#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3du0 n PHE 2 N 0.00 2.53 -4.26 3.17 3.72 -1.26 -4.78 117.46 116.58 3du0 n PHE 2 Ca 0.00 -3.17 -0.14 0.00 -0.05 0.00 0.00 57.45 54.09 3du0 n PHE 2 Cb 0.00 -0.25 -0.10 0.00 -0.94 0.00 0.00 39.48 38.19 3du0 n PHE 2 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 176.76 177.66 3du0 s THR 3 N -4.41 0.43 0.00 4.37 -4.23 -1.26 -4.83 115.64 105.71 3du0 s THR 3 Ca 0.41 -1.99 0.00 0.00 -1.18 0.00 0.00 61.69 58.93 3du0 s THR 3 Cb 0.40 -2.44 0.00 0.00 1.34 0.00 0.00 72.50 71.80 3du0 s THR 3 CO -0.10 -0.15 0.00 0.61 -0.54 0.00 0.00 174.62 174.44 3du0 n GLY 4 N -0.34 -0.53 3.54 3.99 0.00 -0.66 -4.62 105.19 106.57 3du0 n GLY 4 Ca -0.02 -1.11 -0.43 0.00 0.00 0.00 0.00 46.02 44.47 3du0 n GLY 4 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3du0 s SER 5 N -4.00 6.37 -0.17 1.61 0.15 -1.26 -1.11 113.70 115.28 3du0 s SER 5 Ca 0.00 -0.23 -0.04 0.00 0.70 0.00 0.00 55.95 56.38 3du0 s SER 5 Cb 0.00 -2.47 -0.02 0.00 -1.71 0.00 0.00 66.02 61.82 3du0 s SER 5 CO 0.00 -1.29 -0.04 -0.63 1.20 0.00 0.00 173.24 172.48 3du0 s ILE 6 N 4.20 3.72 -0.21 6.45 1.01 -0.26 -0.25 121.20 135.86 3du0 s ILE 6 Ca 0.34 -0.41 -0.16 0.00 0.00 0.00 0.00 60.65 60.42 3du0 s ILE 6 Cb -0.11 -2.64 -0.04 0.00 0.01 0.00 0.00 42.46 39.68 3du0 s ILE 6 CO 0.21 0.47 0.41 0.54 0.00 0.00 0.00 174.94 176.57 3du0 s VAL 7 N 0.70 5.19 -1.07 2.92 0.11 -0.67 -0.22 120.40 127.35 3du0 s VAL 7 Ca -0.02 0.72 -0.22 0.00 -2.93 0.00 0.00 61.98 59.53 3du0 s VAL 7 Cb -0.15 -3.74 0.03 0.00 -1.53 0.00 0.00 36.38 31.00 3du0 s VAL 7 CO 0.02 0.23 1.63 0.00 -3.33 0.00 0.00 175.10 173.65 3du0 s ALA 8 N 1.43 2.60 0.29 1.54 0.00 -0.31 0.84 121.76 128.15 3du0 s ALA 8 Ca 0.19 -2.27 -0.29 0.00 0.00 0.00 0.00 51.96 49.59 3du0 s ALA 8 Cb -0.15 -4.57 -0.10 0.00 0.00 0.00 0.00 23.12 18.30 3du0 s ALA 8 CO 0.08 -3.86 1.26 -1.50 0.00 0.00 0.00 175.76 171.74 3du0 s ILE 9 N 6.10 3.00 0.63 0.00 2.07 -0.97 -4.65 121.20 127.37 3du0 s ILE 9 Ca 0.53 0.96 -0.18 0.00 -1.41 0.00 0.00 60.65 60.55 3du0 s ILE 9 Cb -0.00 -3.61 -0.02 0.00 0.13 0.00 0.00 42.46 38.96 3du0 s ILE 9 CO -0.03 0.21 1.22 0.68 -1.91 0.00 0.00 174.94 175.11 3du0 s VAL 10 N -0.87 2.48 -0.67 4.00 -7.23 -1.26 -3.33 120.40 113.51 3du0 s VAL 10 Ca 0.50 0.28 -0.18 0.00 -1.81 0.00 0.00 61.98 60.77 3du0 s VAL 10 Cb -0.37 -3.05 0.13 0.00 0.56 0.00 0.00 36.38 33.64 3du0 s VAL 10 CO 0.47 -0.08 0.76 -0.89 -0.31 0.00 0.00 175.10 175.05 3du0 s THR 11 N -1.64 4.95 0.24 5.32 2.01 -1.26 -4.90 115.64 120.36 3du0 s THR 11 Ca 0.78 -1.33 -0.31 0.00 0.31 0.00 0.00 61.69 61.14 3du0 s THR 11 Cb -0.31 -4.52 -0.11 0.00 0.01 0.00 0.00 72.50 67.57 3du0 s THR 11 CO 0.37 -1.15 1.58 -2.16 -0.69 0.00 0.00 174.62 172.57 3du0 s PRO 12 N 2.23 4.17 0.06 4.92 0.04 -1.26 -4.95 135.00 140.22 3du0 s PRO 12 Ca 0.15 2.48 0.09 0.00 0.04 0.00 0.00 61.00 63.76 3du0 s PRO 12 Cb -0.20 -3.08 -0.03 0.00 0.04 0.00 0.00 34.50 31.23 3du0 s PRO 12 CO 0.02 -0.61 -0.26 -1.64 0.04 0.00 0.00 177.00 174.55 3du0 s MET 13 N 0.23 1.65 1.10 4.56 -1.94 -1.26 -0.79 119.30 122.85 3du0 s MET 13 Ca 0.66 -1.13 -0.18 0.00 -1.71 0.00 0.00 55.69 53.33 3du0 s MET 13 Cb -0.46 -1.88 0.28 0.00 2.01 0.00 0.00 34.83 34.78 3du0 s MET 13 CO 0.40 0.48 0.74 -0.40 -0.01 0.00 0.00 175.02 176.23 3du0 n ASP 14 N 1.60 -3.11 0.11 3.03 5.68 -0.13 -4.26 116.55 119.48 3du0 n ASP 14 Ca -0.17 -0.80 0.10 0.00 -0.50 0.00 0.00 54.79 53.42 3du0 n ASP 14 Cb 0.52 -0.79 0.46 0.00 -1.14 0.00 0.00 41.12 40.18 3du0 n ASP 14 CO 0.00 0.00 0.00 -0.62 -1.33 0.00 0.00 177.20 175.25 3du0 n GLU 15 N -4.72 0.15 -0.04 0.11 -0.58 -1.26 -2.26 120.64 112.03 3du0 n GLU 15 Ca 0.11 0.46 0.12 0.00 -0.42 0.00 0.00 57.16 57.43 3du0 n GLU 15 Cb 0.47 -1.82 0.30 0.00 -0.57 0.00 0.00 31.44 29.81 3du0 n GLU 15 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 3du0 n LYS 16 N -2.10 2.06 -0.61 3.49 5.02 -1.26 -4.94 118.16 119.81 3du0 n LYS 16 Ca 0.01 -1.55 0.00 0.00 -2.02 0.00 0.00 58.31 54.75 3du0 n LYS 16 Cb 0.16 -1.47 0.00 0.00 -0.02 0.00 0.00 35.03 33.71 3du0 n LYS 16 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 3du0 n GLY 17 N 1.29 0.66 3.87 0.72 0.00 -0.96 -5.05 105.19 105.72 3du0 n GLY 17 Ca 0.17 -0.33 -0.34 0.00 0.00 0.00 0.00 46.02 45.51 3du0 n GLY 17 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3du0 s ASN 18 N -2.30 6.24 0.01 1.61 0.01 -1.26 -4.87 114.94 114.37 3du0 s ASN 18 Ca 0.00 0.34 -0.36 0.00 -0.71 0.00 0.00 52.86 52.13 3du0 s ASN 18 Cb 0.00 -1.95 -0.14 0.00 0.41 0.00 0.00 41.25 39.57 3du0 s ASN 18 CO 0.00 0.30 1.62 0.55 -1.51 0.00 0.00 177.10 178.07 3du0 n VAL 19 N 1.26 0.20 -3.19 1.60 3.14 -1.26 -0.95 118.33 119.13 3du0 n VAL 19 Ca -0.14 -0.04 -0.44 0.00 -2.96 0.00 0.00 64.34 60.77 3du0 n VAL 19 Cb 0.53 -1.40 -0.06 0.00 -1.06 0.00 0.00 33.84 31.85 3du0 n VAL 19 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 3du0 h ARG 21 N 9.00 0.28 -0.07 0.00 2.43 -1.91 -1.76 114.38 122.36 3du0 h ARG 21 Ca -0.28 -0.03 -0.17 0.00 -0.81 0.00 0.00 59.98 58.69 3du0 h ARG 21 Cb 1.10 -0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.58 3du0 h ARG 21 CO 1.00 0.24 -0.70 0.00 -1.51 0.00 0.00 179.97 178.99 3du0 h ALA 22 N 1.81 0.68 -0.01 2.80 0.00 -1.98 -1.69 119.26 120.86 3du0 h ALA 22 Ca 0.07 -0.60 -0.23 0.00 0.00 0.00 0.00 54.91 54.15 3du0 h ALA 22 Cb 0.06 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 17.79 3du0 h ALA 22 CO -0.01 0.77 -0.95 0.77 0.00 0.00 0.00 179.25 179.83 3du0 h SER 23 N 0.22 0.65 0.00 0.00 0.02 -1.79 -2.71 113.55 109.94 3du0 h SER 23 Ca -0.02 -0.51 -0.05 0.00 -0.84 0.00 0.00 61.79 60.37 3du0 h SER 23 Cb 1.25 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 63.59 3du0 h SER 23 CO 0.11 1.30 -0.11 0.25 -1.14 0.00 0.00 176.83 177.25 3du0 h LEU 24 N 0.29 0.23 -0.03 5.07 5.85 -1.21 -1.91 115.31 123.60 3du0 h LEU 24 Ca -0.09 -0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.58 3du0 h LEU 24 Cb 1.58 -0.06 -0.00 0.00 0.37 0.00 0.00 40.66 42.55 3du0 h LEU 24 CO 0.17 0.37 -0.00 0.50 -0.34 0.00 0.00 178.44 179.14 3du0 h LYS 25 N 0.23 0.05 -0.61 1.25 3.64 -1.26 -0.59 116.57 119.29 3du0 h LYS 25 Ca 0.05 -0.02 0.09 0.00 -1.27 0.00 0.00 60.65 59.50 3du0 h LYS 25 Cb 0.34 -0.00 -0.07 0.00 -0.41 0.00 0.00 32.23 32.09 3du0 h LYS 25 CO 0.02 0.36 0.24 0.87 -2.27 0.00 0.00 179.45 178.67 3du0 h LYS 26 N -0.26 0.42 -0.23 1.90 1.57 -1.15 -1.02 116.57 117.80 3du0 h LYS 26 Ca 0.01 -0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 58.74 3du0 h LYS 26 Cb 0.33 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.54 3du0 h LYS 26 CO 0.00 0.28 0.05 -0.07 -0.57 0.00 0.00 179.45 179.14 3du0 h LEU 27 N 0.43 0.36 -1.03 2.94 3.38 -1.27 -1.12 115.31 119.00 3du0 h LEU 27 Ca 0.31 -0.24 -0.07 0.00 0.09 0.00 0.00 57.88 57.97 3du0 h LEU 27 Cb 0.36 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 3du0 h LEU 27 CO -0.29 0.50 -0.03 0.40 0.09 0.00 0.00 178.44 179.11 3du0 h ILE 28 N 0.20 1.23 -0.48 1.22 2.04 -0.81 -2.17 117.51 118.74 3du0 h ILE 28 Ca 0.07 -0.95 -0.13 0.00 1.00 0.00 0.00 64.86 64.85 3du0 h ILE 28 Cb 0.29 0.95 -0.01 0.00 -0.74 0.00 0.00 36.82 37.30 3du0 h ILE 28 CO 0.00 0.33 -0.22 0.44 0.00 0.00 0.00 178.15 178.70 3du0 h ASP 29 N 0.62 1.01 -0.86 1.72 3.32 -1.17 -2.14 116.42 118.93 3du0 h ASP 29 Ca 0.12 -0.39 0.07 0.00 0.02 0.00 0.00 57.03 56.85 3du0 h ASP 29 Cb 0.43 -0.28 -0.06 0.00 0.22 0.00 0.00 39.33 39.64 3du0 h ASP 29 CO 0.02 1.18 0.56 0.22 -1.72 0.00 0.00 179.24 179.51 3du0 h TYR 30 N 0.85 0.97 0.01 4.55 3.20 -0.80 -2.11 116.97 123.64 3du0 h TYR 30 Ca 0.11 0.03 -0.21 0.00 3.14 0.00 0.00 58.73 61.80 3du0 h TYR 30 Cb 0.80 -0.32 -0.03 0.00 1.54 0.00 0.00 36.73 38.72 3du0 h TYR 30 CO 0.05 0.51 -0.97 0.45 -1.64 0.00 0.00 178.16 176.56 3du0 h HIS 31 N 0.95 0.04 -0.59 -3.82 3.86 -1.14 -1.29 115.15 113.17 3du0 h HIS 31 Ca 0.37 -0.03 -0.10 0.00 -1.16 0.00 0.00 60.37 59.46 3du0 h HIS 31 Cb 0.23 -0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.67 3du0 h HIS 31 CO -0.00 0.98 -0.01 0.28 0.86 0.00 0.00 177.93 180.04 3du0 h VAL 32 N 0.01 1.26 0.00 2.45 2.07 -1.22 -2.77 116.25 118.05 3du0 h VAL 32 Ca -0.02 -1.15 -0.10 0.00 0.82 0.00 0.00 66.70 66.25 3du0 h VAL 32 Cb 1.70 0.82 -0.01 0.00 -1.52 0.00 0.00 31.29 32.27 3du0 h VAL 32 CO 0.13 0.42 -0.50 0.00 0.02 0.00 0.00 177.57 177.64 3du0 h ALA 33 N 1.03 0.79 -0.02 1.67 0.00 -1.29 -3.27 119.26 118.17 3du0 h ALA 33 Ca 0.17 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.62 3du0 h ALA 33 Cb 0.56 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.27 3du0 h ALA 33 CO 0.03 0.62 -0.22 0.43 0.00 0.00 0.00 179.25 180.12 3du0 n SER 34 N -3.38 2.01 -0.03 0.00 7.64 -0.50 -4.97 113.62 114.39 3du0 n SER 34 Ca 0.01 -1.52 -0.00 0.00 1.01 0.00 0.00 58.87 58.36 3du0 n SER 34 Cb 0.65 0.19 -0.00 0.00 -1.01 0.00 0.00 64.21 64.04 3du0 n SER 34 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3du0 n GLY 35 N 1.34 0.45 3.63 0.23 0.00 -1.13 -3.96 105.19 105.74 3du0 n GLY 35 Ca 0.13 -0.66 -0.45 0.00 0.00 0.00 0.00 46.02 45.04 3du0 n GLY 35 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 173.32 175.73 3du0 n THR 36 N -2.98 1.50 -0.00 2.61 -1.04 -1.06 -4.86 114.28 108.45 3du0 n THR 36 Ca -0.00 -0.38 -0.18 0.00 -2.04 0.00 0.00 64.05 61.45 3du0 n THR 36 Cb 0.02 -1.18 -0.08 0.00 -1.82 0.00 0.00 70.33 67.26 3du0 n THR 36 CO 0.00 0.00 0.00 0.28 -0.64 0.00 0.00 175.07 174.71 3du0 h SER 37 N 2.93 0.88 -5.14 8.00 0.02 -0.93 -3.46 113.55 115.85 3du0 h SER 37 Ca -0.43 -0.67 0.15 0.00 -0.84 0.00 0.00 61.79 60.00 3du0 h SER 37 Cb 1.32 -0.26 -0.09 0.00 0.14 0.00 0.00 62.40 63.50 3du0 h SER 37 CO 0.67 1.41 0.45 0.00 -1.14 0.00 0.00 176.83 178.22 3du0 s ALA 38 N -3.59 -1.65 -0.16 3.77 0.00 -1.25 -4.37 121.76 114.51 3du0 s ALA 38 Ca -0.11 0.29 0.01 0.00 0.00 0.00 0.00 51.96 52.16 3du0 s ALA 38 Cb 0.07 0.62 0.02 0.00 0.00 0.00 