78 1uza h ALA 139 N 1.42 0.74 -0.39 6.32 0.00 -0.64 -1.18 119.26 125.53 1uza h ALA 139 Ca 0.39 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 1uza h ALA 139 Cb 0.22 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1uza h ALA 139 CO -0.19 0.45 0.19 0.00 0.00 0.00 0.00 179.25 179.70 1uza h ALA 140 N 1.02 0.51 -0.53 0.00 0.00 -0.58 0.15 119.26 119.82 1uza h ALA 140 Ca 0.18 -0.11 -0.11 0.00 0.00 0.00 0.00 54.91 54.87 1uza h ALA 140 Cb 0.35 -0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 1uza h ALA 140 CO 0.00 0.07 -0.10 -0.07 0.00 0.00 0.00 179.25 179.15 1uza h LEU 141 N 0.50 1.01 -0.18 0.00 4.07 -1.27 -0.46 115.31 118.99 1uza h LEU 141 Ca 0.14 -0.35 -0.00 0.00 0.08 0.00 0.00 57.88 57.74 1uza h LEU 141 Cb 0.12 -0.28 -0.01 0.00 1.08 0.00 0.00 40.66 41.58 1uza h LEU 141 CO -0.02 1.13 0.10 0.74 -1.08 0.00 0.00 178.44 179.30 1uza h THR 142 N 0.88 1.11 -0.29 0.22 2.02 -1.05 -1.79 112.91 114.01 1uza h THR 142 Ca 0.14 -0.30 -0.10 0.00 0.77 0.00 0.00 66.41 66.92 1uza h THR 142 Cb 0.67 0.98 -0.01 0.00 -1.74 0.00 0.00 68.15 68.04 1uza h THR 142 CO 0.05 0.10 -0.23 0.00 0.37 0.00 0.00 175.52 175.81 1uza h ALA 143 N 0.98 1.06 -0.16 6.16 0.00 -0.55 -0.53 119.26 126.21 1uza h ALA 143 Ca 0.06 -0.34 0.03 0.00 0.00 0.00 0.00 54.91 54.66 1uza h ALA 143 Cb 0.08 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.71 1uza h ALA 143 CO -0.01 0.57 -0.03 0.00 0.00 0.00 0.00 179.25 179.79 1uza h ALA 144 N 1.26 0.12 -0.53 0.00 0.00 -0.80 -0.46 119.26 118.85 1uza h ALA 144 Ca 0.07 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 1uza h ALA 144 Cb 0.66 0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.53 1uza h ALA 144 CO 0.05 -0.47 0.29 0.37 0.00 0.00 0.00 179.25 179.49 1uza h GLN 145 N 0.02 0.74 -0.36 0.00 -0.00 -0.72 -2.75 115.11 112.04 1uza h GLN 145 Ca 0.08 -0.09 -0.08 0.00 -0.00 0.00 0.00 58.65 58.56 1uza h GLN 145 Cb 0.11 -0.14 -0.02 0.00 0.00 0.00 0.00 27.48 27.43 1uza h GLN 145 CO -0.15 0.58 -0.11 -0.07 0.00 0.00 0.00 178.83 179.07 1uza h LEU 146 N 0.71 0.62 -2.34 -2.39 3.38 -0.92 -2.63 115.31 111.74 1uza h LEU 146 Ca 0.19 -0.17 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 1uza h LEU 146 Cb 0.05 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.64 1uza h LEU 146 CO -0.03 0.76 -0.04 0.77 0.09 0.00 0.00 178.44 179.99 1uza h SER 147 N 0.58 0.00 1.35 -0.43 4.64 -0.77 0.31 113.55 119.23 1uza h SER 147 Ca 0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.42 1uza h SER 147 Cb 0.53 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.62 1uza h SER 147 CO 0.03 0.04 0.00 0.00 -0.87 0.00 0.00 176.83 176.03 1uza h ALA 148 N 1.96 1.00 0.00 5.18 0.00 -1.44 -3.36 119.26 122.60 1uza h ALA 148 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1uza h ALA 148 Cb 0.15 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.94 1uza h ALA 148 CO 0.01 0.00 0.00 0.25 0.00 0.00 0.00 179.25 179.51 1uza n THR 149 N -2.98 0.00 -4.14 0.00 -2.24 -0.43 -5.09 114.28 99.41 1uza n THR 149 Ca 0.02 -0.26 -0.11 0.00 -2.27 0.00 0.00 64.05 61.43 1uza n THR 149 Cb 0.38 1.23 -0.10 0.00 -2.10 0.00 0.00 70.33 69.74 1uza n THR 149 CO 0.00 0.00 0.00 -0.31 -0.57 0.00 0.00 175.07 174.19 1uza s TYR 150 N -0.27 0.81 0.32 4.78 2.02 -0.03 -5.12 117.35 119.86 1uza s TYR 150 Ca 0.00 -0.85 -0.07 0.00 -0.37 0.00 0.00 57.07 55.77 1uza s TYR 150 Cb 0.00 -0.48 -0.06 0.00 -0.40 0.00 0.00 41.96 41.02 1uza s TYR 150 CO 0.00 -0.16 0.62 -0.51 -1.57 0.00 0.00 175.55 173.93 1uza s ASP 151 N -2.77 6.49 -0.99 2.29 1.01 -1.26 -4.59 116.67 116.85 1uza s ASP 151 Ca 0.07 0.87 -0.01 0.00 0.71 0.00 0.00 52.55 54.19 1uza s ASP 151 Cb 0.03 -2.21 -0.02 0.00 1.01 0.00 0.00 42.92 41.73 1uza s ASP 151 CO -0.04 -0.24 0.84 0.59 0.21 0.00 0.00 175.17 176.52 1uza n ASN 152 N -0.94 -3.17 -4.76 0.27 3.02 -1.26 -4.46 115.26 103.96 1uza n ASN 152 Ca -0.00 -0.55 -0.37 0.00 -0.03 0.00 0.00 54.58 53.62 1uza n ASN 152 Cb 0.54 -4.50 -0.06 0.00 -0.61 0.00 0.00 39.78 35.14 1uza n ASN 152 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1uza s VAL 153 N -3.32 5.21 0.05 2.41 1.01 -1.26 -1.26 120.40 123.25 1uza s VAL 153 Ca 0.11 0.74 0.07 0.00 0.00 0.00 0.00 61.98 62.90 1uza s VAL 153 Cb -0.01 -3.70 -0.03 0.00 0.00 0.00 0.00 36.38 32.64 1uza s VAL 153 CO 0.63 0.43 -0.19 -0.13 0.00 0.00 0.00 175.10 175.84 1uza s ARG 154 N 0.07 1.22 -0.08 2.72 0.52 0.59 -4.89 118.95 119.10 1uza s ARG 154 Ca 0.21 -0.92 -0.00 0.00 -0.52 0.00 0.00 55.73 54.50 1uza s ARG 154 Cb -0.15 -1.32 0.02 0.00 0.52 0.00 0.00 34.95 34.03 1uza s ARG 154 CO 0.08 0.33 -0.06 -1.17 0.02 0.00 0.00 175.30 174.51 1uza s LEU 155 N -1.27 1.11 -0.22 2.53 2.96 -0.07 -1.01 118.68 122.70 1uza s LEU 155 Ca 0.06 -0.21 0.02 0.00 -0.22 0.00 0.00 54.13 53.77 1uza s LEU 155 Cb -0.09 -0.66 0.04 0.00 0.50 0.00 0.00 46.19 45.98 1uza s LEU 155 CO 0.02 -0.11 -0.15 -0.31 -1.32 0.00 0.00 176.35 174.48 1uza s TYR 156 N 1.51 2.99 0.20 5.38 1.51 -0.40 -0.94 117.35 127.59 1uza s TYR 156 Ca -0.00 -1.97 0.10 0.00 -1.01 0.00 0.00 57.07 54.19 1uza s TYR 156 Cb -0.13 -1.91 -0.04 0.00 -0.11 0.00 0.00 41.96 39.77 1uza s TYR 156 CO -0.04 -0.84 -0.17 0.95 -1.11 0.00 0.00 175.55 174.33 1uza s THR 157 N 1.21 2.73 -0.10 -0.71 -4.23 -0.30 -3.20 115.64 111.03 1uza s THR 157 Ca -0.02 -1.91 -0.01 0.00 -1.18 0.00 0.00 61.69 58.57 1uza s THR 157 Cb -0.17 -2.34 0.03 0.00 1.34 0.00 0.00 72.50 71.36 1uza s THR 157 CO -0.09 -0.14 -0.04 -0.36 -0.54 0.00 0.00 174.62 173.45 1uza s PHE 158 N -1.77 1.14 -1.29 3.99 0.08 -0.79 -0.25 117.98 119.09 1uza s PHE 158 Ca 0.23 -0.54 -0.03 0.00 0.12 0.00 0.00 56.93 56.71 1uza s PHE 158 Cb -0.08 -1.05 0.00 0.00 -0.57 0.00 0.00 43.02 41.32 1uza s PHE 158 CO 0.13 -0.45 0.45 0.41 -0.10 0.00 0.00 175.22 175.66 1uza n GLY 159 N 5.03 -0.30 3.73 4.36 0.00 -0.57 -0.97 105.19 116.46 1uza n GLY 159 Ca -0.10 -0.05 -0.42 0.00 0.00 0.00 0.00 46.02 45.45 1uza n GLY 159 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1uza s GLU 160 N -5.42 4.42 1.13 1.61 2.12 -1.26 -3.64 118.70 117.65 1uza s GLU 160 Ca 0.22 1.92 -0.12 0.00 0.36 0.00 0.00 54.97 57.35 1uza s GLU 160 Cb -0.10 -3.26 0.26 0.00 0.26 0.00 0.00 34.13 31.29 1uza s GLU 160 CO 0.28 -0.24 1.04 -2.14 -0.54 0.00 0.00 175.26 173.66 1uza s PRO 161 N 0.45 -0.63 -0.22 4.30 0.02 -1.26 -3.77 135.00 133.89 1uza s PRO 161 Ca 0.58 0.86 -0.29 0.00 0.02 0.00 0.00 61.00 62.17 1uza s PRO 161 Cb -0.33 -1.59 -0.03 0.00 0.02 0.00 0.00 34.50 32.57 1uza s PRO 161 CO 0.33 -3.54 1.67 1.03 -0.33 0.00 0.00 177.00 176.16 1uza s ARG 162 N -4.53 3.75 0.07 5.54 0.52 -0.31 -4.88 118.95 119.11 1uza s ARG 162 Ca 0.68 1.70 0.26 0.00 -0.52 0.00 0.00 55.73 57.85 1uza s ARG 162 Cb -0.24 -4.07 0.72 0.00 0.52 0.00 0.00 34.95 31.88 1uza s ARG 162 CO 0.63 -1.35 1.59 0.43 0.02 0.00 0.00 175.30 176.63 1uza n SER 163 N 8.66 0.47 0.00 0.23 7.64 -1.26 -4.41 113.62 124.95 1uza n SER 163 Ca 0.20 0.20 0.00 0.00 1.01 0.00 0.00 58.87 60.27 1uza n SER 163 Cb 0.45 -0.16 0.00 0.00 -1.01 0.00 0.00 64.21 63.49 1uza n SER 163 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1uza n GLY 164 N 1.43 1.05 3.15 0.23 0.00 -1.26 -1.30 105.19 108.48 1uza n GLY 164 Ca 0.05 -0.60 -0.20 0.00 0.00 0.00 0.00 46.02 45.28 1uza n GLY 164 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1uza n ASN 165 N 0.00 0.93 0.05 1.61 6.94 -0.25 -0.79 115.26 123.76 1uza n ASN 165 Ca 0.00 -1.84 -0.05 0.00 -0.02 0.00 0.00 54.58 52.68 1uza n ASN 165 Cb 0.00 -0.58 0.16 0.00 -2.36 0.00 0.00 39.78 37.00 1uza n ASN 165 CO 0.00 0.00 0.00 -0.61 -1.03 0.00 0.00 177.26 175.62 1uza h GLN 166 N 0.00 0.36 -0.59 -3.83 5.75 -1.88 -1.77 115.11 113.14 1uza h GLN 166 Ca -0.28 -0.19 0.06 0.00 -0.15 0.00 0.00 58.65 58.09 1uza h GLN 166 Cb 0.99 0.01 -0.05 0.00 1.07 0.00 0.00 27.48 29.49 1uza h GLN 166 CO 0.28 0.74 0.30 0.00 -2.65 0.00 0.00 178.83 177.50 1uza h ALA 167 N 1.24 0.78 -0.55 3.38 0.00 -1.90 0.35 119.26 122.54 1uza h ALA 167 Ca 0.02 0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.89 1uza h ALA 167 Cb 0.90 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.60 1uza h ALA 167 CO 0.08 -0.05 0.08 0.35 0.00 0.00 0.00 179.25 179.71 