0.00 23.12 23.83 3du0 s ALA 38 CO 0.90 -0.96 -0.19 0.42 0.00 0.00 0.00 175.76 175.93 3du0 s ILE 39 N -3.32 1.94 -0.25 0.00 1.01 -0.40 -1.67 121.20 118.51 3du0 s ILE 39 Ca 0.10 -0.88 -0.24 0.00 0.00 0.00 0.00 60.65 59.63 3du0 s ILE 39 Cb -0.02 -1.75 -0.01 0.00 0.01 0.00 0.00 42.46 40.69 3du0 s ILE 39 CO -0.00 0.52 0.80 -0.69 0.00 0.00 0.00 174.94 175.56 3du0 s VAL 40 N 1.17 4.86 -0.26 2.92 1.01 0.25 0.26 120.40 130.60 3du0 s VAL 40 Ca 0.01 1.49 -0.09 0.00 0.00 0.00 0.00 61.98 63.39 3du0 s VAL 40 Cb -0.14 -4.09 -0.04 0.00 0.00 0.00 0.00 36.38 32.12 3du0 s VAL 40 CO -0.09 -0.06 0.12 -0.55 0.00 0.00 0.00 175.10 174.52 3du0 s SER 41 N 1.36 5.53 -1.21 3.32 0.15 0.28 -2.30 113.70 120.83 3du0 s SER 41 Ca 0.33 -0.11 -0.01 0.00 0.70 0.00 0.00 55.95 56.87 3du0 s SER 41 Cb -0.15 -2.01 -0.01 0.00 -1.71 0.00 0.00 66.02 62.14 3du0 s SER 41 CO 0.07 -0.03 0.91 0.52 1.20 0.00 0.00 173.24 175.91 3du0 n VAL 42 N 4.89 -5.87 -0.20 4.45 0.31 -1.26 -0.40 118.33 120.25 3du0 n VAL 42 Ca -0.15 -0.59 0.00 0.00 -0.01 0.00 0.00 64.34 63.59 3du0 n VAL 42 Cb 0.52 -4.79 0.00 0.00 -0.91 0.00 0.00 33.84 28.65 3du0 n VAL 42 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3du0 n GLY 43 N -1.27 -0.16 0.08 2.92 0.00 -1.26 -4.08 105.19 101.41 3du0 n GLY 43 Ca -0.27 -1.65 -0.11 0.00 0.00 0.00 0.00 46.02 43.99 3du0 n GLY 43 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3du0 h THR 44 N 0.00 1.09 0.00 2.61 2.02 -1.96 -1.44 112.91 115.23 3du0 h THR 44 Ca 0.00 -0.26 -0.01 0.00 0.77 0.00 0.00 66.41 66.91 3du0 h THR 44 Cb 0.00 1.08 -0.00 0.00 -1.74 0.00 0.00 68.15 67.49 3du0 h THR 44 CO 0.00 0.08 -0.04 0.74 0.37 0.00 0.00 175.52 176.68 3du0 h THR 45 N 0.06 0.14 -0.15 3.16 2.02 -1.87 -2.09 112.91 114.18 3du0 h THR 45 Ca 0.04 -0.41 0.00 0.00 0.77 0.00 0.00 66.41 66.81 3du0 h THR 45 Cb 0.08 1.35 0.00 0.00 -1.74 0.00 0.00 68.15 67.85 3du0 h THR 45 CO -0.01 0.03 0.00 0.61 0.37 0.00 0.00 175.52 176.53 3du0 n GLY 46 N -0.40 -0.14 3.27 2.16 0.00 -0.57 -4.30 105.19 105.22 3du0 n GLY 46 Ca -0.01 -0.17 -0.23 0.00 0.00 0.00 0.00 46.02 45.61 3du0 n GLY 46 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3du0 n GLU 47 N -0.04 -6.05 -0.32 1.61 1.02 -0.79 -4.22 120.64 111.85 3du0 n GLU 47 Ca 0.05 0.86 0.20 0.00 -0.02 0.00 0.00 57.16 58.25 3du0 n GLU 47 Cb 0.15 -5.80 0.40 0.00 -0.02 0.00 0.00 31.44 26.18 3du0 n GLU 47 CO 0.00 0.00 0.00 0.66 1.18 0.00 0.00 177.13 178.97 3du0 h SER 48 N -1.90 0.33 -0.73 1.62 4.64 -1.67 -2.17 113.55 113.67 3du0 h SER 48 Ca -0.55 0.19 0.13 0.00 -0.47 0.00 0.00 61.79 61.10 3du0 h SER 48 Cb 1.37 0.19 -0.09 0.00 -0.31 0.00 0.00 62.40 63.55 3du0 h SER 48 CO 0.57 -0.14 0.27 0.00 -0.87 0.00 0.00 176.83 176.67 3du0 h ALA 49 N 1.83 1.00 -0.36 5.18 0.00 -1.87 -3.14 119.26 121.89 3du0 h ALA 49 Ca 0.67 0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.69 3du0 h ALA 49 Cb 1.46 0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.34 3du0 h ALA 49 CO -0.63 -0.22 0.00 0.25 0.00 0.00 0.00 179.25 178.66 3du0 n THR 50 N -5.02 1.30 -4.04 0.00 -2.24 -0.84 -4.89 114.28 98.56 3du0 n THR 50 Ca 0.13 -1.19 -0.35 0.00 -2.27 0.00 0.00 64.05 60.38 3du0 n THR 50 Cb 0.39 0.33 -0.09 0.00 -2.10 0.00 0.00 70.33 68.86 3du0 n THR 50 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 3du0 s LEU 51 N -1.41 3.85 0.75 3.22 1.02 -1.10 -5.03 118.68 119.99 3du0 s LEU 51 Ca 0.29 0.13 -0.11 0.00 0.02 0.00 0.00 54.13 54.46 3du0 s LEU 51 Cb 0.18 -1.96 0.04 0.00 0.02 0.00 0.00 46.19 44.47 3du0 s LEU 51 CO 0.15 0.23 1.09 0.54 0.02 0.00 0.00 176.35 178.38 3du0 s ASN 52 N 0.06 4.97 0.53 2.29 2.20 -1.26 -4.73 114.94 119.00 3du0 s ASN 52 Ca 0.06 1.25 0.35 0.00 -0.94 0.00 0.00 52.86 53.58 3du0 s ASN 52 Cb -0.12 -2.03 1.60 0.00 -2.00 0.00 0.00 41.25 38.70 3du0 s ASN 52 CO 0.01 -1.66 2.04 0.45 -2.94 0.00 0.00 177.10 174.99 3du0 h HIS 53 N -0.87 0.00 0.16 1.54 3.86 -1.98 0.13 115.15 117.99 3du0 h HIS 53 Ca -0.46 0.00 -0.30 0.00 -1.16 0.00 0.00 60.37 58.45 3du0 h HIS 53 Cb 1.26 0.00 0.01 0.00 1.06 0.00 0.00 27.41 29.74 3du0 h HIS 53 CO 0.49 0.00 -1.45 0.22 0.86 0.00 0.00 177.93 178.05 3du0 h ASP 54 N 0.00 0.53 -0.59 2.45 3.58 -1.99 -1.44 116.42 118.96 3du0 h ASP 54 Ca 0.00 -0.90 -0.02 0.00 0.42 0.00 0.00 57.03 56.52 3du0 h ASP 54 Cb 0.32 -0.17 -0.03 0.00 1.72 0.00 0.00 39.33 41.17 3du0 h ASP 54 CO 0.00 1.66 0.28 -0.33 -2.88 0.00 0.00 179.24 177.97 3du0 h GLU 55 N -0.12 0.85 -0.29 0.28 5.08 -1.67 -1.85 114.58 116.85 3du0 h GLU 55 Ca -0.29 -0.13 0.06 0.00 -1.00 0.00 0.00 59.36 58.00 3du0 h GLU 55 Cb 1.91 -0.15 -0.08 0.00 0.50 0.00 0.00 28.75 30.92 3du0 h GLU 55 CO 0.14 0.69 -0.41 1.25 -1.00 0.00 0.00 179.01 179.68 3du0 h HIS 56 N 0.80 -1.18 -0.75 4.33 2.76 -0.84 -0.90 115.15 119.38 3du0 h HIS 56 Ca 0.20 0.06 0.04 0.00 -2.20 0.00 0.00 60.37 58.47 3du0 h HIS 56 Cb 0.12 0.56 -0.04 0.00 1.55 0.00 0.00 27.41 29.59 3du0 h HIS 56 CO -0.00 -0.44 0.49 0.00 -1.30 0.00 0.00 177.93 176.68 3du0 h ALA 57 N 0.35 1.59 -0.06 5.26 0.00 -1.19 -2.21 119.26 123.01 3du0 h ALA 57 Ca 0.12 -0.03 -0.13 0.00 0.00 0.00 0.00 54.91 54.87 3du0 h ALA 57 Cb 0.59 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 3du0 h ALA 57 CO -0.50 0.32 -0.54 0.22 0.00 0.00 0.00 179.25 178.75 3du0 h ASP 58 N 0.88 0.18 -0.12 0.00 3.58 -0.77 -0.24 116.42 119.92 3du0 h ASP 58 Ca 0.31 -0.09 -0.20 0.00 0.42 0.00 0.00 57.03 57.47 3du0 h ASP 58 Cb 0.11 -0.05 0.01 0.00 1.72 0.00 0.00 39.33 41.12 3du0 h ASP 58 CO -0.09 0.68 -0.70 0.58 -2.88 0.00 0.00 179.24 176.83 3du0 h VAL 59 N 0.12 1.31 -0.43 2.25 2.07 -0.91 -1.94 116.25 118.73 3du0 h VAL 59 Ca -0.00 -1.95 0.01 0.00 0.82 0.00 0.00 66.70 65.59 3du0 h VAL 59 Cb 1.00 2.11 -0.03 0.00 -1.52 0.00 0.00 31.29 32.85 3du0 h VAL 59 CO 0.08 0.60 0.27 0.58 0.02 0.00 0.00 177.57 179.12 3du0 h VAL 60 N 0.36 1.08 -0.33 2.57 2.07 -1.22 -0.12 116.25 120.65 3du0 h VAL 60 Ca -0.05 -0.19 -0.10 0.00 0.82 0.00 0.00 66.70 67.18 3du0 h VAL 60 Cb 1.34 0.48 -0.01 0.00 -1.52 0.00 0.00 31.29 31.58 3du0 h VAL 60 CO 0.14 0.10 -0.17 0.24 0.02 0.00 0.00 177.57 177.91 3du0 h MET 61 N 0.54 0.70 -0.80 1.57 2.07 -1.07 -0.80 114.93 117.14 3du0 h MET 61 Ca 0.16 -0.31 0.02 0.00 -2.07 0.00 0.00 59.70 57.51 3du0 h MET 61 Cb -0.03 -0.02 -0.04 0.00 -1.87 0.00 0.00 31.60 29.64 3du0 h MET 61 CO -0.06 0.91 0.52 1.98 1.07 0.00 0.00 176.91 181.33 3du0 h MET 62 N 0.48 1.01 -0.06 1.72 -1.53 -1.32 -0.32 114.93 114.90 3du0 h MET 62 Ca 0.07 -0.06 0.00 0.00 -3.44 0.00 0.00 59.70 56.27 3du0 h MET 62 Cb 0.70 -0.23 -0.00 0.00 -0.55 0.00 0.00 31.60 31.52 3du0 h MET 62 CO 0.05 0.67 0.04 1.15 0.14 0.00 0.00 176.91 178.96 3du0 h THR 63 N 1.04 1.01 -0.74 -0.77 2.02 -0.61 -0.92 112.91 113.93 3du0 h THR 63 Ca 0.31 -0.03 0.08 0.00 0.77 0.00 0.00 66.41 67.54 3du0 h THR 63 Cb -0.05 0.92 -0.06 0.00 -1.74 0.00 0.00 68.15 67.22 3du0 h THR 63 CO -0.09 0.02 0.41 -0.07 0.37 0.00 0.00 175.52 176.15 3du0 h LEU 64 N 0.08 0.59 0.36 2.58 3.38 -0.98 -0.28 115.31 121.05 3du0 h LEU 64 Ca 0.02 0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.02 3du0 h LEU 64 Cb -0.01 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 40.67 3du0 h LEU 64 CO -0.01 0.36 -0.17 -0.78 0.09 0.00 0.00 178.44 177.93 3du0 h ASP 65 N 0.72 -0.41 -0.49 -0.43 3.58 -0.83 -2.07 116.42 116.49 3du0 h ASP 65 Ca 0.35 -0.07 -0.05 0.00 0.42 0.00 0.00 57.03 57.68 3du0 h ASP 65 Cb 0.28 0.11 -0.03 0.00 1.72 0.00 0.00 39.33 41.41 3du0 h ASP 65 CO -0.22 -0.18 0.15 -0.07 -2.88 0.00 0.00 179.24 176.04 3du0 h LEU 66 N -0.62 0.76 -0.94 2.28 3.38 -1.08 -2.57 115.31 116.52 3du0 h LEU 66 Ca -0.05 -0.12 -0.08 0.00 0.09 0.00 0.00 57.88 57.72 3du0 h LEU 66 Cb 0.45 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 3du0 h LEU 66 CO 0.08 0.73 -0.05 0.00 0.09 0.00 0.00 178.44 179.29 3du0 h ALA 67 N 1.37 1.12 -5.15 1.53 0.00 -1.01 -3.47 119.26 113.65 3du0 h ALA 67 Ca 0.18 -0.28 -0.41 0.00 0.00 0.00 0.00 54.91 54.41 3du0 h ALA 67 Cb 0.26 -0.17 0.08 0.00 0.00 0.00 0.00 17.79 17.96 3du0 h ALA 67 CO -0.01 0.56 -0.64 -3.47 0.00 0.00 0.00 179.25 175.69 3du0 n ASP 68 N -4.20 -6.11 0.00 0.00 2.03 -0.78 -0.78 116.55 106.71 3du0 n ASP 68 Ca 0.02 -0.42 0.00 0.00 0.52 0.00 0.00 54.79 54.91 3du0 n ASP 68 Cb 0.32 -4.88 0.00 0.00 -0.72 0.00 0.00 41.12 35.84 3du0 n ASP 68 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3du0 n GLY 69 N -1.72 0.89 0.15 0.27 0.00 -1.26 -4.90 105.19 98.62 3du0 n GLY 69 Ca -0.05 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.09 3du0 n GLY 69 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3du0 h ARG 70 N 2.55 0.00 -2.01 1.61 3.08 -1.34 -3.45 114.38 114.83 3du0 h ARG 70 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3du0 h ARG 70 Cb 0.00 0.00 -0.21 0.00 0.08 0.00 0.00 29.97 29.84 3du0 h ARG 70 CO 0.00 0.00 0.05 -1.50 -1.07 0.00 0.00 179.97 177.45 3du0 s ILE 71 N -3.23 -0.00 0.57 2.04 2.07 -1.26 -4.94 121.20 116.45 3du0 s ILE 71 Ca 0.05 0.00 -0.19 0.00 -1.41 0.00 0.00 60.65 59.10 3du0 s ILE 71 Cb 0.09 -1.00 -0.05 0.00 0.13 0.00 0.00 42.46 41.63 3du0 s ILE 71 CO 0.70 0.00 1.19 -2.84 -1.91 0.00 0.00 174.94 172.08 3du0 s PRO 72 N 1.29 3.14 -0.10 3.50 0.02 -1.26 -4.87 135.00 136.72 3du0 s PRO 72 Ca -0.07 1.78 0.03 0.00 0.02 0.00 0.00 61.00 62.76 3du0 s PRO 72 Cb -0.05 -1.99 0.01 0.00 0.02 0.00 0.00 34.50 32.48 3du0 s PRO 72 CO -0.14 -1.06 -0.20 0.08 -0.33 0.00 0.00 177.00 175.35 3du0 s VAL 73 N -1.62 1.77 -0.18 3.83 1.01 -1.26 -1.28 120.40 122.67 3du0 s VAL 73 Ca 0.75 -0.84 -0.05 0.00 0.00 0.00 0.00 61.98 61.84 3du0 s VAL 73 Cb -0.29 -1.56 -0.03 0.00 0.00 0.00 0.00 36.38 34.50 3du0 s VAL 73 CO 0.32 0.50 0.00 -0.63 0.00 0.00 0.00 175.10 175.29 3du0 s ILE 74 N 0.56 4.18 -0.04 2.22 1.01 0.14 -1.05 121.20 128.22 3du0 s ILE 74 Ca -0.15 -0.25 -0.23 0.00 0.00 0.00 0.00 60.65 60.02 3du0 s ILE 74 Cb -0.17 -2.87 -0.04 0.00 0.01 0.00 0.00 42.46 39.39 3du0 s ILE 74 CO 0.05 