1uza h PHE 168 N 0.56 0.98 -0.66 0.00 3.57 -1.73 -1.32 116.94 118.34 1uza h PHE 168 Ca 0.27 -0.14 -0.01 0.00 3.53 0.00 0.00 57.97 61.62 1uza h PHE 168 Cb 0.20 -0.27 -0.03 0.00 2.79 0.00 0.00 35.95 38.64 1uza h PHE 168 CO -0.10 0.87 0.38 0.00 -2.23 0.00 0.00 178.31 177.23 1uza h ALA 169 N 0.99 0.84 -0.25 2.41 0.00 -0.86 -1.14 119.26 121.26 1uza h ALA 169 Ca 0.17 -0.09 -0.14 0.00 0.00 0.00 0.00 54.91 54.84 1uza h ALA 169 Cb 0.42 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.94 1uza h ALA 169 CO 0.01 0.34 -0.42 0.77 0.00 0.00 0.00 179.25 179.95 1uza h SER 170 N 0.90 0.64 -0.07 0.00 0.02 -0.79 0.58 113.55 114.83 1uza h SER 170 Ca 0.24 -0.29 0.02 0.00 -0.84 0.00 0.00 61.79 60.91 1uza h SER 170 Cb 0.00 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 62.35 1uza h SER 170 CO -0.04 0.98 -0.02 0.22 -1.14 0.00 0.00 176.83 176.83 1uza h TYR 171 N 0.49 -0.05 -0.75 3.45 5.03 -0.92 -1.65 116.97 122.56 1uza h TYR 171 Ca 0.04 0.01 -0.02 0.00 2.58 0.00 0.00 58.73 61.34 1uza h TYR 171 Cb 0.94 0.03 -0.04 0.00 1.55 0.00 0.00 36.73 39.22 1uza h TYR 171 CO 0.04 -0.04 0.40 0.52 -1.32 0.00 0.00 178.16 177.76 1uza h MET 172 N -0.01 1.05 -0.69 1.82 2.86 -0.93 -0.37 114.93 118.65 1uza h MET 172 Ca 0.04 -0.12 -0.07 0.00 -2.06 0.00 0.00 59.70 57.49 1uza h MET 172 Cb 0.07 -0.21 -0.03 0.00 0.06 0.00 0.00 31.60 31.49 1uza h MET 172 CO -0.08 0.77 0.17 -0.91 1.06 0.00 0.00 176.91 177.92 1uza h ASN 173 N 1.05 1.04 -0.06 1.22 2.35 -0.60 -0.26 115.58 120.32 1uza h ASN 173 Ca 0.27 -0.22 -0.02 0.00 -0.55 0.00 0.00 56.30 55.78 1uza h ASN 173 Cb 0.04 -0.27 -0.00 0.00 0.05 0.00 0.00 38.32 38.13 1uza h ASN 173 CO -0.04 1.00 -0.04 -0.78 -1.65 0.00 0.00 177.43 175.91 1uza h ASP 174 N 1.04 0.14 0.51 5.81 3.58 -0.98 -1.51 116.42 125.01 1uza h ASP 174 Ca 0.22 -0.45 -0.06 0.00 0.42 0.00 0.00 57.03 57.17 1uza h ASP 174 Cb 0.36 -0.04 -0.01 0.00 1.72 0.00 0.00 39.33 41.37 1uza h ASP 174 CO 0.00 0.56 -0.26 0.00 -2.88 0.00 0.00 179.24 176.66 1uza h ALA 175 N 0.59 1.25 -0.27 -0.78 0.00 -0.81 -2.87 119.26 116.36 1uza h ALA 175 Ca 0.01 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1uza h ALA 175 Cb 0.51 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.26 1uza h ALA 175 CO 0.01 0.33 0.00 1.19 0.00 0.00 0.00 179.25 180.78 1uza n PHE 176 N -3.77 0.73 -3.83 0.00 3.01 -0.13 -5.00 117.46 108.47 1uza n PHE 176 Ca -0.01 -0.75 -0.28 0.00 1.01 0.00 0.00 57.45 57.43 1uza n PHE 176 Cb 0.36 -0.21 0.03 0.00 -0.01 0.00 0.00 39.48 39.66 1uza n PHE 176 CO 0.00 0.00 0.00 1.04 1.01 0.00 0.00 176.76 178.81 1uza n GLN 177 N -0.20 -5.73 0.12 -1.08 6.02 -0.92 -0.69 117.38 114.90 1uza n GLN 177 Ca 0.17 0.63 0.12 0.00 -0.01 0.00 0.00 57.00 57.92 1uza n GLN 177 Cb 0.71 -5.48 0.47 0.00 1.02 0.00 0.00 30.24 26.96 1uza n GLN 177 CO 0.00 0.00 0.00 0.28 -1.01 0.00 0.00 177.06 176.33 1uza n VAL 178 N -4.64 0.75 0.14 5.09 0.31 -0.62 -2.47 118.33 116.90 1uza n VAL 178 Ca -0.03 0.07 0.04 0.00 -0.01 0.00 0.00 64.34 64.41 1uza n VAL 178 Cb 0.56 -0.98 0.19 0.00 -0.91 0.00 0.00 33.84 32.71 1uza n VAL 178 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1uza n SER 179 N -2.23 0.14 -3.82 4.52 3.41 -1.26 -4.42 113.62 109.96 1uza n SER 179 Ca 0.03 0.56 -0.12 0.00 -0.26 0.00 0.00 58.87 59.08 1uza n SER 179 Cb 0.29 -0.58 -0.13 0.00 -0.26 0.00 0.00 64.21 63.53 1uza n SER 179 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1uza s SER 180 N -3.26 -0.13 0.66 4.04 0.15 -1.24 -5.01 113.70 108.90 1uza s SER 180 Ca 0.01 0.26 0.40 0.00 0.70 0.00 0.00 55.95 57.32 1uza s SER 180 Cb 0.03 0.26 2.21 0.00 -1.71 0.00 0.00 66.02 66.81 1uza s SER 180 CO 0.11 -0.05 2.27 -0.65 1.20 0.00 0.00 173.24 176.12 1uza h PRO 181 N 5.99 0.00 0.00 5.44 0.11 -1.88 -1.26 132.00 140.41 1uza h PRO 181 Ca -0.26 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.85 1uza h PRO 181 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1uza h PRO 181 CO 0.43 0.00 0.00 0.93 -0.21 0.00 0.00 178.00 179.15 1uza h GLU 182 N 0.00 0.00 0.00 1.05 5.08 -1.95 -3.30 114.58 115.46 1uza h GLU 182 Ca 0.01 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.37 1uza h GLU 182 Cb 0.14 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.39 1uza h GLU 182 CO -0.00 0.00 -0.46 0.25 -1.00 0.00 0.00 179.01 177.80 1uza n THR 183 N -2.81 0.00 -1.77 1.13 -2.24 -0.71 -5.06 114.28 102.81 1uza n THR 183 Ca 0.04 -0.32 -0.41 0.00 -2.27 0.00 0.00 64.05 61.08 1uza n THR 183 Cb 0.44 0.84 -0.00 0.00 -2.10 0.00 0.00 70.33 69.51 1uza n THR 183 CO 0.00 0.00 0.00 1.07 -0.57 0.00 0.00 175.07 175.57 1uza n THR 184 N -1.24 2.01 0.14 4.28 5.66 -0.56 -4.72 114.28 119.86 1uza n THR 184 Ca 0.00 -0.50 0.05 0.00 -3.05 0.00 0.00 64.05 60.56 1uza n THR 184 Cb 0.07 -1.96 0.09 0.00 -1.55 0.00 0.00 70.33 66.99 1uza n THR 184 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1uza n GLN 185 N 0.43 1.64 -4.02 1.09 1.13 0.13 -4.91 117.38 112.87 1uza n GLN 185 Ca 0.01 -1.56 -0.31 0.00 -1.94 0.00 0.00 57.00 53.20 1uza n GLN 185 Cb 0.39 -1.23 -0.15 0.00 0.11 0.00 0.00 30.24 29.36 1uza n GLN 185 CO 0.00 0.00 0.00 -0.47 -1.44 0.00 0.00 177.06 175.15 1uza s TYR 186 N -0.93 3.12 -0.41 1.08 5.04 -1.26 -0.89 117.35 123.10 1uza s TYR 186 Ca 0.17 -2.31 -0.07 0.00 -2.44 0.00 0.00 57.07 52.42 1uza s TYR 186 Cb 0.10 -2.03 0.09 0.00 0.35 0.00 0.00 41.96 40.46 1uza s TYR 186 CO 0.14 -0.87 0.23 -0.06 -1.34 0.00 0.00 175.55 173.65 1uza s PHE 187 N 1.15 3.40 -0.67 4.97 0.40 -0.12 -2.54 117.98 124.57 1uza s PHE 187 Ca -0.04 -1.83 -0.14 0.00 -0.60 0.00 0.00 56.93 54.32 1uza s PHE 187 Cb -0.19 -2.99 0.17 0.00 0.51 0.00 0.00 43.02 40.52 1uza s PHE 187 CO -0.06 -0.89 0.61 0.50 0.70 0.00 0.00 175.22 176.08 1uza s ARG 188 N 1.33 3.23 -0.12 0.44 3.52 0.13 -1.14 118.95 126.33 1uza s ARG 188 Ca 0.04 -2.09 -0.20 0.00 -0.13 0.00 0.00 55.73 53.34 1uza s ARG 188 Cb -0.23 -4.32 -0.04 0.00 -1.56 0.00 0.00 34.95 28.80 1uza s ARG 188 CO -0.00 -1.30 0.57 0.08 -0.81 0.00 0.00 175.30 173.84 1uza s VAL 189 N 0.86 5.11 0.35 7.11 1.01 0.65 -1.38 120.40 134.11 1uza s VAL 189 Ca 0.11 1.14 0.05 0.00 0.00 0.00 0.00 61.98 63.28 1uza s VAL 189 Cb -0.20 -3.91 -0.07 0.00 0.00 0.00 0.00 36.38 32.20 1uza s VAL 189 CO -0.03 0.25 0.03 0.42 0.00 0.00 0.00 175.10 175.77 1uza s THR 190 N 0.98 1.56 -0.06 3.92 -4.23 -0.10 -1.52 115.64 116.20 1uza s THR 190 Ca 0.30 -2.01 -0.02 0.00 -1.18 0.00 0.00 61.69 58.77 1uza s THR 190 Cb -0.16 -2.85 0.04 0.00 1.34 0.00 0.00 72.50 70.87 1uza s THR 190 CO 0.12 -0.03 0.11 -2.28 -0.54 0.00 0.00 174.62 172.00 1uza s HIS 191 N -3.03 -0.07 0.00 3.99 2.46 -1.26 -0.70 115.29 116.67 1uza s HIS 191 Ca 0.35 0.40 0.00 0.00 0.47 0.00 0.00 55.06 56.28 1uza s HIS 191 Cb 0.09 -0.28 0.00 0.00 -0.13 0.00 0.00 32.58 32.25 1uza s HIS 191 CO 0.16 -0.20 0.00 0.45 -2.47 0.00 0.00 174.74 172.69 1uza n SER 192 N 4.89 0.00 -2.27 9.88 2.88 0.20 -0.75 113.62 128.46 1uza n SER 192 Ca -0.13 0.00 -0.33 0.00 -1.33 0.00 0.00 58.87 57.08 1uza n SER 192 Cb 0.50 0.00 0.07 0.00 -0.75 0.00 0.00 64.21 64.04 1uza n SER 192 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 1uza n ASN 193 N 1.68 7.16 -4.64 -3.46 6.94 -1.26 -4.52 115.26 117.17 1uza n ASN 193 Ca 0.00 -3.78 -0.51 0.00 -0.02 0.00 0.00 54.58 50.27 1uza n ASN 193 Cb 0.00 -0.87 -0.05 0.00 -2.36 0.00 0.00 39.78 36.49 1uza n ASN 193 CO 0.00 0.00 0.00 -0.67 -1.03 0.00 0.00 177.26 175.56 1uza n ASP 194 N -0.89 2.39 0.21 0.53 -0.08 0.07 -3.77 116.55 115.02 1uza n ASP 194 Ca 0.60 1.08 0.12 0.00 -1.51 0.00 0.00 54.79 55.08 1uza n ASP 194 Cb 0.73 -1.27 0.15 0.00 2.34 0.00 0.00 41.12 43.07 1uza n ASP 194 CO 0.00 0.00 0.00 1.23 0.12 0.00 0.00 177.20 178.55 1uza h GLY 195 N 5.91 0.00 1.05 0.27 0.00 -1.71 -3.37 103.07 105.21 1uza h GLY 195 Ca -0.47 0.00 -0.06 0.00 0.00 0.00 0.00 47.33 46.81 1uza h GLY 195 CO 0.86 0.00 0.24 -2.22 0.00 0.00 0.00 176.54 175.41 1uza h ILE 196 N 0.00 1.26 0.00 2.60 1.08 -1.87 -2.09 117.51 118.49 1uza h ILE 196 Ca -0.00 -0.89 0.00 0.00 -0.39 0.00 0.00 64.86 63.58 1uza h ILE 196 Cb 1.01 0.46 0.00 0.00 -3.07 0.00 0.00 36.82 35.22 1uza h ILE 196 CO 0.00 0.35 0.00 -2.65 -0.69 0.00 0.00 178.15 175.16 1uza n PRO 