0.46 0.70 0.00 0.00 0.00 0.00 174.94 176.15 3du0 s ALA 75 N 0.55 3.36 0.14 9.38 0.00 -0.60 0.10 121.76 134.69 3du0 s ALA 75 Ca -0.01 0.15 -0.31 0.00 0.00 0.00 0.00 51.96 51.79 3du0 s ALA 75 Cb -0.14 -2.93 -0.10 0.00 0.00 0.00 0.00 23.12 19.95 3du0 s ALA 75 CO 0.02 -0.03 1.68 0.20 0.00 0.00 0.00 175.76 177.63 3du0 s GLY 76 N 0.49 1.44 -0.02 0.00 0.00 0.47 -0.38 107.32 109.31 3du0 s GLY 76 Ca 0.37 1.39 0.03 0.00 0.00 0.00 0.00 44.72 46.50 3du0 s GLY 76 CO 0.19 2.87 0.82 -1.30 0.00 0.00 0.00 173.10 175.68 3du0 n THR 77 N 4.36 0.42 -1.95 0.90 -2.24 -0.49 -4.87 114.28 110.41 3du0 n THR 77 Ca 0.16 -0.47 -0.41 0.00 -2.27 0.00 0.00 64.05 61.06 3du0 n THR 77 Cb 0.38 0.60 -0.01 0.00 -2.10 0.00 0.00 70.33 69.20 3du0 n THR 77 CO 0.00 0.00 0.00 -0.83 -0.57 0.00 0.00 175.07 173.67 3du0 s GLY 78 N -0.86 2.96 -0.04 3.38 0.00 -1.23 -4.68 107.32 106.86 3du0 s GLY 78 Ca 0.04 1.41 -0.23 0.00 0.00 0.00 0.00 44.72 45.94 3du0 s GLY 78 CO 0.00 2.07 0.51 0.00 0.00 0.00 0.00 173.10 175.68 3du0 s ALA 79 N -1.15 -1.32 -2.32 3.20 0.00 -1.26 -4.91 121.76 114.00 3du0 s ALA 79 Ca 0.52 0.88 0.28 0.00 0.00 0.00 0.00 51.96 53.64 3du0 s ALA 79 Cb -0.43 0.01 1.00 0.00 0.00 0.00 0.00 23.12 23.70 3du0 s ALA 79 CO 0.57 -0.32 1.72 0.27 0.00 0.00 0.00 175.76 178.00 3du0 n ASN 80 N 1.13 1.36 -4.37 0.00 6.94 -1.26 -4.45 115.26 114.61 3du0 n ASN 80 Ca -0.20 -1.35 -0.34 0.00 -0.02 0.00 0.00 54.58 52.68 3du0 n ASN 80 Cb 0.57 0.03 -0.14 0.00 -2.36 0.00 0.00 39.78 37.87 3du0 n ASN 80 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 3du0 s ALA 81 N -2.11 2.74 0.21 -2.53 0.00 -1.26 -4.84 121.76 113.96 3du0 s ALA 81 Ca 0.35 -0.96 -0.10 0.00 0.00 0.00 0.00 51.96 51.26 3du0 s ALA 81 Cb 0.21 -1.42 0.22 0.00 0.00 0.00 0.00 23.12 22.13 3du0 s ALA 81 CO 0.38 0.05 1.81 1.15 0.00 0.00 0.00 175.76 179.15 3du0 h THR 82 N 5.44 0.99 -0.82 0.00 2.02 -1.95 -1.38 112.91 117.21 3du0 h THR 82 Ca -0.32 -0.24 0.14 0.00 0.77 0.00 0.00 66.41 66.76 3du0 h THR 82 Cb 1.19 0.23 -0.09 0.00 -1.74 0.00 0.00 68.15 67.75 3du0 h THR 82 CO 0.59 0.13 0.41 0.00 0.37 0.00 0.00 175.52 177.02 3du0 h ALA 83 N 1.33 1.21 -0.21 6.16 0.00 -1.97 -0.72 119.26 125.07 3du0 h ALA 83 Ca 0.29 0.08 -0.19 0.00 0.00 0.00 0.00 54.91 55.08 3du0 h ALA 83 Cb 0.15 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.92 3du0 h ALA 83 CO -0.16 -0.08 -0.64 0.93 0.00 0.00 0.00 179.25 179.30 3du0 h GLU 84 N 0.61 0.76 -0.50 0.00 4.39 -1.69 -1.49 114.58 116.66 3du0 h GLU 84 Ca 0.44 -0.53 0.08 0.00 0.34 0.00 0.00 59.36 59.69 3du0 h GLU 84 Cb 0.59 0.08 -0.07 0.00 -0.10 0.00 0.00 28.75 29.26 3du0 h GLU 84 CO -0.35 1.15 0.11 0.00 -1.16 0.00 0.00 179.01 178.77 3du0 h ALA 85 N 0.72 0.57 -0.25 3.43 0.00 -0.89 -0.41 119.26 122.44 3du0 h ALA 85 Ca -0.01 0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.96 3du0 h ALA 85 Cb 1.24 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 19.15 3du0 h ALA 85 CO 0.13 -0.30 0.00 0.82 0.00 0.00 0.00 179.25 179.90 3du0 h ILE 86 N 0.25 1.25 0.00 0.00 2.04 -1.01 -0.93 117.51 119.11 3du0 h ILE 86 Ca 0.25 -0.90 -0.13 0.00 1.00 0.00 0.00 64.86 65.08 3du0 h ILE 86 Cb 0.33 1.35 -0.02 0.00 -0.74 0.00 0.00 36.82 37.74 3du0 h ILE 86 CO -0.32 0.28 -0.60 0.77 0.00 0.00 0.00 178.15 178.28 3du0 h SER 87 N 0.22 0.00 -0.33 1.72 4.64 -1.24 0.27 113.55 118.83 3du0 h SER 87 Ca 0.07 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.35 3du0 h SER 87 Cb 0.41 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.49 3du0 h SER 87 CO 0.01 0.60 0.03 0.25 -0.87 0.00 0.00 176.83 176.86 3du0 h LEU 88 N 0.00 0.53 -0.41 5.97 5.85 -0.98 -2.58 115.31 123.69 3du0 h LEU 88 Ca -0.01 -0.28 -0.00 0.00 0.84 0.00 0.00 57.88 58.44 3du0 h LEU 88 Cb 1.14 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 42.00 3du0 h LEU 88 CO 0.08 0.68 0.25 0.74 -0.34 0.00 0.00 178.44 179.85 3du0 h THR 89 N 0.37 1.13 -0.96 1.05 2.02 -0.91 -2.17 112.91 113.45 3du0 h THR 89 Ca 0.10 -0.29 0.27 0.00 0.77 0.00 0.00 66.41 67.26 3du0 h THR 89 Cb 0.38 0.58 -0.14 0.00 -1.74 0.00 0.00 68.15 67.23 3du0 h THR 89 CO 0.01 0.13 0.47 1.56 0.37 0.00 0.00 175.52 178.06 3du0 h GLN 90 N 0.55 0.36 0.00 6.66 4.20 -0.85 -1.21 115.11 124.80 3du0 h GLN 90 Ca 0.15 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.84 3du0 h GLN 90 Cb -0.01 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 27.69 3du0 h GLN 90 CO -0.03 0.24 0.00 0.00 -0.67 0.00 0.00 178.83 178.37 3du0 h ARG 91 N 0.37 0.00 -0.01 1.46 2.47 -0.98 -2.85 114.38 114.84 3du0 h ARG 91 Ca 0.65 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 59.37 3du0 h ARG 91 Cb 1.36 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.68 3du0 h ARG 91 CO -0.58 0.00 -0.04 1.19 0.56 0.00 0.00 179.97 181.10 3du0 n PHE 92 N -2.75 0.00 -1.63 3.04 3.72 -0.47 -4.93 117.46 114.44 3du0 n PHE 92 Ca -0.01 0.00 -0.60 0.00 -0.05 0.00 0.00 57.45 56.79 3du0 n PHE 92 Cb 0.12 0.00 -0.08 0.00 -0.94 0.00 0.00 39.48 38.58 3du0 n PHE 92 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 3du0 n ASN 93 N 0.12 1.11 -0.68 4.37 3.02 -1.08 -2.16 115.26 119.96 3du0 n ASN 93 Ca 0.03 1.14 -0.09 0.00 -0.03 0.00 0.00 54.58 55.64 3du0 n ASN 93 Cb 0.15 -1.01 -0.04 0.00 -0.61 0.00 0.00 39.78 38.28 3du0 n ASN 93 CO 0.00 0.00 0.00 0.47 -2.62 0.00 0.00 177.26 175.11 3du0 n ASP 94 N 3.11 -4.19 0.04 6.41 8.00 -1.26 -4.89 116.55 123.77 3du0 n ASP 94 Ca 0.24 0.22 -0.00 0.00 0.71 0.00 0.00 54.79 55.95 3du0 n ASP 94 Cb 0.07 -2.47 -0.07 0.00 -0.02 0.00 0.00 41.12 38.63 3du0 n ASP 94 CO 0.00 0.00 0.00 0.77 -0.39 0.00 0.00 177.20 177.58 3du0 h SER 95 N 0.00 0.00 0.00 -2.24 4.64 -1.79 -3.48 113.55 110.68 3du0 h SER 95 Ca -0.18 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.14 3du0 h SER 95 Cb 0.62 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.71 3du0 h SER 95 CO 0.26 0.60 0.00 0.61 -0.87 0.00 0.00 176.83 177.44 3du0 n GLY 96 N 1.38 0.90 3.75 -0.77 0.00 -1.26 -5.06 105.19 104.14 3du0 n GLY 96 Ca -0.08 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.59 3du0 n GLY 96 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3du0 s ILE 97 N -2.13 2.76 -0.52 -0.61 -4.36 -1.26 -4.77 121.20 110.32 3du0 s ILE 97 Ca 0.00 0.43 0.22 0.00 -0.26 0.00 0.00 60.65 61.04 3du0 s ILE 97 Cb 0.00 -3.07 -0.18 0.00 1.25 0.00 0.00 42.46 40.46 3du0 s ILE 97 CO 0.00 -0.15 0.88 1.33 0.24 0.00 0.00 174.94 177.25 3du0 n VAL 98 N -1.96 0.13 -4.00 8.37 0.24 -0.21 -4.99 118.33 115.90 3du0 n VAL 98 Ca 0.13 -0.28 0.03 0.00 -2.04 0.00 0.00 64.34 62.17 3du0 n VAL 98 Cb 0.50 0.25 0.01 0.00 -1.47 0.00 0.00 33.84 33.14 3du0 n VAL 98 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3du0 n GLY 99 N 1.35 0.24 3.18 7.63 0.00 -1.26 -4.16 105.19 112.19 3du0 n GLY 99 Ca 0.01 -0.97 -0.23 0.00 0.00 0.00 0.00 46.02 44.82 3du0 n GLY 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3du0 s LEU 101 N -0.92 4.01 -0.24 0.00 2.96 0.48 -0.04 118.68 124.93 3du0 s LEU 101 Ca 0.05 -0.95 0.02 0.00 -0.22 0.00 0.00 54.13 53.03 3du0 s LEU 101 Cb -0.08 -1.85 0.06 0.00 0.50 0.00 0.00 46.19 44.82 3du0 s LEU 101 CO 0.01 -0.25 -0.08 0.28 -1.32 0.00 0.00 176.35 174.98 3du0 s THR 102 N 1.43 1.83 0.49 3.68 -1.32 -0.12 -1.40 115.64 120.22 3du0 s THR 102 Ca 0.00 -1.40 -0.20 0.00 -1.21 0.00 0.00 61.69 58.88 3du0 s THR 102 Cb -0.18 -2.01 -0.08 0.00 -1.51 0.00 0.00 72.50 68.71 3du0 s THR 102 CO 0.02 -0.05 1.03 0.54 -2.21 0.00 0.00 174.62 173.95 3du0 s VAL 103 N 1.26 3.84 0.24 5.08 0.11 -1.26 -1.49 120.40 128.18 3du0 s VAL 103 Ca -0.07 1.13 -0.31 0.00 -2.93 0.00 0.00 61.98 59.80 3du0 s VAL 103 Cb -0.19 -3.46 -0.14 0.00 -1.53 0.00 0.00 36.38 31.06 3du0 s VAL 103 CO -0.06 -0.26 1.27 0.35 -3.33 0.00 0.00 175.10 173.07 3du0 n THR 104 N -1.01 1.23 -1.56 5.04 -2.24 -0.58 -4.58 114.28 110.58 3du0 n THR 104 Ca 0.09 -0.31 -0.54 0.00 -2.27 0.00 0.00 64.05 61.03 3du0 n THR 104 Cb 0.53 -1.27 -0.06 0.00 -2.10 0.00 0.00 70.33 67.42 3du0 n THR 104 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 3du0 n PRO 105 N 1.57 0.84 -3.66 -0.78 -0.02 -1.26 -4.94 135.00 126.75 3du0 n PRO 105 Ca 0.11 0.30 -0.29 0.00 -2.02 0.00 0.00 63.50 61.61 3du0 n PRO 105 Cb 0.31 -1.90 -0.04 0.00 -0.02 0.00 0.00 33.50 31.85 3du0 n PRO 105 CO 0.00 0.00 0.00 1.52 1.98 0.00 0.00 175.50 179.00 3du0 s TYR 106 N 0.32 3.48 0.00 6.00 -0.85 -1.26 -4.46 117.35 120.58 3du0 s TYR 106 Ca 0.86 0.43 0.00 0.00 -0.52 0.00 0.00 57.07 57.83 3du0 s TYR 106 Cb -1.03 -1.92 0.00 0.00 0.38 0.00 0.00 41.96 39.39 3du0 s TYR 106 CO 0.50 0.38 0.00 0.98 -1.52 0.00 0.00 175.55 175.89 3du0 n TYR 107 N -0.44 0.00 1.23 -3.49 9.36 -0.38 -4.56 117.16 118.89 3du0 n TYR 107 Ca -0.04 0.00 0.14 0.00 3.32 0.00 0.00 57.90 61.32 3du0 n TYR 107 Cb 0.53 0.00 0.56 0.00 -0.63 0.00 0.00 39.34 39.80 3du0 n TYR 107 CO 0.00 0.00 0.00 0.27 0.22 0.00 0.00 176.86 177.35 3du0 n ASN 108 N 2.86 0.31 -3.59 2.98 0.23 -1.26 -4.99 115.26 111.80 3du0 n ASN 108 Ca 0.00 -0.21 -0.27 0.00 -0.53 0.00 0.00 54.58 53.57 3du0 n ASN 108 Cb 0.00 -0.14 0.04 0.00 -2.08 0.00 0.00 39.78 37.60 3du0 n ASN 108 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 3du0 n ARG 109 N -1.22 -1.36 -1.07 -3.83 1.74 -1.26 -4.95 116.66 104.71 3du0 n ARG 109 Ca 0.11 0.59 -0.31 0.00 -0.77 0.00 0.00 57.85 57.47 3du0 n ARG 109 Cb 0.30 -4.35 0.12 0.00 -1.02 0.00 0.00 32.46 27.51 3du0 n ARG 109 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 3du0 s PRO 110 N -5.54 1.81 1.19 5.56 0.04 -1.26 -5.04 135.00 131.77 3du0 s PRO 110 Ca 0.42 1.33 -0.19 0.00 0.04 0.00 0.00 61.00 62.61 3du0 s PRO 110 Cb -0.14 -1.83 0.28 0.00 0.04 0.00 0.00 34.50 32.85 3du0 s PRO 110 CO 0.84 -2.00 1.10 -1.54 0.04 0.00 0.00 177.00 175.44 3du0 s SER 111 N -3.07 0.98 0.21 6.66 1.04 -1.26 -4.76 113.70 113.49 3du0 s SER 111 Ca 0.64 0.67 -0.05 0.00 0.48 0.00 0.00 55.95 57.69 3du0 s SER 111 Cb -0.20 -0.95 0.17 0.00 0.10 0.00 0.00 66.02 65.14 3du0 