197 N -4.28 0.02 -0.09 2.37 -0.02 -1.25 -1.35 135.00 130.39 1uza n PRO 197 Ca 0.06 0.50 0.11 0.00 -2.02 0.00 0.00 63.50 62.15 1uza n PRO 197 Cb 0.22 -1.55 0.34 0.00 -0.02 0.00 0.00 33.50 32.48 1uza n PRO 197 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1uza n ASN 198 N -1.59 2.13 -4.25 2.55 3.02 -0.78 -4.53 115.26 111.81 1uza n ASN 198 Ca 0.00 -1.77 -0.25 0.00 -0.03 0.00 0.00 54.58 52.53 1uza n ASN 198 Cb 0.02 -0.12 -0.14 0.00 -0.61 0.00 0.00 39.78 38.93 1uza n ASN 198 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1uza s LEU 199 N -1.63 2.18 0.87 3.41 1.43 -0.46 -3.41 118.68 121.07 1uza s LEU 199 Ca 0.34 -0.53 -0.11 0.00 -1.03 0.00 0.00 54.13 52.79 1uza s LEU 199 Cb 0.19 -0.95 0.12 0.00 0.03 0.00 0.00 46.19 45.58 1uza s LEU 199 CO 0.28 0.15 1.17 -2.84 0.23 0.00 0.00 176.35 175.34 1uza s PRO 200 N -1.23 1.26 0.51 1.29 0.02 -1.26 -1.16 135.00 134.43 1uza s PRO 200 Ca 0.07 1.63 -0.23 0.00 0.02 0.00 0.00 61.00 62.50 1uza s PRO 200 Cb -0.09 -1.75 -0.07 0.00 0.02 0.00 0.00 34.50 32.62 1uza s PRO 200 CO 0.02 -2.47 1.30 -2.30 -0.33 0.00 0.00 177.00 173.22 1uza n PRO 201 N -3.87 1.72 -0.22 5.54 -0.02 -1.22 -4.71 135.00 132.22 1uza n PRO 201 Ca 0.12 0.62 0.08 0.00 -2.02 0.00 0.00 63.50 62.31 1uza n PRO 201 Cb 0.51 -2.48 0.35 0.00 -0.02 0.00 0.00 33.50 31.86 1uza n PRO 201 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1uza h ALA 202 N 1.58 1.73 0.00 3.55 0.00 -1.81 -1.77 119.26 122.54 1uza h ALA 202 Ca -0.50 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.40 1uza h ALA 202 Cb 1.31 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.91 1uza h ALA 202 CO 0.57 0.12 0.00 -0.85 0.00 0.00 0.00 179.25 179.09 1uza n GLU 203 N -4.50 0.01 -0.06 0.00 0.00 -1.26 -0.77 120.64 114.05 1uza n GLU 203 Ca 0.13 0.26 0.04 0.00 0.00 0.00 0.00 57.16 57.59 1uza n GLU 203 Cb 0.30 -1.51 0.17 0.00 0.00 0.00 0.00 31.44 30.40 1uza n GLU 203 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.13 178.17 1uza n GLN 204 N -1.52 1.29 -0.60 3.44 6.02 -0.66 -4.88 117.38 120.47 1uza n GLN 204 Ca 0.03 -0.45 0.00 0.00 -0.01 0.00 0.00 57.00 56.57 1uza n GLN 204 Cb 0.17 -1.16 0.00 0.00 1.02 0.00 0.00 30.24 30.26 1uza n GLN 204 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1uza n GLY 205 N 0.76 1.03 3.69 1.08 0.00 0.05 -4.99 105.19 106.81 1uza n GLY 205 Ca 0.07 -0.40 -0.28 0.00 0.00 0.00 0.00 46.02 45.41 1uza n GLY 205 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1uza s TYR 206 N -2.00 2.94 0.02 1.61 1.51 -0.93 -4.13 117.35 116.38 1uza s TYR 206 Ca 0.00 -0.08 -0.15 0.00 -1.01 0.00 0.00 57.07 55.83 1uza s TYR 206 Cb 0.00 -1.46 0.03 0.00 -0.11 0.00 0.00 41.96 40.41 1uza s TYR 206 CO 0.00 0.50 0.34 0.00 -1.11 0.00 0.00 175.55 175.28 1uza s ALA 207 N -1.55 -0.81 0.13 3.71 0.00 0.03 -4.43 121.76 118.84 1uza s ALA 207 Ca 0.27 0.22 -0.05 0.00 0.00 0.00 0.00 51.96 52.39 1uza s ALA 207 Cb -0.10 0.22 -0.05 0.00 0.00 0.00 0.00 23.12 23.19 1uza s ALA 207 CO 0.19 -0.36 0.37 -1.01 0.00 0.00 0.00 175.76 174.95 1uza s HIS 208 N -2.05 3.49 0.16 0.00 3.76 -1.26 -4.20 115.29 115.19 1uza s HIS 208 Ca -0.08 0.57 0.01 0.00 -0.15 0.00 0.00 55.06 55.41 1uza s HIS 208 Cb -0.02 -2.01 0.01 0.00 1.11 0.00 0.00 32.58 31.67 1uza s HIS 208 CO 0.00 0.46 0.11 0.41 -0.85 0.00 0.00 174.74 174.87 1uza n GLY 209 N 0.22 3.03 0.00 -2.22 0.00 -1.26 -4.88 105.19 100.08 1uza n GLY 209 Ca -0.03 -2.21 0.00 0.00 0.00 0.00 0.00 46.02 43.78 1uza n GLY 209 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1uza n GLY 210 N 3.12 -1.30 3.70 -0.02 0.00 -1.26 -4.84 105.19 104.59 1uza n GLY 210 Ca -0.01 -1.59 -0.40 0.00 0.00 0.00 0.00 46.02 44.01 1uza n GLY 210 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1uza s VAL 211 N -2.34 5.00 -0.02 1.61 1.01 -1.05 -4.91 120.40 119.69 1uza s VAL 211 Ca 0.00 1.51 -0.23 0.00 0.00 0.00 0.00 61.98 63.26 1uza s VAL 211 Cb 0.00 -4.07 -0.05 0.00 0.00 0.00 0.00 36.38 32.26 1uza s VAL 211 CO 0.00 0.19 0.68 -0.70 0.00 0.00 0.00 175.10 175.28 1uza s GLU 212 N 1.16 4.42 -0.33 2.72 2.12 -0.78 -0.69 118.70 127.32 