s SER 111 CO 0.56 -4.09 1.60 1.56 0.98 0.00 0.00 173.24 173.86 3du0 h GLN 112 N -2.56 0.76 -0.70 4.02 1.08 -1.96 -1.34 115.11 114.41 3du0 h GLN 112 Ca -0.46 -0.33 0.05 0.00 -1.45 0.00 0.00 58.65 56.47 3du0 h GLN 112 Cb 1.30 -0.02 -0.05 0.00 -0.05 0.00 0.00 27.48 28.65 3du0 h GLN 112 CO 0.36 0.94 0.40 1.49 -0.95 0.00 0.00 178.83 181.07 3du0 h GLU 113 N 0.65 0.73 -0.51 1.46 4.57 -1.99 0.20 114.58 119.69 3du0 h GLU 113 Ca 0.08 -0.04 -0.00 0.00 -1.18 0.00 0.00 59.36 58.21 3du0 h GLU 113 Cb 0.79 -0.16 -0.02 0.00 -0.16 0.00 0.00 28.75 29.19 3du0 h GLU 113 CO 0.07 0.48 0.31 0.78 -1.18 0.00 0.00 179.01 179.47 3du0 h GLY 114 N 0.75 0.73 0.73 1.92 0.00 -1.81 -0.97 103.07 104.43 3du0 h GLY 114 Ca 0.31 -0.30 0.05 0.00 0.00 0.00 0.00 47.33 47.38 3du0 h GLY 114 CO -0.17 0.29 0.36 1.41 0.00 0.00 0.00 176.54 178.44 3du0 h LEU 115 N 0.68 0.55 0.08 3.11 3.38 -1.04 0.42 115.31 122.50 3du0 h LEU 115 Ca 0.18 0.02 0.02 0.00 0.09 0.00 0.00 57.88 58.20 3du0 h LEU 115 Cb -0.01 -0.09 -0.04 0.00 0.09 0.00 0.00 40.66 40.60 3du0 h LEU 115 CO -0.03 0.37 -0.32 0.22 0.09 0.00 0.00 178.44 178.76 3du0 h TYR 116 N 0.69 -0.88 -0.74 1.13 3.20 -0.63 -1.60 116.97 118.15 3du0 h TYR 116 Ca 0.28 0.02 -0.04 0.00 3.14 0.00 0.00 58.73 62.14 3du0 h TYR 116 Cb 0.14 0.38 -0.03 0.00 1.54 0.00 0.00 36.73 38.75 3du0 h TYR 116 CO -0.07 -0.42 0.32 1.96 -1.64 0.00 0.00 178.16 178.30 3du0 h GLN 117 N -0.52 1.08 0.17 1.82 1.08 -1.04 -0.19 115.11 117.50 3du0 h GLN 117 Ca 0.04 -0.17 -0.00 0.00 -1.45 0.00 0.00 58.65 57.07 3du0 h GLN 117 Cb 0.57 -0.19 -0.02 0.00 -0.05 0.00 0.00 27.48 27.79 3du0 h GLN 117 CO -0.21 0.86 -0.29 1.25 -0.95 0.00 0.00 178.83 179.49 3du0 h HIS 118 N 1.06 -0.81 -0.37 2.96 2.76 -0.82 -1.65 115.15 118.27 3du0 h HIS 118 Ca 0.25 0.01 -0.11 0.00 -2.20 0.00 0.00 60.37 58.32 3du0 h HIS 118 Cb 0.16 0.33 -0.01 0.00 1.55 0.00 0.00 27.41 29.44 3du0 h HIS 118 CO 0.02 -0.35 -0.22 0.74 -1.30 0.00 0.00 177.93 176.82 3du0 h PHE 119 N -0.49 0.83 -0.09 5.26 0.04 -1.24 -2.41 116.94 118.83 3du0 h PHE 119 Ca -0.02 -0.18 0.03 0.00 2.80 0.00 0.00 57.97 60.60 3du0 h PHE 119 Cb 0.45 -0.20 -0.03 0.00 2.20 0.00 0.00 35.95 38.37 3du0 h PHE 119 CO -0.28 0.88 -0.09 -0.22 -0.60 0.00 0.00 178.31 178.00 3du0 h LYS 120 N 0.64 -0.11 -0.77 1.51 3.64 -1.03 -1.52 116.57 118.92 3du0 h LYS 120 Ca 0.09 0.01 0.01 0.00 -1.27 0.00 0.00 60.65 59.49 3du0 h LYS 120 Cb 0.71 0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 32.52 3du0 h LYS 120 CO 0.05 -0.08 0.51 0.00 -2.27 0.00 0.00 179.45 177.67 3du0 h ALA 121 N 0.95 0.98 -0.41 5.00 0.00 -1.16 -0.29 119.26 124.33 3du0 h ALA 121 Ca 0.07 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 54.94 3du0 h ALA 121 Cb 0.22 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 3du0 h ALA 121 CO -0.16 0.39 0.24 0.82 0.00 0.00 0.00 179.25 180.54 3du0 h ILE 122 N 1.04 1.05 -0.16 0.00 2.04 -1.30 -2.91 117.51 117.26 3du0 h ILE 122 Ca 0.28 -0.17 -0.12 0.00 1.00 0.00 0.00 64.86 65.86 3du0 h ILE 122 Cb -0.12 0.51 -0.01 0.00 -0.74 0.00 0.00 36.82 36.46 3du0 h ILE 122 CO -0.06 0.09 -0.40 0.00 0.00 0.00 0.00 178.15 177.78 3du0 h ALA 123 N 1.18 1.01 0.00 1.87 0.00 -0.72 -2.10 119.26 120.50 3du0 h ALA 123 Ca 0.16 -0.42 -0.00 0.00 0.00 0.00 0.00 54.91 54.65 3du0 h ALA 123 Cb 0.00 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.70 3du0 h ALA 123 CO -0.07 0.61 -0.01 0.93 0.00 0.00 0.00 179.25 180.71 3du0 h GLU 124 N 0.31 0.00 -0.51 0.00 5.08 -0.91 -3.09 114.58 115.46 3du0 h GLU 124 Ca 0.03 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.39 3du0 h GLU 124 Cb 0.84 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.09 3du0 h GLU 124 CO 0.07 0.01 0.00 0.72 -1.00 0.00 0.00 179.01 178.81 3du0 n HIS 125 N -3.19 1.50 -3.55 4.33 8.25 -0.79 -4.94 115.22 116.83 3du0 n HIS 125 Ca -0.02 -0.71 -0.12 0.00 -0.26 0.00 0.00 57.72 56.61 3du0 n HIS 125 Cb 0.13 -0.34 -0.04 0.00 1.12 0.00 0.00 29.99 30.86 3du0 n HIS 125 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 3du0 s THR 126 N -2.35 0.03 -1.05 1.59 -1.32 -1.17 -4.82 115.64 106.56 3du0 s THR 126 Ca 0.48 -0.29 0.23 0.00 -1.21 0.00 0.00 61.69 60.90 3du0 s THR 126 Cb 0.35 -1.05 -0.12 0.00 -1.51 0.00 0.00 72.50 70.17 3du0 s THR 126 CO 0.17 -0.16 1.13 0.47 -2.21 0.00 0.00 174.62 174.02 3du0 n ASP 127 N -0.02 0.83 -4.76 8.08 8.00 -1.26 -4.92 116.55 122.50 3du0 n ASP 127 Ca -0.17 -0.72 -0.40 0.00 0.71 0.00 0.00 54.79 54.21 3du0 n ASP 127 Cb 0.63 0.67 -0.04 0.00 -0.02 0.00 0.00 41.12 42.36 3du0 n ASP 127 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3du0 s LEU 128 N -2.97 4.45 0.27 0.64 1.43 -1.26 -4.98 118.68 116.25 3du0 s LEU 128 Ca 0.10 2.35 -0.29 0.00 -1.03 0.00 0.00 54.13 55.25 3du0 s LEU 128 Cb 0.17 -3.73 -0.14 0.00 0.03 0.00 0.00 46.19 42.52 3du0 s LEU 128 CO 0.79 -0.32 1.09 -2.65 0.23 0.00 0.00 176.35 175.48 3du0 n PRO 129 N 0.86 1.42 -4.44 1.29 -0.02 -1.26 -4.83 135.00 128.02 3du0 n PRO 129 Ca 0.00 0.50 -0.34 0.00 -2.02 0.00 0.00 63.50 61.65 3du0 n PRO 129 Cb 0.45 -1.93 -0.14 0.00 -0.02 0.00 0.00 33.50 31.86 3du0 n PRO 129 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 3du0 s GLN 130 N -1.25 3.45 -0.35 -0.52 -1.52 0.13 -0.92 119.66 118.68 3du0 s GLN 130 Ca 0.62 -0.63 -0.07 0.00 -1.95 0.00 0.00 55.36 53.33 3du0 s GLN 130 Cb -0.72 -2.80 0.04 0.00 -0.22 0.00 0.00 33.01 29.31 3du0 s GLN 130 CO 0.58 0.11 0.13 0.42 -0.25 0.00 0.00 175.29 176.28 3du0 s ILE 131 N 0.66 3.89 0.81 1.08 1.01 0.94 -1.58 121.20 128.01 3du0 s ILE 131 Ca -0.05 -1.16 -0.13 0.00 0.00 0.00 0.00 60.65 59.31 3du0 s ILE 131 Cb -0.15 -3.23 0.08 0.00 0.01 0.00 0.00 42.46 39.17 3du0 s ILE 131 CO 0.02 -0.23 1.20 -0.76 0.00 0.00 0.00 174.94 175.17 3du0 s LEU 132 N 1.41 3.13 -0.17 2.97 1.43 -0.08 -0.95 118.68 126.43 3du0 s LEU 132 Ca -0.01 2.34 -0.05 0.00 -1.03 0.00 0.00 54.13 55.38 3du0 s LEU 132 Cb -0.20 -4.58 0.06 0.00 0.03 0.00 0.00 46.19 41.50 3du0 s LEU 132 CO 0.03 -2.65 0.08 -0.47 0.23 0.00 0.00 176.35 173.57 3du0 s TYR 133 N -2.19 0.30 -0.24 0.29 5.04 -0.55 -4.19 117.35 115.80 3du0 s TYR 133 Ca 0.72 -0.37 -0.07 0.00 -2.44 0.00 0.00 57.07 54.92 3du0 s TYR 133 Cb -0.28 -0.73 -0.03 0.00 0.35 0.00 0.00 41.96 41.27 3du0 s TYR 133 CO 0.51 -0.52 0.05 1.21 -1.34 0.00 0.00 175.55 175.46 3du0 s ASN 134 N 2.10 5.05 -0.44 4.32 2.47 -1.26 -1.53 114.94 125.64 3du0 s ASN 134 Ca 0.02 -0.21 0.07 0.00 0.42 0.00 0.00 52.86 53.15 3du0 s ASN 134 Cb -0.16 -1.90 0.24 0.00 -1.45 0.00 0.00 41.25 37.98 3du0 s ASN 134 CO -0.09 -0.02 0.70 0.55 -3.72 0.00 0.00 177.10 174.53 3du0 n VAL 135 N 4.80 -0.36 -0.02 -5.21 3.14 -1.26 -1.10 118.33 118.33 3du0 n VAL 135 Ca -0.16 -2.70 0.23 0.00 -2.96 0.00 0.00 64.34 58.74 3du0 n VAL 135 Cb 0.51 -0.20 0.72 0.00 -1.06 0.00 0.00 33.84 33.81 3du0 n VAL 135 CO 0.00 0.00 0.00 -0.65 -6.46 0.00 0.00 176.83 169.72 3du0 h PRO 136 N 4.07 0.00 0.00 1.45 0.11 -1.91 0.14 132.00 135.87 3du0 h PRO 136 Ca -0.03 0.00 -0.04 0.00 0.11 0.00 0.00 66.00 66.04 3du0 h PRO 136 Cb 0.96 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.06 3du0 h PRO 136 CO 0.38 0.00 -0.19 0.66 -0.21 0.00 0.00 178.00 178.64 3du0 h SER 137 N 0.00 0.00 0.20 -2.05 4.64 -1.94 -1.90 113.55 112.50 3du0 h SER 137 Ca 0.28 0.00 -0.24 0.00 -0.47 0.00 0.00 61.79 61.35 3du0 h SER 137 Cb 1.22 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 63.26 3du0 h SER 137 CO -0.00 0.19 -2.03 0.54 -0.87 0.00 0.00 176.83 174.65 3du0 n ARG 138 N -3.55 0.66 -0.03 4.77 1.74 0.01 -4.68 116.66 115.59 3du0 n ARG 138 Ca -0.01 0.03 0.02 0.00 -0.77 0.00 0.00 57.85 57.13 3du0 n ARG 138 Cb 0.34 -1.61 -0.13 0.00 -1.02 0.00 0.00 32.46 30.04 3du0 n ARG 138 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 3du0 n THR 139 N -2.71 0.40 -1.09 0.55 -2.24 -1.07 -4.78 114.28 103.34 3du0 n THR 139 Ca -0.21 -0.49 -0.03 0.00 -2.27 0.00 0.00 64.05 61.06 3du0 n THR 139 Cb 0.96 -0.15 -0.01 0.00 -2.10 0.00 0.00 70.33 69.03 3du0 n THR 139 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3du0 n GLY 140 N 1.73 0.63 3.16 3.38 0.00 -0.73 -1.24 105.19 112.11 3du0 n GLY 140 Ca -0.11 -0.79 -0.12 0.00 0.00 0.00 0.00 46.02 44.99 3du0 n GLY 140 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3du0 s ASP 142 N 0.75 4.24 -0.40 0.00 -1.08 -1.26 -3.76 116.67 115.16 3du0 s ASP 142 Ca -0.05 -1.50 -0.29 0.00 -0.52 0.00 0.00 52.55 50.19 3du0 s ASP 142 Cb -0.06 -1.36 0.01 0.00 -1.46 0.00 0.00 42.92 40.05 3du0 s ASP 142 CO -0.05 -0.27 1.42 -0.22 0.52 0.00 0.00 175.17 176.57 3du0 s LEU 143 N 1.22 3.61 0.32 -1.34 2.96 -1.26 -4.99 118.68 119.20 3du0 s LEU 143 Ca -0.02 0.88 -0.09 0.00 -0.22 0.00 0.00 54.13 54.69 3du0 s LEU 143 Cb -0.19 -3.54 -0.06 0.00 0.50 0.00 0.00 46.19 42.90 3du0 s LEU 143 CO -0.08 -1.41 0.64 -0.76 -1.32 0.00 0.00 176.35 173.42 3du0 s LEU 144 N 5.39 4.00 0.26 -0.68 1.43 -1.26 -4.87 118.68 122.95 3du0 s LEU 144 Ca 0.62 0.95 -0.02 0.00 -1.03 0.00 0.00 54.13 54.64 3du0 s LEU 144 Cb -0.14 -3.78 0.53 0.00 0.03 0.00 0.00 46.19 42.83 3du0 s LEU 144 CO 0.32 -0.24 1.70 -0.65 0.23 0.00 0.00 176.35 177.71 3du0 h PRO 145 N 1.77 0.35 -0.49 1.29 0.11 -1.95 -0.30 132.00 132.78 3du0 h PRO 145 Ca -0.47 -0.02 0.04 0.00 0.11 0.00 0.00 66.00 65.66 3du0 h PRO 145 Cb 1.18 -0.08 -0.06 0.00 0.11 0.00 0.00 31.00 32.15 3du0 h PRO 145 CO 0.66 0.23 -0.29 0.39 -0.21 0.00 0.00 178.00 178.78 3du0 n GLU 146 N -5.08 -0.22 -0.01 1.05 1.02 -1.26 -0.74 120.64 115.41 3du0 n GLU 146 Ca 0.16 0.99 -0.09 0.00 -0.02 0.00 0.00 57.16 58.21 3du0 n GLU 146 Cb 0.50 -1.47 0.07 0.00 -0.02 0.00 0.00 31.44 30.52 3du0 n GLU 146 CO 0.00 0.00 0.00 1.15 1.18 0.00 0.00 177.13 179.46 3du0 h THR 147 N 0.00 1.31 -0.68 2.62 2.02 -1.48 -1.95 112.91 114.74 3du0 h THR 147 Ca 0.08 -1.69 0.07 0.00 0.77 0.00 0.00 66.41 65.64 3du0 h THR 147 Cb 0.20 1.65 -0.06 0.00 -1.74 0.00 0.00 68.15 68.21 3du0 h THR 147 CO -0.46 0.53 0.37 0.58 0.37 0.00 0.00 