1uza s GLU 212 Ca 0.38 0.88 0.01 0.00 0.36 0.00 0.00 54.97 56.61 1uza s GLU 212 Cb -0.18 -3.39 0.08 0.00 0.26 0.00 0.00 34.13 30.91 1uza s GLU 212 CO 0.17 0.22 0.03 0.71 -0.54 0.00 0.00 175.26 175.86 1uza s TYR 213 N 0.26 3.52 -0.43 5.30 1.51 -0.48 -0.23 117.35 126.80 1uza s TYR 213 Ca 0.36 -2.51 -0.17 0.00 -1.01 0.00 0.00 57.07 53.73 1uza s TYR 213 Cb -0.19 -2.60 0.03 0.00 -0.11 0.00 0.00 41.96 39.09 1uza s TYR 213 CO 0.19 -0.91 0.44 -0.46 -1.11 0.00 0.00 175.55 173.70 1uza s TRP 214 N 1.06 3.17 -0.32 2.71 -0.00 0.62 -0.93 118.94 125.26 1uza s TRP 214 Ca 0.03 -0.44 -0.25 0.00 -0.00 0.00 0.00 56.10 55.44 1uza s TRP 214 Cb -0.20 -2.95 0.01 0.00 -0.00 0.00 0.00 33.47 30.32 1uza s TRP 214 CO -0.05 -0.73 0.87 0.45 -0.00 0.00 0.00 176.95 177.49 1uza s SER 215 N 1.93 6.72 0.03 5.86 0.15 0.12 -0.90 113.70 127.62 1uza s SER 215 Ca 0.11 0.72 -0.00 0.00 0.70 0.00 0.00 55.95 57.48 1uza s SER 215 Cb -0.18 -2.45 -0.04 0.00 -1.71 0.00 0.00 66.02 61.65 1uza s SER 215 CO 0.13 -0.72 0.15 -0.69 1.20 0.00 0.00 173.24 173.31 1uza s VAL 216 N 3.20 5.08 0.32 4.45 1.01 -0.61 -0.63 120.40 133.23 1uza s VAL 216 Ca 0.36 -0.40 -0.16 0.00 0.00 0.00 0.00 61.98 61.78 1uza s VAL 216 Cb -0.13 -3.41 -0.09 0.00 0.00 0.00 0.00 36.38 32.75 1uza s VAL 216 CO 0.14 0.24 0.75 -1.81 0.00 0.00 0.00 175.10 174.42 1uza s ASP 217 N -2.14 6.81 0.24 3.32 1.01 -1.26 -3.18 116.67 121.47 1uza s ASP 217 Ca 0.29 1.32 -0.30 0.00 0.71 0.00 0.00 52.55 54.57 1uza s ASP 217 Cb -0.12 -2.39 -0.09 0.00 1.01 0.00 0.00 42.92 41.32 1uza s ASP 217 CO 0.21 -0.19 1.29 -2.16 0.21 0.00 0.00 175.17 174.52 1uza s PRO 218 N -2.90 4.40 0.36 8.23 0.04 -1.26 -5.09 135.00 138.78 1uza s PRO 218 Ca 0.54 2.07 -0.27 0.00 0.04 0.00 0.00 61.00 63.37 1uza s PRO 218 Cb -0.11 -3.16 -0.09 0.00 0.04 0.00 0.00 34.50 31.17 1uza s PRO 218 CO 0.17 -0.19 1.27 1.52 0.04 0.00 0.00 177.00 179.81 1uza s TYR 219 N -0.31 3.02 -0.14 0.56 -0.85 -1.19 -4.77 117.35 113.68 1uza s TYR 219 Ca 0.54 1.45 -0.34 0.00 -0.52 0.00 0.00 57.07 58.20 1uza s TYR 219 Cb -0.37 -3.61 0.15 0.00 0.38 0.00 0.00 41.96 38.51 1uza s TYR 219 CO 0.42 -1.76 1.41 -1.54 -1.52 0.00 0.00 175.55 172.56 1uza s SER 220 N -0.68 -0.01 0.23 -0.18 1.04 -1.26 -4.97 113.70 107.86 1uza s SER 220 Ca 0.52 -0.02 -0.07 0.00 0.48 0.00 0.00 55.95 56.86 1uza s SER 220 Cb -0.37 0.03 0.27 0.00 0.10 0.00 0.00 66.02 66.04 1uza s SER 220 CO 0.49 -0.05 1.87 0.00 0.98 0.00 0.00 173.24 176.53 1uza h ALA 221 N 2.00 1.13 0.00 5.32 0.00 -1.92 -2.67 119.26 123.12 1uza h ALA 221 Ca -0.25 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1uza h ALA 221 Cb 1.17 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.68 1uza h ALA 221 CO 0.27 0.37 0.00 -0.56 0.00 0.00 0.00 179.25 179.33 1uza h GLN 222 N 1.05 0.00 -0.28 0.00 -0.00 -1.96 -1.90 115.11 112.03 1uza h GLN 222 Ca 0.34 0.00 -0.11 0.00 -0.00 0.00 0.00 58.65 58.88 1uza h GLN 222 Cb 0.03 0.00 -0.06 0.00 -0.00 0.00 0.00 27.48 27.44 1uza h GLN 222 CO -0.12 0.00 -0.07 -1.71 -0.00 0.00 0.00 178.83 176.93 1uza n ASN 223 N -2.41 2.80 -4.41 0.06 5.15 -1.02 -4.14 115.26 111.30 1uza n ASN 223 Ca 0.03 -3.52 -0.33 0.00 -0.60 0.00 0.00 54.58 50.16 1uza n ASN 223 Cb 0.32 -0.59 -0.14 0.00 -0.53 0.00 0.00 39.78 38.84 1uza n ASN 223 CO 0.00 0.00 0.00 -0.89 1.40 0.00 0.00 177.26 177.77 1uza s THR 224 N -3.11 2.94 0.01 -0.44 2.01 -1.10 -1.58 115.64 114.38 1uza s THR 224 Ca 0.43 -0.74 0.04 0.00 0.31 0.00 0.00 61.69 61.73 1uza s THR 224 Cb 0.38 -2.18 -0.03 0.00 0.01 0.00 0.00 72.50 70.68 1uza s THR 224 CO 0.02 0.56 -0.11 -0.36 -0.69 0.00 0.00 174.62 174.04 1uza s PHE 225 N -0.22 2.77 -0.28 4.92 0.40 -0.07 -0.49 117.98 125.01 1uza s PHE 225 Ca 0.00 -0.12 -0.08 0.00 -0.60 0.00 0.00 56.93 56.14 1uza s PHE 225 Cb -0.13 -1.56 -0.01 0.00 0.51 0.00 0.00 43.02 41.82 1uza s PHE 225 CO 0.03 0.32 0.10 0.08 0.70 0.00 0.00 175.22 176.45 1uza s VAL 226 N -0.95 4.34 -0.15 -0.44 1.01 -0.13 -0.27 120.40 123.80 1uza s VAL 226 Ca 0.16 -0.35 0.02 0.00 0.00 0.00 0.00 61.98 61.80 1uza s VAL 226 Cb -0.11 -3.13 0.02 0.00 0.00 0.00 0.00 36.38 33.16 1uza s VAL 226 CO 0.06 0.20 -0.19 0.00 0.00 0.00 0.00 175.10 175.17 1uza s THR 228 N 1.11 0.58 0.00 0.00 -4.23 -1.26 -1.87 115.64 109.97 1uza s THR 228 Ca -0.01 -1.97 0.00 0.00 -1.18 0.00 0.00 61.69 58.54 1uza s THR 228 Cb -0.14 -2.14 0.00 0.00 1.34 0.00 0.00 72.50 71.56 1uza s THR 228 CO -0.08 -0.45 0.00 0.61 -0.54 0.00 0.00 174.62 174.17 1uza n GLY 229 N -0.23 -2.16 0.50 3.99 0.00 -1.26 -4.73 105.19 101.29 1uza n GLY 229 Ca -0.06 -1.50 0.12 0.00 0.00 0.00 0.00 46.02 44.58 1uza n GLY 229 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1uza n ASP 230 N 0.46 1.86 -4.78 1.61 8.00 -1.26 -4.96 116.55 117.48 1uza n ASP 230 Ca 0.00 -1.42 -0.35 0.00 0.71 0.00 0.00 54.79 53.73 1uza n ASP 230 Cb 0.00 0.26 -0.00 0.00 -0.02 0.00 0.00 41.12 41.36 1uza n ASP 230 CO 0.00 0.00 0.00 -1.83 -0.39 0.00 0.00 177.20 174.98 1uza s GLU 231 N -2.36 3.39 -0.11 -1.24 1.03 -1.26 -4.99 118.70 113.16 1uza s GLU 231 Ca 0.23 1.52 -0.30 0.00 0.03 0.00 0.00 54.97 56.46 1uza s GLU 231 Cb 0.19 -2.02 -0.02 0.00 -0.80 0.00 0.00 34.13 31.48 1uza s GLU 231 CO 0.49 -0.80 1.21 0.08 -1.33 0.00 0.00 175.26 174.91 1uza s VAL 232 N -1.90 4.31 0.34 1.83 1.01 -1.26 -4.95 120.40 119.77 1uza s VAL 232 Ca 0.71 1.61 -0.17 0.00 0.00 0.00 0.00 61.98 64.12 1uza s VAL 232 Cb -0.22 -4.04 0.06 0.00 0.00 0.00 0.00 36.38 32.19 1uza s VAL 232 CO 0.27 -0.06 0.85 0.00 0.00 0.00 0.00 175.10 176.16 1uza s GLN 233 N 2.72 2.02 2.49 2.72 -2.07 -1.26 -4.80 119.66 121.48 1uza s GLN 233 Ca 0.55 -1.30 0.00 0.00 -1.82 0.00 0.00 55.36 52.79 1uza s GLN 233 Cb -0.23 0.57 0.00 0.00 -1.09 0.00 0.00 33.01 32.26 1uza s GLN 233 CO 0.18 -0.95 0.00 0.00 -1.32 0.00 0.00 175.29 173.21 1uza h GLU 236 N 0.99 0.00 0.00 0.00 3.07 -1.81 -1.18 114.58 115.65 1uza h GLU 236 Ca 0.32 0.00 -0.00 0.00 -0.50 0.00 0.00 59.36 59.18 1uza h GLU 236 Cb 0.02 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 27.93 1uza h GLU 236 CO -0.12 0.27 -0.01 0.00 -1.40 0.00 0.00 179.01 177.75 1uza h ALA 237 N 1.73 1.00 0.00 3.43 0.00 -1.14 -3.16 119.26 121.13 1uza h ALA 237 Ca -0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1uza h ALA 237 Cb 0.59 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.38 1uza h ALA 237 CO 0.03 0.02 0.00 1.96 0.00 0.00 0.00 179.25 181.26 1uza h GLN 238 N 0.00 0.00 -3.32 0.00 1.08 -1.25 -3.48 115.11 108.15 1uza h GLN 238 Ca -0.00 0.00 -0.36 0.00 -1.45 0.00 0.00 58.65 56.84 1uza h GLN 238 Cb 0.62 0.00 0.02 0.00 -0.05 0.00 0.00 27.48 28.07 1uza h GLN 238 CO 0.00 0.00 -0.50 0.41 -0.95 0.00 0.00 178.83 177.79 1uza n GLY 239 N 0.82 -0.38 3.73 3.46 0.00 -1.20 -4.98 105.19 106.64 1uza n GLY 239 Ca 0.04 -0.05 -0.37 0.00 0.00 0.00 0.00 46.02 45.64 1uza n GLY 239 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1uza s GLY 240 N -2.47 2.81 -0.37 -0.02 0.00 -1.25 -4.98 107.32 101.04 1uza s GLY 240 Ca 0.14 1.19 -0.03 0.00 0.00 0.00 0.00 44.72 46.01 1uza s GLY 240 CO 0.17 1.61 0.14 1.20 0.00 0.00 0.00 173.10 176.22 1uza s GLN 241 N -3.44 2.23 3.31 2.90 -1.52 -1.26 -4.34 119.66 117.54 1uza s GLN 241 Ca 0.82 -1.57 0.00 0.00 -1.95 0.00 0.00 55.36 52.66 1uza s GLN 241 Cb -0.37 -3.47 0.00 0.00 -0.22 0.00 0.00 33.01 28.95 1uza s GLN 241 CO 0.41 -0.89 0.00 0.41 -0.25 0.00 0.00 175.29 174.96 1uza n GLY 242 N 4.65 0.26 3.59 3.09 0.00 -1.26 -4.49 105.19 111.02 1uza n GLY 242 Ca -0.07 -0.88 -0.43 0.00 0.00 0.00 0.00 46.02 44.64 1uza n GLY 242 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1uza s VAL 243 N 0.00 4.15 0.42 1.61 1.01 -1.26 -2.75 120.40 123.58 1uza s VAL 243 Ca 0.00 1.02 0.02 0.00 0.00 0.00 0.00 61.98 63.02 1uza s VAL 243 Cb 0.00 -4.64 -0.01 0.00 0.00 0.00 0.00 36.38 31.73 1uza s VAL 243 CO 0.00 -1.14 0.07 -0.46 0.00 0.00 0.00 175.10 173.57 1uza n ASN 244 N 8.04 2.19 -0.25 3.32 0.23 -1.26 -5.02 115.26 122.51 1uza n ASN 244 Ca 0.10 -3.04 0.02 0.00 -0.53 0.00 0.00 54.58 51.13 1uza n ASN 244 Cb 0.49 0.67 0.25 0.00 -2.08 0.00 0.00 39.78 39.11 1uza n ASN 244 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 1uza h ASP 245 N 1.34 0.86 0.01 0.53 