175.52 176.90 3du0 h VAL 148 N 0.47 0.94 -0.32 3.16 2.07 -0.81 -1.35 116.25 120.41 3du0 h VAL 148 Ca 0.02 -0.23 0.06 0.00 0.82 0.00 0.00 66.70 67.38 3du0 h VAL 148 Cb 1.01 0.21 -0.06 0.00 -1.52 0.00 0.00 31.29 30.93 3du0 h VAL 148 CO 0.09 0.12 -0.04 1.23 0.02 0.00 0.00 177.57 178.99 3du0 h GLY 149 N 0.67 0.27 0.86 2.17 0.00 -0.22 0.18 103.07 107.00 3du0 h GLY 149 Ca 0.31 0.07 0.02 0.00 0.00 0.00 0.00 47.33 47.73 3du0 h GLY 149 CO -0.20 -0.10 0.13 3.21 0.00 0.00 0.00 176.54 179.58 3du0 h ARG 150 N 0.04 0.27 -0.20 4.80 3.08 -1.22 -3.14 114.38 118.01 3du0 h ARG 150 Ca 0.15 -0.02 -0.09 0.00 0.07 0.00 0.00 59.98 60.10 3du0 h ARG 150 Cb 0.22 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.20 3du0 h ARG 150 CO -0.30 0.18 -0.25 -0.07 -1.07 0.00 0.00 179.97 178.46 3du0 h LEU 151 N 0.28 0.38 -2.22 3.04 3.38 -0.87 -2.73 115.31 116.57 3du0 h LEU 151 Ca 0.12 -0.12 0.00 0.00 0.09 0.00 0.00 57.88 57.96 3du0 h LEU 151 Cb 0.04 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.69 3du0 h LEU 151 CO -0.09 0.63 0.00 0.00 0.09 0.00 0.00 178.44 179.08 3du0 h ALA 152 N 1.40 1.00 0.00 1.53 0.00 -0.61 -0.99 119.26 121.59 3du0 h ALA 152 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3du0 h ALA 152 Cb 0.63 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.42 3du0 h ALA 152 CO 0.05 0.00 0.00 0.87 0.00 0.00 0.00 179.25 180.17 3du0 h LYS 153 N 0.00 0.00 -6.52 0.00 1.57 -1.54 -3.43 116.57 106.64 3du0 h LYS 153 Ca 0.00 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 58.25 3du0 h LYS 153 Cb 0.11 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.43 3du0 h LYS 153 CO 0.00 0.00 0.61 0.08 -0.57 0.00 0.00 179.45 179.57 3du0 s VAL 154 N -3.40 3.76 0.18 0.50 1.01 -0.38 -4.94 120.40 117.13 3du0 s VAL 154 Ca 0.04 1.28 -0.16 0.00 0.00 0.00 0.00 61.98 63.15 3du0 s VAL 154 Cb 0.09 -3.82 0.15 0.00 0.00 0.00 0.00 36.38 32.80 3du0 s VAL 154 CO 0.52 0.11 1.64 0.50 0.00 0.00 0.00 175.10 177.87 3du0 h LYS 155 N 6.60 -0.03 -0.69 2.72 3.64 -1.87 -2.24 116.57 124.70 3du0 h LYS 155 Ca -0.42 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 58.96 3du0 h LYS 155 Cb 1.21 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 33.04 3du0 h LYS 155 CO 0.82 -0.02 0.00 0.27 -2.27 0.00 0.00 179.45 178.25 3du0 n ASN 156 N -5.37 4.53 -4.45 4.20 6.94 -1.26 -4.72 115.26 115.13 3du0 n ASN 156 Ca 0.04 -2.30 -0.44 0.00 -0.02 0.00 0.00 54.58 51.87 3du0 n ASN 156 Cb 0.28 -0.56 -0.05 0.00 -2.36 0.00 0.00 39.78 37.09 3du0 n ASN 156 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 3du0 s ILE 157 N -1.58 4.64 -0.35 1.53 1.01 -0.84 0.20 121.20 125.81 3du0 s ILE 157 Ca 0.51 -0.40 0.03 0.00 0.00 0.00 0.00 60.65 60.79 3du0 s ILE 157 Cb 0.31 -4.47 0.01 0.00 0.01 0.00 0.00 42.46 38.32 3du0 s ILE 157 CO 0.28 -1.08 0.48 2.30 0.00 0.00 0.00 174.94 176.92 3du0 n ILE 158 N 5.79 0.00 -3.73 2.92 -6.64 -0.61 -4.67 119.36 112.42 3du0 n ILE 158 Ca -0.05 -0.48 0.01 0.00 -1.77 0.00 0.00 62.75 60.46 3du0 n ILE 158 Cb 0.45 1.05 0.00 0.00 -1.44 0.00 0.00 39.64 39.70 3du0 n ILE 158 CO 0.00 0.00 0.00 -0.83 -1.77 0.00 0.00 176.55 173.95 3du0 s GLY 159 N -0.53 -0.31 0.00 3.28 0.00 -1.21 -1.34 107.32 107.21 3du0 s GLY 159 Ca 0.03 0.45 0.00 0.00 0.00 0.00 0.00 44.72 45.20 3du0 s GLY 159 CO 0.06 1.62 0.00 4.51 0.00 0.00 0.00 173.10 179.29 3du0 n ILE 160 N -0.60 0.00 -3.15 0.90 3.06 -0.50 -0.90 119.36 118.16 3du0 n ILE 160 Ca -0.05 0.00 0.06 0.00 -2.50 0.00 0.00 62.75 60.25 3du0 n ILE 160 Cb 0.62 0.00 -0.02 0.00 0.54 0.00 0.00 39.64 40.77 3du0 n ILE 160 CO 0.00 0.00 0.00 -0.70 -2.50 0.00 0.00 176.55 173.35 3du0 s GLU 162 N 1.99 0.01 -0.04 9.51 -6.30 0.13 -0.98 118.70 123.03 3du0 s GLU 162 Ca 0.00 0.02 0.08 0.00 -2.50 0.00 0.00 54.97 52.57 3du0 s GLU 162 Cb 0.00 0.01 0.17 0.00 0.00 0.00 0.00 34.13 34.32 3du0 s GLU 162 CO 0.00 -0.01 1.13 0.00 0.02 0.00 0.00 175.26 176.39 3du0 n ALA 163 N 5.34 2.18 0.20 6.30 0.00 -0.25 -0.92 120.51 133.35 3du0 n ALA 163 Ca -0.09 -1.46 0.03 0.00 0.00 0.00 0.00 53.44 51.92 3du0 n ALA 163 Cb 0.55 -0.24 0.40 0.00 0.00 0.00 0.00 19.45 20.16 3du0 n ALA 163 CO 0.00 0.00 0.00 1.79 0.00 0.00 0.00 177.50 179.29 3du0 h THR 164 N 0.63 1.23 0.00 0.00 1.35 -1.90 -3.43 112.91 110.78 3du0 h THR 164 Ca 0.00 -1.11 0.00 0.00 -0.55 0.00 0.00 66.41 64.75 3du0 h THR 164 Cb 0.74 1.60 0.00 0.00 -1.73 0.00 0.00 68.15 68.76 3du0 h THR 164 CO 0.02 0.32 0.00 0.61 -0.25 0.00 0.00 175.52 176.22 3du0 n GLY 165 N -0.59 0.51 3.46 5.82 0.00 -1.26 -4.99 105.19 108.14 3du0 n GLY 165 Ca -0.02 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.56 3du0 n GLY 165 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 3du0 s ASN 166 N -2.29 6.24 0.23 1.61 3.84 -1.26 -4.94 114.94 118.38 3du0 s ASN 166 Ca 0.00 -0.83 0.25 0.00 0.21 0.00 0.00 52.86 52.50 3du0 s ASN 166 Cb 0.00 -2.32 0.68 0.00 -0.55 0.00 0.00 41.25 39.06 3du0 s ASN 166 CO 0.00 -0.97 1.70 -0.07 -2.79 0.00 0.00 177.10 174.96 3du0 h LEU 167 N 9.99 0.00 -1.88 3.21 3.38 -1.97 -2.66 115.31 125.37 3du0 h LEU 167 Ca -0.27 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.67 3du0 h LEU 167 Cb 1.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.84 3du0 h LEU 167 CO 1.00 0.01 0.00 0.71 0.09 0.00 0.00 178.44 180.25 3du0 h THR 168 N 0.00 0.00 0.00 0.22 1.35 -2.02 -2.74 112.91 109.72 3du0 h THR 168 Ca 0.00 -0.09 -0.13 0.00 -0.55 0.00 0.00 66.41 65.64 3du0 h THR 168 Cb 0.78 0.85 -0.02 0.00 -1.73 0.00 0.00 68.15 68.03 3du0 h THR 168 CO 0.00 0.00 -0.60 0.03 -0.25 0.00 0.00 175.52 174.70 3du0 h ARG 169 N 0.00 0.00 -0.13 4.72 2.47 -1.90 -2.98 114.38 116.55 3du0 h ARG 169 Ca 0.00 0.00 0.04 0.00 -1.26 0.00 0.00 59.98 58.76 3du0 h ARG 169 Cb 0.11 0.00 -0.07 0.00 -1.65 0.00 0.00 29.97 28.37 3du0 h ARG 169 CO 0.00 0.60 -0.48 0.28 0.56 0.00 0.00 179.97 180.93 3du0 h VAL 170 N 0.00 0.07 0.00 2.04 2.07 -1.70 -1.17 116.25 117.56 3du0 h VAL 170 Ca -0.01 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.51 3du0 h VAL 170 Cb 1.07 0.07 0.00 0.00 -1.52 0.00 0.00 31.29 30.91 3du0 h VAL 170 CO 0.08 0.00 -0.56 0.78 0.02 0.00 0.00 177.57 177.89 3du0 h ASN 171 N -0.54 0.00 -0.46 0.57 2.35 -1.77 -0.38 115.58 115.36 3du0 h ASN 171 Ca 0.06 -0.10 -0.07 0.00 -0.55 0.00 0.00 56.30 55.63 3du0 h ASN 171 Cb 0.66 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.01 3du0 h ASN 171 CO -0.42 0.05 -0.00 1.56 -1.65 0.00 0.00 177.43 176.97 3du0 h GLN 172 N 0.00 0.81 0.01 0.81 4.20 -1.37 -1.85 115.11 117.71 3du0 h GLN 172 Ca 0.00 -0.26 -0.00 0.00 0.06 0.00 0.00 58.65 58.45 3du0 h GLN 172 Cb 0.85 -0.07 0.00 0.00 0.30 0.00 0.00 27.48 28.55 3du0 h GLN 172 CO 0.00 0.87 -0.00 0.82 -0.67 0.00 0.00 178.83 179.84 3du0 h ILE 173 N 0.66 1.37 -0.99 2.54 2.04 -1.19 -3.33 117.51 118.61 3du0 h ILE 173 Ca 0.13 -1.15 0.17 0.00 1.00 0.00 0.00 64.86 65.01 3du0 h ILE 173 Cb 0.50 2.15 -0.09 0.00 -0.74 0.00 0.00 36.82 38.64 3du0 h ILE 173 CO 0.02 0.30 0.62 0.50 0.00 0.00 0.00 178.15 179.59 3du0 h LYS 174 N -0.51 0.78 0.00 2.37 3.64 -1.06 0.11 116.57 121.91 3du0 h LYS 174 Ca -0.00 -0.05 -0.00 0.00 -1.27 0.00 0.00 60.65 59.33 3du0 h LYS 174 Cb 0.49 -0.18 -0.00 0.00 -0.41 0.00 0.00 32.23 32.14 3du0 h LYS 174 CO 0.00 0.52 -0.01 0.93 -2.27 0.00 0.00 179.45 178.62 3du0 h GLU 175 N 0.81 0.00 -0.01 1.90 4.39 -1.44 -3.12 114.58 117.11 3du0 h GLU 175 Ca 0.54 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.24 3du0 h GLU 175 Cb 0.78 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.43 3du0 h GLU 175 CO -0.32 0.01 -0.51 1.28 -1.16 0.00 0.00 179.01 178.32 3du0 n LEU 176 N -3.23 1.51 -4.42 1.33 4.77 0.37 -4.99 117.00 112.34 3du0 n LEU 176 Ca -0.02 -0.69 -0.21 0.00 -0.03 0.00 0.00 56.01 55.06 3du0 n LEU 176 Cb 0.13 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.11 3du0 n LEU 176 CO 0.23 0.30 -0.37 0.68 -1.33 0.00 0.00 177.39 176.90 3du0 s VAL 177 N -2.25 1.60 0.81 4.08 -7.23 -1.15 -4.69 120.40 111.57 3du0 s VAL 177 Ca 0.13 -2.12 -0.11 0.00 -1.81 0.00 0.00 61.98 58.06 3du0 s VAL 177 Cb 0.14 -2.42 0.08 0.00 0.56 0.00 0.00 36.38 34.74 3du0 s VAL 177 CO 0.53 -0.32 1.09 -0.94 -0.31 0.00 0.00 175.10 175.16 3du0 s SER 178 N -3.43 4.31 0.61 4.85 1.04 -1.26 -4.94 113.70 114.89 3du0 s SER 178 Ca 0.29 1.49 0.37 0.00 0.48 0.00 0.00 55.95 58.58 3du0 s SER 178 Cb 0.04 -2.22 2.02 0.00 0.10 0.00 0.00 66.02 65.96 3du0 s SER 178 CO 0.11 -2.11 2.26 0.44 0.98 0.00 0.00 173.24 174.93 3du0 h ASP 179 N -1.18 0.00 0.26 7.02 3.32 -2.01 -2.53 116.42 121.30 3du0 h ASP 179 Ca -0.47 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.58 3du0 h ASP 179 Cb 1.26 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.81 3du0 h ASP 179 CO 0.56 0.02 -0.41 -0.90 -1.72 0.00 0.00 179.24 176.80 3du0 n ASP 180 N -3.38 1.00 -4.69 6.45 5.68 -1.26 -4.86 116.55 115.48 3du0 n ASP 180 Ca -0.02 -0.80 -0.42 0.00 -0.50 0.00 0.00 54.79 53.05 3du0 n ASP 180 Cb 0.12 0.27 -0.03 0.00 -1.14 0.00 0.00 41.12 40.34 3du0 n ASP 180 CO 0.00 0.00 0.00 0.12 -1.33 0.00 0.00 177.20 175.99 3du0 s PHE 181 N -2.67 2.44 -0.03 2.11 5.36 -0.95 -4.95 117.98 119.28 3du0 s PHE 181 Ca 0.19 0.29 -0.19 0.00 -0.96 0.00 0.00 56.93 56.26 3du0 s PHE 181 Cb 0.18 -4.00 -0.05 0.00 -0.34 0.00 0.00 43.02 38.82 3du0 s PHE 181 CO 0.60 -3.99 0.55 0.14 -1.46 0.00 0.00 175.22 171.06 3du0 s VAL 182 N 2.51 4.98 -0.29 3.12 -7.23 -0.45 -4.95 120.40 118.09 3du0 s VAL 182 Ca 0.75 1.14 -0.07 0.00 -1.81 0.00 0.00 61.98 61.98 3du0 s VAL 182 Cb -0.41 -3.88 -0.00 0.00 0.56 0.00 0.00 36.38 32.65 3du0 s VAL 182 CO 0.33 0.42 0.09 -0.76 -0.31 0.00 0.00 175.10 174.87 3du0 s LEU 183 N -0.15 3.81 -0.07 1.32 1.43 -1.26 -1.42 118.68 122.34 3du0 s LEU 183 Ca 0.29 -0.59 0.04 0.00 -1.03 0.00 0.00 54.13 52.84 3du0 s LEU 183 Cb -0.17 -1.91 -0.02 0.00 0.03 0.00 0.00 46.19 44.12 3du0 s LEU 183 CO 0.15 -0.16 -0.18 -0.76 0.23 0.00 0.00 176.35 175.63 3du0 s LEU 184 N 1.54 2.49 0.29 