3.32 -1.96 -1.53 116.42 118.99 1uza h ASP 245 Ca -0.34 -0.01 -0.03 0.00 0.02 0.00 0.00 57.03 56.66 1uza h ASP 245 Cb 1.16 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 40.50 1uza h ASP 245 CO 0.55 0.60 -0.08 0.00 -1.72 0.00 0.00 179.24 178.59 1uza h ALA 246 N 1.53 1.64 -0.36 3.45 0.00 -1.90 -2.48 119.26 121.14 1uza h ALA 246 Ca 0.32 -0.15 -0.13 0.00 0.00 0.00 0.00 54.91 54.95 1uza h ALA 246 Cb 0.03 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1uza h ALA 246 CO -0.09 0.27 -0.31 1.25 0.00 0.00 0.00 179.25 180.37 1uza h HIS 247 N 0.18 0.90 0.00 0.00 -0.00 -1.58 -3.29 115.15 111.37 1uza h HIS 247 Ca 0.04 -0.23 -0.05 0.00 -0.00 0.00 0.00 60.37 60.13 1uza h HIS 247 Cb 0.27 -0.20 -0.01 0.00 -0.00 0.00 0.00 27.41 27.47 1uza h HIS 247 CO 0.00 0.98 -0.22 1.79 -0.00 0.00 0.00 177.93 180.49 1uza h THR 248 N 0.65 0.40 -3.50 6.26 1.35 -1.30 -3.44 112.91 113.34 1uza h THR 248 Ca 0.07 -1.42 -0.58 0.00 -0.55 0.00 0.00 66.41 63.93 1uza h THR 248 Cb 0.84 2.08 -0.39 0.00 -1.73 0.00 0.00 68.15 68.95 1uza h THR 248 CO 0.07 0.21 -0.78 -0.89 -0.25 0.00 0.00 175.52 173.89 1uza s THR 249 N -3.23 1.21 -0.15 6.82 2.01 -1.18 -1.77 115.64 119.35 1uza s THR 249 Ca 0.04 -1.06 -0.02 0.00 0.31 0.00 0.00 61.69 60.97 1uza s THR 249 Cb 0.07 -1.58 -0.02 0.00 0.01 0.00 0.00 72.50 70.98 1uza s THR 249 CO 0.68 -0.18 -0.09 -0.31 -0.69 0.00 0.00 174.62 174.03 1uza s TYR 250 N 1.54 2.89 -1.65 4.92 1.51 -0.79 -4.57 117.35 121.19 1uza s TYR 250 Ca -0.03 -0.59 -0.16 0.00 -1.01 0.00 0.00 57.07 55.28 1uza s TYR 250 Cb -0.18 -1.91 0.13 0.00 -0.11 0.00 0.00 41.96 39.89 1uza s TYR 250 CO -0.08 -0.21 0.79 1.19 -1.11 0.00 0.00 175.55 176.13 1uza n PHE 251 N 3.70 -1.82 -0.98 2.71 3.72 -1.26 -1.17 117.46 122.36 1uza n PHE 251 Ca -0.18 0.81 0.00 0.00 -0.05 0.00 0.00 57.45 58.03 1uza n PHE 251 Cb 0.52 -3.18 0.00 0.00 -0.94 0.00 0.00 39.48 35.89 1uza n PHE 251 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1uza n GLY 252 N -1.50 0.54 3.26 1.37 0.00 -1.26 -4.99 105.19 102.60 1uza n GLY 252 Ca 0.04 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.70 1uza n GLY 252 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1uza s MET 253 N -0.29 2.88 0.28 1.61 -1.94 -0.32 -5.01 119.30 116.52 1uza s MET 253 Ca 0.00 -0.98 -0.26 0.00 -1.71 0.00 0.00 55.69 52.74 1uza s MET 253 Cb 0.00 -3.19 -0.09 0.00 2.01 0.00 0.00 34.83 33.56 1uza s MET 253 CO 0.00 -0.46 0.91 0.99 -0.01 0.00 0.00 175.02 176.45 1uza s THR 254 N 1.39 4.22 -0.24 2.05 2.01 -1.26 -1.89 115.64 121.92 1uza s THR 254 Ca 0.00 1.83 -0.40 0.00 0.31 0.00 0.00 61.69 63.44 1uza s THR 254 Cb -0.17 -4.08 -0.16 0.00 0.01 0.00 0.00 72.50 68.09 1uza s THR 254 CO -0.01 0.26 1.68 -1.20 -0.69 0.00 0.00 174.62 174.67 1uza n SER 255 N 0.87 2.25 0.00 3.53 7.64 -0.73 -1.61 113.62 125.56 1uza n SER 255 Ca 0.00 1.08 0.00 0.00 1.01 0.00 0.00 58.87 60.97 1uza n SER 255 Cb 0.49 -1.14 0.00 0.00 -1.01 0.00 0.00 64.21 62.55 1uza n SER 255 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1uza n GLY 256 N 3.96 0.85 0.10 0.23 0.00 -0.50 -4.88 105.19 104.94 1uza n GLY 256 Ca 0.26 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.25 1uza n GLY 256 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1uza h ALA 257 N 0.00 0.55 -5.92 4.61 0.00 -1.57 -3.44 119.26 113.49 1uza h ALA 257 Ca 0.00 -0.77 -0.42 0.00 0.00 0.00 0.00 54.91 53.71 1uza h ALA 257 Cb 0.01 -0.02 0.08 0.00 0.00 0.00 0.00 17.79 17.86 1uza h ALA 257 CO 0.00 1.00 -0.70 0.00 0.00 0.00 0.00 179.25 179.55 1uza n THR 259 N -4.90 0.00 -3.00 0.00 -2.24 -1.26 -4.91 114.28 97.97 1uza n THR 259 Ca 0.02 -0.04 -0.33 0.00 -2.27 0.00 0.00 64.05 61.42 1uza n THR 259 Cb 0.55 0.24 -0.06 0.00 -2.10 0.00 0.00 70.33 68.96 1uza n THR 259 CO 0.00 0.00 0.00 -1.66 -0.57 0.00 0.00 175.07 172.84 1uza s TRP 260 N -2.81 3.35 0.00 4.78 -2.14 -1.26 -5.15 118.94 115.71 1uza s TRP 260 Ca 0.16 1.37 0.00 0.00 2.66 0.00 0.00 56.10 60.29 1uza s TRP 260 Cb 0.18 -2.66 0.00 0.00 -3.10 0.00 0.00 33.47 27.89 1uza s TRP 260 CO 0.62 0.01 0.00 1.55 -2.66 0.00 0.00 176.95 176.47