1.79 1.43 -0.15 0.01 118.68 126.09 3du0 s LEU 184 Ca 0.04 -0.33 -0.29 0.00 -1.03 0.00 0.00 54.13 52.51 3du0 s LEU 184 Cb -0.17 -1.50 -0.10 0.00 0.03 0.00 0.00 46.19 44.45 3du0 s LEU 184 CO 0.03 0.28 1.16 -0.55 0.23 0.00 0.00 176.35 177.50 3du0 s SER 185 N -0.32 7.13 -0.25 2.29 0.15 -0.53 -0.69 113.70 121.47 3du0 s SER 185 Ca 0.02 2.39 0.10 0.00 0.70 0.00 0.00 55.95 59.16 3du0 s SER 185 Cb -0.13 -2.63 0.47 0.00 -1.71 0.00 0.00 66.02 62.02 3du0 s SER 185 CO 0.02 -0.26 1.36 0.61 1.20 0.00 0.00 173.24 176.17 3du0 n GLY 186 N 1.10 5.00 2.53 9.45 0.00 -0.10 -0.46 105.19 122.70 3du0 n GLY 186 Ca -0.01 -1.26 -0.29 0.00 0.00 0.00 0.00 46.02 44.46 3du0 n GLY 186 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3du0 s ASP 187 N -2.84 3.43 0.23 1.61 2.15 -1.26 -4.60 116.67 115.39 3du0 s ASP 187 Ca 0.42 -1.48 -0.07 0.00 0.43 0.00 0.00 52.55 51.84 3du0 s ASP 187 Cb 0.39 -0.37 0.38 0.00 -0.30 0.00 0.00 42.92 43.01 3du0 s ASP 187 CO -0.03 -0.41 1.72 0.44 -0.17 0.00 0.00 175.17 176.72 3du0 h ASP 188 N 8.11 0.17 -0.07 -0.34 3.32 -1.90 -2.30 116.42 123.41 3du0 h ASP 188 Ca -0.14 0.11 0.02 0.00 0.02 0.00 0.00 57.03 57.03 3du0 h ASP 188 Cb 1.00 0.11 -0.00 0.00 0.22 0.00 0.00 39.33 40.66 3du0 h ASP 188 CO 0.40 0.07 0.06 0.00 -1.72 0.00 0.00 179.24 178.05 3du0 h ALA 189 N 1.51 1.97 -0.21 3.45 0.00 -1.95 -2.52 119.26 121.51 3du0 h ALA 189 Ca 0.37 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.27 3du0 h ALA 189 Cb 0.54 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.34 3du0 h ALA 189 CO -0.39 -0.09 0.00 -1.13 0.00 0.00 0.00 179.25 177.63 3du0 n SER 190 N -4.37 2.95 -0.03 0.00 3.41 -0.91 -4.76 113.62 109.92 3du0 n SER 190 Ca -0.01 -2.45 -0.12 0.00 -0.26 0.00 0.00 58.87 56.02 3du0 n SER 190 Cb 0.16 -0.31 0.01 0.00 -0.26 0.00 0.00 64.21 63.81 3du0 n SER 190 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3du0 h ALA 191 N 1.29 0.57 -0.46 7.33 0.00 -0.98 -0.59 119.26 126.41 3du0 h ALA 191 Ca 0.00 -0.53 -0.05 0.00 0.00 0.00 0.00 54.91 54.33 3du0 h ALA 191 Cb 0.94 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.63 3du0 h ALA 191 CO 0.07 0.69 0.09 1.25 0.00 0.00 0.00 179.25 181.34 3du0 h LEU 192 N 0.52 0.72 -0.60 0.00 5.85 -1.86 -0.44 115.31 119.50 3du0 h LEU 192 Ca 0.00 -0.25 0.05 0.00 0.84 0.00 0.00 57.88 58.52 3du0 h LEU 192 Cb 1.16 -0.19 -0.05 0.00 0.37 0.00 0.00 40.66 41.95 3du0 h LEU 192 CO 0.12 0.79 0.33 0.44 -0.34 0.00 0.00 178.44 179.78 3du0 h ASP 193 N 0.62 0.50 -0.23 1.25 3.32 -1.87 -0.16 116.42 119.85 3du0 h ASP 193 Ca 0.14 0.02 0.06 0.00 0.02 0.00 0.00 57.03 57.27 3du0 h ASP 193 Cb 0.37 -0.08 -0.06 0.00 0.22 0.00 0.00 39.33 39.77 3du0 h ASP 193 CO 0.01 0.34 -0.20 0.15 -1.72 0.00 0.00 179.24 177.81 3du0 h PHE 194 N 0.63 -0.52 -0.65 4.55 3.04 -0.90 -1.88 116.94 121.21 3du0 h PHE 194 Ca 0.26 0.03 -0.04 0.00 3.98 0.00 0.00 57.97 62.21 3du0 h PHE 194 Cb 0.13 0.27 -0.03 0.00 2.56 0.00 0.00 35.95 38.88 3du0 h PHE 194 CO -0.08 -0.28 0.25 0.52 -2.02 0.00 0.00 178.31 176.70 3du0 h MET 195 N -0.21 0.96 0.00 1.11 2.86 -0.68 -1.65 114.93 117.32 3du0 h MET 195 Ca 0.13 -0.16 -0.05 0.00 -2.06 0.00 0.00 59.70 57.56 3du0 h MET 195 Cb 0.41 -0.16 -0.01 0.00 0.06 0.00 0.00 31.60 31.90 3du0 h MET 195 CO -0.35 0.79 -0.23 0.37 1.06 0.00 0.00 176.91 178.54 3du0 h GLN 196 N 0.94 0.00 0.00 1.72 4.15 -0.85 -1.32 115.11 119.75 3du0 h GLN 196 Ca 0.22 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.64 3du0 h GLN 196 Cb 0.20 0.00 0.00 0.00 0.21 0.00 0.00 27.48 27.89 3du0 h GLN 196 CO -0.02 0.23 -0.05 1.28 -1.93 0.00 0.00 178.83 178.35 3du0 n LEU 197 N -4.06 0.46 0.00 -2.39 4.77 -0.72 -4.89 117.00 110.17 3du0 n LEU 197 Ca -0.02 0.51 0.00 0.00 -0.03 0.00 0.00 56.01 56.47 3du0 n LEU 197 Cb 0.30 -0.38 0.00 0.00 -2.33 0.00 0.00 43.42 41.01 3du0 n LEU 197 CO 0.36 -0.09 0.00 0.61 -1.33 0.00 0.00 177.39 176.94 3du0 n GLY 198 N 1.40 -0.56 3.73 -0.72 0.00 -0.51 -4.79 105.19 103.74 3du0 n GLY 198 Ca 0.06 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.75 3du0 n GLY 198 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3du0 s GLY 199 N -0.07 2.08 0.00 -0.02 0.00 -0.66 -4.87 107.32 103.79 3du0 s GLY 199 Ca 0.00 0.66 0.19 0.00 0.00 0.00 0.00 44.72 45.58 3du0 s GLY 199 CO 0.00 1.05 0.92 1.42 0.00 0.00 0.00 173.10 176.49 3du0 n HIS 200 N -3.07 0.00 -3.78 1.90 8.25 0.10 -4.46 115.22 114.16 3du0 n HIS 200 Ca 0.12 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.58 3du0 n HIS 200 Cb 0.51 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.62 3du0 n HIS 200 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3du0 n GLY 201 N 1.36 -0.86 2.95 -1.41 0.00 -1.24 -1.66 105.19 104.33 3du0 n GLY 201 Ca 0.06 -1.06 -0.13 0.00 0.00 0.00 0.00 46.02 44.90 3du0 n GLY 201 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3du0 s VAL 202 N -3.00 -0.03 -0.44 1.61 0.11 -0.27 -1.45 120.40 116.93 3du0 s VAL 202 Ca 0.00 0.09 -0.22 0.00 -2.93 0.00 0.00 61.98 58.93 3du0 s VAL 202 Cb 0.00 -0.20 0.02 0.00 -1.53 0.00 0.00 36.38 34.67 3du0 s VAL 202 CO 0.00 0.04 0.69 -0.63 -3.33 0.00 0.00 175.10 171.87 3du0 s ILE 203 N 0.62 4.76 -0.06 7.04 1.01 0.39 -1.10 121.20 133.87 3du0 s ILE 203 Ca -0.05 0.21 0.06 0.00 0.00 0.00 0.00 60.65 60.88 3du0 s ILE 203 Cb -0.06 -4.25 -0.01 0.00 0.01 0.00 0.00 42.46 38.15 3du0 s ILE 203 CO -0.03 -0.64 -0.25 -0.55 0.00 0.00 0.00 174.94 173.47 3du0 s SER 204 N 2.06 3.08 -0.11 3.58 0.15 0.69 -4.41 113.70 118.73 3du0 s SER 204 Ca 0.25 -0.51 -0.22 0.00 0.70 0.00 0.00 55.95 56.16 3du0 s SER 204 Cb -0.13 -0.89 -0.27 0.00 -1.71 0.00 0.00 66.02 63.01 3du0 s SER 204 CO 0.20 0.24 0.69 0.58 1.20 0.00 0.00 173.24 176.15 3du0 h VAL 205 N 5.11 1.39 -0.99 4.45 2.07 -1.87 -0.80 116.25 125.61 3du0 h VAL 205 Ca -0.31 -2.41 0.23 0.00 0.82 0.00 0.00 66.70 65.03 3du0 h VAL 205 Cb 1.18 3.01 -0.12 0.00 -1.52 0.00 0.00 31.29 33.84 3du0 h VAL 205 CO 0.47 0.64 0.58 0.74 0.02 0.00 0.00 177.57 180.02 3du0 h THR 206 N -0.60 0.57 0.00 2.57 2.02 -1.95 -1.46 112.91 114.07 3du0 h THR 206 Ca -0.17 -0.21 0.00 0.00 0.77 0.00 0.00 66.41 66.80 3du0 h THR 206 Cb 1.46 -0.09 0.00 0.00 -1.74 0.00 0.00 68.15 67.78 3du0 h THR 206 CO 0.04 0.11 0.28 0.00 0.37 0.00 0.00 175.52 176.33 3du0 h ALA 207 N 1.71 1.27 -0.60 6.16 0.00 -1.82 -0.31 119.26 125.67 3du0 h ALA 207 Ca 0.62 0.00 0.09 0.00 0.00 0.00 0.00 54.91 55.63 3du0 h ALA 207 Cb 1.14 0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.90 3du0 h ALA 207 CO -0.46 -0.27 0.40 -0.91 0.00 0.00 0.00 179.25 178.01 3du0 h ASN 208 N 0.00 0.39 0.00 0.00 2.35 -1.50 -2.98 115.58 113.85 3du0 h ASN 208 Ca 0.00 0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.76 3du0 h ASN 208 Cb 0.57 -0.08 0.00 0.00 0.05 0.00 0.00 38.32 38.86 3du0 h ASN 208 CO 0.00 0.24 -0.76 1.33 -1.65 0.00 0.00 177.43 176.59 3du0 n VAL 209 N -4.47 0.00 -2.29 2.81 0.24 -0.62 -4.77 118.33 109.23 3du0 n VAL 209 Ca 0.10 -0.00 -0.26 0.00 -2.04 0.00 0.00 64.34 62.13 3du0 n VAL 209 Cb 0.35 0.39 0.01 0.00 -1.47 0.00 0.00 33.84 33.12 3du0 n VAL 209 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3du0 n ALA 210 N -1.15 5.11 -0.15 2.33 0.00 -0.22 -4.93 120.51 121.49 3du0 n ALA 210 Ca 0.00 -4.12 -0.05 0.00 0.00 0.00 0.00 53.44 49.27 3du0 n ALA 210 Cb 0.00 -0.52 0.04 0.00 0.00 0.00 0.00 19.45 18.98 3du0 n ALA 210 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 3du0 h ALA 211 N 2.44 0.60 -0.31 0.00 0.00 -1.75 -1.49 119.26 118.76 3du0 h ALA 211 Ca 0.34 0.02 -0.07 0.00 0.00 0.00 0.00 54.91 55.19 3du0 h ALA 211 Cb 1.12 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.83 3du0 h ALA 211 CO 0.84 -0.11 -0.10 -0.09 0.00 0.00 0.00 179.25 179.79 3du0 h ARG 212 N 0.47 0.61 -0.62 0.00 2.43 -1.90 -1.13 114.38 114.24 3du0 h ARG 212 Ca 0.21 -0.25 -0.04 0.00 -0.81 0.00 0.00 59.98 59.09 3du0 h ARG 212 Cb 0.11 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 29.61 3du0 h ARG 212 CO -0.15 0.81 0.23 -0.44 -1.51 0.00 0.00 179.97 178.91 3du0 h ASP 213 N 0.38 0.88 -0.31 -3.80 3.32 -1.88 -0.27 116.42 114.74 3du0 h ASP 213 Ca 0.07 -0.19 -0.01 0.00 0.02 0.00 0.00 57.03 56.93 3du0 h ASP 213 Cb 0.60 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.91 3du0 h ASP 213 CO 0.04 0.83 0.16 0.24 -1.72 0.00 0.00 179.24 178.79 3du0 h MET 214 N 0.88 0.43 -0.07 3.56 2.86 -1.16 0.17 114.93 121.60 3du0 h MET 214 Ca 0.20 -0.05 0.01 0.00 -2.06 0.00 0.00 59.70 57.80 3du0 h MET 214 Cb 0.24 -0.08 -0.01 0.00 0.06 0.00 0.00 31.60 31.81 3du0 h MET 214 CO -0.01 0.37 -0.01 0.00 1.06 0.00 0.00 176.91 178.32 3du0 h ALA 215 N 1.03 0.05 -0.49 6.32 0.00 -0.97 -1.38 119.26 123.81 3du0 h ALA 215 Ca 0.11 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.02 3du0 h ALA 215 Cb 0.07 0.04 -0.02 0.00 0.00 0.00 0.00 17.79 17.88 3du0 h ALA 215 CO -0.02 -0.48 0.24 0.37 0.00 0.00 0.00 179.25 179.36 3du0 h GLN 216 N 0.02 0.71 -0.69 0.00 5.75 -0.94 -1.83 115.11 118.13 3du0 h GLN 216 Ca 0.03 -0.10 0.03 0.00 -0.15 0.00 0.00 58.65 58.46 3du0 h GLN 216 Cb 0.04 -0.13 -0.04 0.00 1.07 0.00 0.00 27.48 28.42 3du0 h GLN 216 CO -0.06 0.59 0.43 1.98 -2.65 0.00 0.00 178.83 179.12 3du0 h MET 217 N 0.65 0.83 -0.09 1.69 4.05 -0.52 -0.67 114.93 120.88 3du0 h MET 217 Ca 0.17 -0.05 -0.15 0.00 -0.28 0.00 0.00 59.70 59.39 3du0 h MET 217 Cb 0.11 -0.19 -0.01 0.00 -0.80 0.00 0.00 31.60 30.71 3du0 h MET 217 CO -0.02 0.55 -0.60 0.00 0.23 0.00 0.00 176.91 177.07 3du0 h LYS 219 N 0.23 0.89 -0.69 0.00 3.64 -0.95 -0.76 116.57 118.93 3du0 h LYS 219 Ca -0.00 -0.34 -0.01 0.00 -1.27 0.00 0.00 60.65 59.03 3du0 h LYS 219 Cb 1.11 -0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.84 3du0 h LYS 219 CO 0.10 0.98 0.40 -0.07 -2.27 0.00 0.00 179.45 178.59 3du0 h LEU 220 N 0.73 0.84 -0.57 5.20 3.38 -1.04 -1.26 115.31 122.59 3du0 h LEU 220 Ca 0.12 -0.08 -0.05 0.00 0.09 0.00 0.00 57.88 57.96 3du0 h LEU 220 Cb 0.65 -0.21 -0.02 0.00 0.09 0.00 0.00 40.66 41.16 3du0 h LEU 220 CO 0.04 0.68 0.15 0.00 0.09 0.00 0.00 178.44 179.40 3du0 h ALA 221 N 1.20 0.76 -0.02 1.53 0.00 -1.26 0.15 119.26 121.62 3du0 h ALA 221 Ca 0.25 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 3du0 h ALA 221 Cb 0.00 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.57 3du0 h ALA 221 CO -0.04 0.45 -0.06 0.00 0.00 0.00 0.00 179.25 179.60 3du0 h ALA 222 N 1.03 1.86 0.00 0.00 0.00 -0.75 -1.14 119.26 120.26 3du0 h ALA 222 Ca 0.18 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 55.02 3du0 h ALA 222 Cb 0.33 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.10 3du0 h ALA 222 CO 0.00 0.11 -0.41 0.39 0.00 0.00 0.00 179.25 179.34 3du0 n GLU 223 N -4.45 0.12 -0.31 0.00 1.02 -0.51 -4.94 120.64 111.58 3du0 n GLU 223 Ca -0.02 0.05 0.00 0.00 -0.02 0.00 0.00 57.16 57.16 3du0 n GLU 223 Cb 0.15 -1.59 0.00 0.00 -0.02 0.00 0.00 31.44 29.98 3du0 n GLU 223 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3du0 n GLY 224 N 1.43 0.84 2.82 0.62 0.00 -0.30 -4.99 105.19 105.60 3du0 n GLY 224 Ca 0.05 -0.07 -0.42 0.00 0.00 0.00 0.00 46.02 45.58 3du0 n GLY 224 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3du0 n HIS 225 N -2.31 2.63 -0.03 1.61 8.25 0.38 -4.79 115.22 120.96 3du0 n HIS 225 Ca 0.00 -2.70 -0.12 0.00 -0.26 0.00 0.00 57.72 54.64 3du0 n HIS 225 Cb 0.00 -1.63 0.00 0.00 1.12 0.00 0.00 29.99 29.48 3du0 n HIS 225 CO 0.00 0.00 0.00 0.74 0.64 0.00 0.00 176.34 177.72 3du0 h PHE 226 N 5.28 0.90 -0.42 4.41 0.04 -1.90 -0.97 116.94 124.29 3du0 h PHE 226 Ca 0.40 -0.33 0.03 0.00 2.80 0.00 0.00 57.97 60.87 3du0 h PHE 226 Cb 0.53 -0.17 -0.03 0.00 2.20 0.00 0.00 35.95 38.48 3du0 h PHE 226 CO 1.25 1.12 0.21 0.00 -0.60 0.00 0.00 178.31 180.29 3du0 h ALA 227 N 0.81 0.52 -0.44 2.45 0.00 -1.97 0.33 119.26 120.95 3du0 h ALA 227 Ca 0.00 0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.82 3du0 h ALA 227 Cb 1.16 -0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.87 3du0 h ALA 227 CO 0.12 -0.14 -0.12 0.93 0.00 0.00 0.00 179.25 180.03 3du0 h GLU 228 N 0.43 0.87 -0.63 0.00 3.07 -1.91 -2.50 114.58 113.91 3du0 h GLU 228 Ca 0.18 -0.34 -0.01 0.00 -0.50 0.00 0.00 59.36 58.69 3du0 h GLU 228 Cb 0.08 -0.05 -0.03 0.00 -0.84 0.00 0.00 28.75 27.91 3du0 h GLU 228 CO -0.12 0.98 0.36 0.00 -1.40 0.00 0.00 179.01 178.82 3du0 h ALA 229 N 0.86 1.44 -0.26 3.43 0.00 -0.92 -3.08 119.26 120.73 3du0 h ALA 229 Ca 0.11 -0.09 -0.09 0.00 0.00 0.00 0.00 54.91 54.84 3du0 h ALA 229 Cb 0.67 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 18.19 3du0 h ALA 229 CO 0.05 0.47 -0.24 -0.09 0.00 0.00 0.00 179.25 179.44 3du0 h ARG 230 N 0.87 0.48 -0.11 0.00 2.43 0.07 -1.56 114.38 116.57 3du0 h ARG 230 Ca 0.23 -0.18 0.02 0.00 -0.81 0.00 0.00 59.98 59.24 3du0 h ARG 230 Cb 0.01 -0.03 -0.02 0.00 -0.42 0.00 0.00 29.97 29.51 3du0 h ARG 230 CO -0.04 0.69 -0.01 0.28 -1.51 0.00 0.00 179.97 179.38 3du0 h VAL 231 N 0.43 0.91 -0.13 0.20 2.07 -1.38 0.50 116.25 118.85 3du0 h VAL 231 Ca 0.07 -0.01 0.02 0.00 0.82 0.00 0.00 66.70 67.60 3du0 h VAL 231 Cb 0.65 0.89 -0.02 0.00 -1.52 0.00 0.00 31.29 31.28 3du0 h VAL 231 CO 0.05 0.00 -0.01 0.40 0.02 0.00 0.00 177.57 178.03 3du0 h ILE 232 N 0.02 0.90 -0.93 4.57 2.04 -1.54 -2.97 117.51 119.60 3du0 h ILE 232 Ca 0.05 -0.01 0.11 0.00 1.00 0.00 0.00 64.86 66.01 3du0 h ILE 232 Cb 0.07 0.87 -0.08 0.00 -0.74 0.00 0.00 36.82 36.94 3du0 h ILE 232 CO -0.10 0.00 0.56 -1.13 0.00 0.00 0.00 178.15 177.49 3du0 h ASN 233 N 0.02 0.82 0.30 1.72 -0.00 -1.02 -1.29 115.58 116.13 3du0 h ASN 233 Ca 0.06 0.05 -0.06 0.00 -0.00 0.00 0.00 56.30 56.34 3du0 h ASN 233 Cb 0.08 -0.11 -0.01 0.00 -0.00 0.00 0.00 38.32 38.28 3du0 h ASN 233 CO -0.11 0.45 -0.30 1.56 -0.00 0.00 0.00 177.43 179.03 3du0 h GLN 234 N 0.91 0.00 -0.18 6.67 1.08 -0.75 -0.25 115.11 122.59 3du0 h GLN 234 Ca 0.45 0.00 -0.14 0.00 -1.45 0.00 0.00 58.65 57.51 3du0 h GLN 234 Cb 0.43 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.85 3du0 h GLN 234 CO -0.26 0.30 -0.48 0.00 -0.95 0.00 0.00 178.83 177.45 3du0 h ARG 235 N 0.00 0.47 0.00 1.46 3.08 -1.16 -3.19 114.38 115.03 3du0 h ARG 235 Ca -0.00 -0.26 0.00 0.00 0.07 0.00 0.00 59.98 59.78 3du0 h ARG 235 Cb 0.53 0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.60 3du0 h ARG 235 CO 0.04 0.85 -0.24 1.28 -1.07 0.00 0.00 179.97 180.83 3du0 n LEU 236 N -3.98 0.28 -0.03 3.04 4.77 -0.79 -3.44 117.00 116.85 3du0 n LEU 236 Ca -0.02 0.29 -0.12 0.00 -0.03 0.00 0.00 56.01 56.13 3du0 n LEU 236 Cb 0.55 -0.37 -0.07 0.00 -2.33 0.00 0.00 43.42 41.20 3du0 n LEU 236 CO 0.45 0.04 0.75 -0.03 -1.33 0.00 0.00 177.39 177.27 3du0 h MET 237 N 0.00 0.20 -0.74 3.23 4.05 -1.06 0.21 114.93 120.81 3du0 h MET 237 Ca 0.00 -0.06 0.15 0.00 -0.28 0.00 0.00 59.70 59.51 3du0 h MET 237 Cb 0.53 -0.02 -0.10 0.00 -0.80 0.00 0.00 31.60 31.21 3du0 h MET 237 CO 0.00 0.43 0.25 -1.35 0.23 0.00 0.00 176.91 176.47 3du0 h PRO 238 N -0.06 0.36 -0.66 0.39 0.11 -1.80 -0.09 132.00 130.25 3du0 h PRO 238 Ca 0.03 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.11 3du0 h PRO 238 Cb 0.34 -0.08 -0.03 0.00 0.11 0.00 0.00 31.00 31.34 3du0 h PRO 238 CO 0.00 0.24 0.36 1.25 -0.21 0.00 0.00 178.00 179.64 3du0 h LEU 239 N 0.37 0.82 -0.61 2.35 5.85 -1.56 0.50 115.31 123.03 3du0 h LEU 239 Ca 0.42 -0.09 0.11 0.00 0.84 0.00 0.00 57.88 59.15 3du0 h LEU 239 Cb 0.67 -0.21 -0.08 0.00 0.37 0.00 0.00 40.66 41.41 3du0 h LEU 239 CO -0.45 0.68 0.17 0.45 -0.34 0.00 0.00 178.44 178.95 3du0 h HIS 240 N 0.90 0.28 0.05 1.25 3.86 0.11 -1.48 115.15 120.12 3du0 h HIS 240 Ca 0.23 0.03 -0.00 0.00 -1.16 0.00 0.00 60.37 59.47 3du0 h HIS 240 Cb 0.04 -0.03 0.00 0.00 1.06 0.00 0.00 27.41 28.48 3du0 h HIS 240 CO -0.01 0.01 -0.02 -0.91 0.86 0.00 0.00 177.93 177.86 3du0 h ASN 241 N 0.31 -0.05 1.20 2.45 -0.26 -0.81 -3.38 115.58 115.04 3du0 h ASN 241 Ca 0.32 -0.60 0.00 0.00 -0.56 0.00 0.00 56.30 55.46 3du0 h ASN 241 Cb 0.45 0.01 0.00 0.00 -1.06 0.00 0.00 38.32 37.72 3du0 h ASN 241 CO -0.37 0.62 0.00 0.11 -1.06 0.00 0.00 177.43 176.73 3du0 h LYS 242 N -0.78 0.00 0.00 0.81 1.79 0.03 -0.79 116.57 117.62 3du0 h LYS 242 Ca -0.01 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.46 3du0 h LYS 242 Cb 0.65 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.30 3du0 h LYS 242 CO 0.01 0.00 0.00 1.28 -1.08 0.00 0.00 179.45 179.66 3du0 n LEU 243 N -3.07 0.00 -0.20 2.94 4.77 -0.56 -1.53 117.00 119.35 3du0 n LEU 243 Ca 0.01 0.30 0.09 0.00 -0.03 0.00 0.00 56.01 56.38 3du0 n LEU 243 Cb 0.35 -0.30 0.14 0.00 -2.33 0.00 0.00 43.42 41.27 3du0 n LEU 243 CO 0.28 -0.24 0.51 0.49 -1.33 0.00 0.00 177.39 177.10 3du0 n PHE 244 N -1.30 0.00 0.15 -1.77 3.72 -0.30 -4.47 117.46 113.49 3du0 n PHE 244 Ca 0.03 -0.99 0.02 0.00 -0.05 0.00 0.00 57.45 56.45 3du0 n PHE 244 Cb 0.05 -0.16 0.35 0.00 -0.94 0.00 0.00 39.48 38.78 3du0 n PHE 244 CO 0.00 0.00 0.00 -0.24 -0.05 0.00 0.00 176.76 176.47 3du0 h VAL 245 N 0.78 1.24 -3.45 -4.37 3.04 -1.33 -3.42 116.25 108.74 3du0 h VAL 245 Ca -0.00 -1.11 -0.32 0.00 -1.01 0.00 0.00 66.70 64.26 3du0 h VAL 245 Cb 1.04 1.50 -0.15 0.00 -2.01 0.00 0.00 31.29 31.68 3du0 h VAL 245 CO 0.00 0.33 -0.70 -1.61 -1.01 0.00 0.00 177.57 174.58 3du0 s GLU 246 N -4.39 1.07 0.17 4.17 2.02 -1.26 -5.09 118.70 115.39 3du0 s GLU 246 Ca -0.04 -1.47 -0.33 0.00 0.02 0.00 0.00 54.97 53.15 3du0 s GLU 246 Cb 0.15 -0.56 -0.15 0.00 0.10 0.00 0.00 34.13 33.67 3du0 s GLU 246 CO 0.74 0.04 1.32 -2.30 0.02 0.00 0.00 175.26 175.07 3du0 n PRO 247 N -0.21 1.53 -2.09 0.39 -0.02 -1.26 -4.45 135.00 128.88 3du0 n PRO 247 Ca -0.10 0.55 -0.42 0.00 -2.02 0.00 0.00 63.50 61.51 3du0 n PRO 247 Cb 0.61 -2.15 -0.03 0.00 -0.02 0.00 0.00 33.50 31.91 3du0 n PRO 247 CO 0.00 0.00 0.00 1.21 1.98 0.00 0.00 175.50 178.69 3du0 s ASN 248 N 0.28 6.75 -0.46 2.55 2.47 -1.26 0.06 114.94 125.33 3du0 s ASN 248 Ca 0.75 2.50 0.04 0.00 0.42 0.00 0.00 52.86 56.56 3du0 s ASN 248 Cb -0.79 -2.61 0.61 0.00 -1.45 0.00 0.00 41.25 37.01 3du0 s ASN 248 CO 0.49 -0.66 1.86 -0.81 -3.72 0.00 0.00 177.10 174.25 3du0 n PRO 249 N 3.10 2.28 0.25 0.43 -0.04 -1.26 -4.90 135.00 134.86 3du0 n PRO 249 Ca 0.09 -3.10 -0.16 0.00 -0.04 0.00 0.00 63.50 60.29 3du0 n PRO 249 Cb 0.41 -2.15 -0.08 0.00 -0.04 0.00 0.00 33.50 31.65 3du0 n PRO 249 CO 0.00 0.00 0.00 0.82 -0.04 0.00 0.00 175.50 176.28 3du0 h ILE 250 N 1.02 0.48 -0.36 0.52 2.04 -0.64 -1.63 117.51 118.93 3du0 h ILE 250 Ca 0.57 0.00 -0.05 0.00 1.00 0.00 0.00 64.86 66.38 3du0 h ILE 250 Cb 2.37 0.48 -0.02 0.00 -0.74 0.00 0.00 36.82 38.91 3du0 h ILE 250 CO 1.08 0.00 -0.00 -0.65 0.00 0.00 0.00 178.15 178.57 3du0 h PRO 251 N -0.64 0.57 0.04 2.37 0.11 -1.78 -2.63 132.00 130.05 3du0 h PRO 251 Ca -0.05 -0.13 -0.24 0.00 0.11 0.00 0.00 66.00 65.70 3du0 h PRO 251 Cb 0.52 -0.08 -0.02 0.00 0.11 0.00 0.00 31.00 31.53 3du0 h PRO 251 CO 0.05 0.60 -1.15 -0.24 -0.21 0.00 0.00 178.00 177.05 3du0 h VAL 252 N 0.54 1.56 -0.51 3.15 3.04 -1.78 -1.42 116.25 120.84 3du0 h VAL 252 Ca 0.11 -3.24 -0.01 0.00 -1.01 0.00 0.00 66.70 62.56 3du0 h VAL 252 Cb 0.36 2.84 -0.02 0.00 -2.01 0.00 0.00 31.29 32.45 3du0 h VAL 252 CO 0.01 0.91 0.28 0.11 -1.01 0.00 0.00 177.57 177.87 3du0 h LYS 253 N 0.02 0.71 -0.50 4.17 1.57 -1.27 -1.21 116.57 120.06 3du0 h LYS 253 Ca -0.08 -0.08 0.00 0.00 -1.87 0.00 0.00 60.65 58.62 3du0 h LYS 253 Cb 1.86 -0.14 -0.02 0.00 0.08 0.00 0.00 32.23 34.00 3du0 h LYS 253 CO 0.15 0.56 0.33 2.35 -0.57 0.00 0.00 179.45 182.26 3du0 h TRP 254 N 0.68 0.64 -0.62 -1.35 7.01 -1.37 -1.59 115.95 119.36 3du0 h TRP 254 Ca 0.18 0.01 0.05 0.00 2.11 0.00 0.00 58.89 61.24 3du0 h TRP 254 Cb 0.05 -0.22 -0.05 0.00 -2.10 0.00 0.00 29.16 26.84 3du0 h TRP 254 CO -0.02 0.41 0.34 0.00 -2.79 0.00 0.00 178.44 176.39 3du0 h ALA 255 N 1.17 0.81 -0.37 2.65 0.00 -1.16 0.13 119.26 122.50 3du0 h ALA 255 Ca 0.18 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 55.11 3du0 h ALA 255 Cb -0.06 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 3du0 h ALA 255 CO -0.04 0.02 0.23 0.00 0.00 0.00 0.00 179.25 179.46 3du0 h LYS 257 N 0.49 0.37 0.00 0.00 3.64 -0.93 0.31 116.57 120.45 3du0 h LYS 257 Ca 0.14 -0.02 -0.03 0.00 -1.27 0.00 0.00 60.65 59.46 3du0 h LYS 257 Cb -0.02 -0.08 -0.00 0.00 -0.41 0.00 0.00 32.23 31.72 3du0 h LYS 257 CO -0.03 0.24 -0.15 1.49 -2.27 0.00 0.00 179.45 178.74 3du0 h GLU 258 N 0.38 0.00 0.00 1.90 4.57 -0.71 -1.31 114.58 119.41 3du0 h GLU 258 Ca 0.21 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.39 3du0 h GLU 258 Cb 0.18 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.77 3du0 h GLU 258 CO -0.19 0.15 -0.25 1.28 -1.18 0.00 0.00 179.01 178.81 3du0 n LEU 259 N -4.24 0.44 0.00 1.64 4.77 -0.73 -4.94 117.00 113.94 3du0 n LEU 259 Ca -0.02 0.33 0.00 0.00 -0.03 0.00 0.00 56.01 56.29 3du0 n LEU 259 Cb 0.22 -0.33 0.00 0.00 -2.33 0.00 0.00 43.42 40.97 3du0 n LEU 259 CO 0.35 -0.02 0.00 0.61 -1.33 0.00 0.00 177.39 177.00 3du0 n GLY 260 N 1.43 0.59 0.09 -0.72 0.00 -0.50 -4.96 105.19 101.12 3du0 n GLY 260 Ca 0.06 -0.42 -0.04 0.00 0.00 0.00 0.00 46.02 45.62 3du0 n GLY 260 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3du0 h LEU 261 N 0.00 0.00 -8.42 0.99 3.38 -1.17 -3.45 115.31 106.64 3du0 h LEU 261 Ca 0.00 0.00 -0.38 0.00 0.09 0.00 0.00 57.88 57.59 3du0 h LEU 261 Cb 0.00 0.00 -0.20 0.00 0.09 0.00 0.00 40.66 40.55 3du0 h LEU 261 CO 0.00 0.84 -0.76 0.68 0.09 0.00 0.00 178.44 179.29 3du0 s VAL 262 N -2.78 1.04 0.13 1.22 -7.23 -1.19 -4.35 120.40 107.24 3du0 s VAL 262 Ca 0.01 -1.41 -0.12 0.00 -1.81 0.00 0.00 61.98 58.65 3du0 s VAL 262 Cb 0.09 -1.14 -0.06 0.00 0.56 0.00 0.00 36.38 35.83 3du0 s VAL 262 CO 0.80 -0.34 1.46 0.00 -0.31 0.00 0.00 175.10 176.71 3du0 h ALA 263 N 4.05 0.52 -2.60 1.32 0.00 -1.91 -3.38 119.26 117.26 3du0 h ALA 263 Ca -0.39 -0.43 -0.23 0.00 0.00 0.00 0.00 54.91 53.85 3du0 h ALA 263 Cb 1.19 -0.11 -0.17 0.00 0.00 0.00 0.00 17.79 18.70 3du0 h ALA 263 CO 0.44 0.58 -0.71 0.95 0.00 0.00 0.00 179.25 180.52 3du0 s THR 264 N -4.41 0.59 -0.35 0.00 -4.23 -1.26 -5.01 115.64 100.97 3du0 s THR 264 Ca -0.12 -1.58 0.08 0.00 -1.18 0.00 0.00 61.69 58.90 3du0 s THR 264 Cb 0.10 -1.24 0.72 0.00 1.34 0.00 0.00 72.50 73.42 3du0 s THR 264 CO 0.86 -0.69 1.80 -0.90 -0.54 0.00 0.00 174.62 175.15 3du0 n ASP 265 N 0.57 4.63 -4.77 3.99 5.75 -1.26 -4.46 116.55 120.99 3du0 n ASP 265 Ca -0.17 -3.24 -0.40 0.00 -0.01 0.00 0.00 54.79 50.98 3du0 n ASP 265 Cb 0.58 -0.76 -0.00 0.00 -1.03 0.00 0.00 41.12 39.92 3du0 n ASP 265 CO 0.00 0.00 0.00 -0.89 -0.11 0.00 0.00 177.20 176.20 3du0 s THR 266 N -2.95 2.42 0.37 2.12 2.01 -1.26 -4.70 115.64 113.65 3du0 s THR 266 Ca 0.54 0.38 0.03 0.00 0.31 0.00 0.00 61.69 62.96 3du0 s THR 266 Cb 0.43 -3.23 -0.04 0.00 0.01 0.00 0.00 72.50 69.67 3du0 s THR 266 CO 0.13 0.07 0.10 -0.76 -0.69 0.00 0.00 174.62 173.47 3du0 s LEU 267 N -2.38 2.03 -0.09 4.42 1.43 -1.26 -4.30 118.68 118.52 3du0 s LEU 267 Ca 0.56 -1.55 -0.02 0.00 -1.03 0.00 0.00 54.13 52.09 3du0 s LEU 267 Cb -0.41 -0.20 -0.03 0.00 0.03 0.00 0.00 46.19 45.58 3du0 s LEU 267 CO 0.53 -0.81 -0.01 -0.13 0.23 0.00 0.00 176.35 176.16 3du0 s ARG 268 N -3.80 3.05 0.45 1.70 0.52 -1.26 -4.85 118.95 114.76 3du0 s ARG 268 Ca 0.29 -0.43 -0.25 0.00 -0.52 0.00 0.00 55.73 54.81 3du0 s ARG 268 Cb 0.05 -2.79 -0.09 0.00 0.52 0.00 0.00 34.95 32.64 3du0 s ARG 268 CO 0.15 0.64 1.40 1.28 0.02 0.00 0.00 175.30 178.78 3du0 n LEU 269 N 2.34 4.88 -0.91 2.53 4.77 -1.26 -1.13 117.00 128.22 3du0 n LEU 269 Ca -0.18 1.12 0.03 0.00 -0.03 0.00 0.00 56.01 56.94 3du0 n LEU 269 Cb 0.53 -1.58 0.14 0.00 -2.33 0.00 0.00 43.42 40.19 3du0 n LEU 269 CO 0.29 -0.27 0.51 -0.81 -1.33 0.00 0.00 177.39 175.77 3du0 n PRO 270 N -0.15 2.28 -2.60 3.23 -0.04 -1.26 -4.95 135.00 131.50 3du0 n PRO 270 Ca 0.06 -1.13 -0.41 0.00 -0.04 0.00 0.00 63.50 61.97 3du0 n PRO 270 Cb 0.41 -1.66 -0.05 0.00 -0.04 0.00 0.00 33.50 32.17 3du0 n PRO 270 CO 0.00 0.00 0.00 -1.64 -0.04 0.00 0.00 175.50 173.82 3du0 s MET 271 N -1.65 4.68 0.26 0.54 -1.94 -0.28 -5.06 119.30 115.85 3du0 s MET 271 Ca 0.20 1.63 0.10 0.00 -1.71 0.00 0.00 55.69 55.91 3du0 s MET 271 Cb 0.14 -3.28 -0.05 0.00 2.01 0.00 0.00 34.83 33.65 3du0 s MET 271 CO 0.07 0.22 -0.16 0.95 -0.01 0.00 0.00 175.02 176.09 3du0 s THR 272 N -0.53 2.14 0.62 2.05 -4.23 -1.26 -4.51 115.64 109.92 3du0 s THR 272 Ca 0.46 -2.30 -0.18 0.00 -1.18 0.00 0.00 61.69 58.50 3du0 s THR 272 Cb -0.28 -2.26 -0.06 0.00 1.34 0.00 0.00 72.50 71.24 3du0 s THR 272 CO 0.34 -0.44 0.72 -2.65 -0.54 0.00 0.00 174.62 172.06 3du0 n PRO 273 N -0.55 0.61 -1.98 3.99 -0.02 -1.26 -4.91 135.00 130.88 3du0 n PRO 273 Ca -0.06 0.25 -0.40 0.00 -2.02 0.00 0.00 63.50 61.27 3du0 n PRO 273 Cb 0.61 -1.93 -0.00 0.00 -0.02 0.00 0.00 33.50 32.15 3du0 n PRO 273 CO 0.00 0.00 0.00 -1.50 1.98 0.00 0.00 175.50 175.98 3du0 s ILE 274 N -1.68 2.45 0.80 4.25 2.07 -1.26 -5.03 121.20 122.81 3du0 s ILE 274 Ca 0.72 0.41 -0.12 0.00 -1.41 0.00 0.00 60.65 60.25 3du0 s ILE 274 Cb -0.41 -3.25 0.07 0.00 0.13 0.00 0.00 42.46 39.01 3du0 s ILE 274 CO 0.51 0.07 1.11 0.42 -1.91 0.00 0.00 174.94 175.14 3du0 s THR 275 N -1.22 2.88 0.15 4.00 -4.23 -1.26 -4.89 115.64 111.06 3du0 s THR 275 Ca 0.57 0.28 -0.11 0.00 -1.18 0.00 0.00 61.69 61.26 3du0 s THR 275 Cb -0.40 -3.09 -0.04 0.00 1.34 0.00 0.00 72.50 70.32 3du0 s THR 275 CO 0.52 -0.37 1.49 0.44 -0.54 0.00 0.00 174.62 176.16 3du0 h ASP 276 N -1.09 1.00 -0.99 3.99 3.32 -1.99 -1.19 116.42 119.47 3du0 h ASP 276 Ca -0.47 -0.45 0.05 0.00 0.02 0.00 0.00 57.03 56.18 3du0 h ASP 276 Cb 1.28 -0.28 -0.06 0.00 0.22 0.00 0.00 39.33 40.49 3du0 h ASP 276 CO 0.61 1.25 0.64 -1.28 -1.72 0.00 0.00 179.24 178.75 3du0 h SER 277 N 0.77 1.05 0.15 6.45 0.87 -2.00 -2.34 113.55 118.51 3du0 h SER 277 Ca 0.07 0.00 -0.01 0.00 -1.23 0.00 0.00 61.79 60.62 3du0 h SER 277 Cb 0.96 -0.23 0.00 0.00 -0.44 0.00 0.00 62.40 62.70 3du0 h SER 277 CO 0.09 0.69 -0.07 1.23 -0.53 0.00 0.00 176.83 178.24 3du0 h GLY 278 N 1.20 -0.21 -0.85 5.77 0.00 -1.85 -2.42 103.07 104.69 3du0 h GLY 278 Ca 0.41 0.08 0.14 0.00 0.00 0.00 0.00 47.33 47.96 3du0 h GLY 278 CO -0.15 -0.08 -0.31 -2.13 0.00 0.00 0.00 176.54 173.88 3du0 n ARG 279 N -5.05 -0.17 0.00 4.80 0.63 -0.48 -1.32 116.66 115.07 3du0 n ARG 279 Ca -0.09 1.32 -0.10 0.00 -0.92 0.00 0.00 57.85 58.06 3du0 n ARG 279 Cb 0.21 -1.96 -0.05 0.00 0.45 0.00 0.00 32.46 31.12 3du0 n ARG 279 CO 0.00 0.00 0.00 0.93 -2.51 0.00 0.00 177.63 176.05 3du0 h GLU 280 N 0.00 -0.02 -0.50 -0.14 5.08 -1.24 -0.88 114.58 116.87 3du0 h GLU 280 Ca 0.32 0.00 -0.08 0.00 -1.00 0.00 0.00 59.36 58.61 3du0 h GLU 280 Cb 0.53 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.77 3du0 h GLU 280 CO -0.85 -0.02 0.01 1.15 -1.00 0.00 0.00 179.01 178.30 3du0 h THR 281 N -0.02 1.26 -0.40 1.13 2.02 -0.94 -2.11 112.91 113.85 3du0 h THR 281 Ca 0.05 -1.07 -0.10 0.00 0.77 0.00 0.00 66.41 66.07 3du0 h THR 281 Cb 0.10 0.96 -0.01 0.00 -1.74 0.00 0.00 68.15 67.46 3du0 h THR 281 CO -0.12 0.38 -0.13 0.58 0.37 0.00 0.00 175.52 176.59 3du0 h VAL 282 N 0.74 1.28 -0.54 3.16 2.07 -1.17 -2.17 116.25 119.63 3du0 h VAL 282 Ca 0.14 -1.25 -0.03 0.00 0.82 0.00 0.00 66.70 66.38 3du0 h VAL 282 Cb 0.51 1.25 -0.02 0.00 -1.52 0.00 0.00 31.29 31.50 3du0 h VAL 282 CO 0.02 0.42 0.21 -0.09 0.02 0.00 0.00 177.57 178.15 3du0 h ARG 283 N 0.61 0.81 -0.85 1.57 2.43 -1.04 -0.25 114.38 117.65 3du0 h ARG 283 Ca 0.10 -0.15 0.05 0.00 -0.81 0.00 0.00 59.98 59.17 3du0 h ARG 283 Cb 0.67 -0.13 -0.06 0.00 -0.42 0.00 0.00 29.97 30.03 3du0 h ARG 283 CO 0.05 0.71 0.53 0.00 -1.51 0.00 0.00 179.97 179.76 3du0 h ALA 284 N 1.06 1.16 -0.43 2.80 0.00 -1.41 -1.22 119.26 121.23 3du0 h ALA 284 Ca 0.18 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.98 3du0 h ALA 284 Cb 0.21 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 3du0 h ALA 284 CO -0.01 0.30 -0.10 0.00 0.00 0.00 0.00 179.25 179.44 3du0 h ALA 285 N 1.39 1.02 -0.43 0.00 0.00 -0.61 -0.90 119.26 119.73 3du0 h ALA 285 Ca 0.36 -0.31 -0.15 0.00 0.00 0.00 0.00 54.91 54.82 3du0 h ALA 285 Cb 0.13 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 3du0 h ALA 285 CO -0.16 0.59 -0.30 -0.07 0.00 0.00 0.00 179.25 179.31 3du0 h LEU 286 N 0.70 0.99 -0.45 0.00 3.38 -0.74 -2.01 115.31 117.17 3du0 h LEU 286 Ca 0.12 -0.41 -0.05 0.00 0.09 0.00 0.00 57.88 57.63 3du0 h LEU 286 Cb 0.57 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.02 3du0 h LEU 286 CO 0.03 1.21 0.10 0.11 0.09 0.00 0.00 178.44 179.98 3du0 h LYS 287 N 0.80 0.72 -0.69 1.13 1.57 -0.98 0.26 116.57 119.37 3du0 h LYS 287 Ca 0.08 -0.18 0.08 0.00 -1.87 0.00 0.00 60.65 58.77 3du0 h LYS 287 Cb 0.89 -0.09 -0.04 0.00 0.08 0.00 0.00 32.23 33.06 3du0 h LYS 287 CO 0.08 0.73 0.46 1.25 -0.57 0.00 0.00 179.45 181.39 3du0 h HIS 288 N 0.60 0.65 -0.00 -1.35 2.76 -0.98 0.22 115.15 117.05 3du0 h HIS 288 Ca 0.14 0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.33 3du0 h HIS 288 Cb 0.34 -0.21 0.00 0.00 1.55 0.00 0.00 27.41 29.08 3du0 h HIS 288 CO 0.02 0.33 -0.00 0.00 -1.30 0.00 0.00 177.93 176.97 3du0 n ALA 289 N -2.47 2.66 -1.47 5.26 0.00 -0.77 -4.83 120.51 118.89 3du0 n ALA 289 Ca 0.11 -0.22 -0.08 0.00 0.00 0.00 0.00 53.44 53.25 3du0 n ALA 289 Cb 0.29 -1.48 -0.03 0.00 0.00 0.00 0.00 19.45 18.24 3du0 n ALA 289 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3du0 n GLY 290 N 1.06 0.76 0.06 0.00 0.00 0.78 -4.91 105.19 102.94 3du0 n GLY 290 Ca 0.22 -0.64 0.02 0.00 0.00 0.00 0.00 46.02 45.62 3du0 n GLY 290 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3du0 n LEU 291 N -0.98 0.23 -0.28 0.99 4.77 0.87 -4.99 117.00 117.61 3du0 n LEU 291 Ca -0.08 0.10 0.03 0.00 -0.03 0.00 0.00 56.01 56.03 3du0 n LEU 291 Cb 0.34 0.17 0.03 0.00 -2.33 0.00 0.00 43.42 41.63 3du0 n LEU 291 CO 0.12 0.18 0.36 0.18 -1.33 0.00 0.00 177.39 176.90