#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ai5 s ASN 2 N 0.00 3.77 -0.28 6.43 6.03 -0.54 -3.53 114.94 126.82 1ai5 s ASN 2 Ca 0.00 -1.50 -0.23 0.00 -1.03 0.00 0.00 52.86 50.10 1ai5 s ASN 2 Cb 0.00 0.04 0.11 0.00 -3.03 0.00 0.00 41.25 38.37 1ai5 s ASN 2 CO 0.00 -0.65 0.93 -0.32 -2.03 0.00 0.00 177.10 175.03 1ai5 s MET 3 N -3.79 0.58 -0.05 3.55 -2.45 -0.98 -0.63 119.30 115.53 1ai5 s MET 3 Ca 0.23 0.74 0.00 0.00 -1.25 0.00 0.00 55.69 55.41 1ai5 s MET 3 Cb 0.06 0.26 0.02 0.00 1.25 0.00 0.00 34.83 36.42 1ai5 s MET 3 CO 0.12 -0.08 -0.03 1.67 1.05 0.00 0.00 175.02 177.75 1ai5 s TRP 4 N 0.47 0.70 -0.15 4.11 -2.14 -0.57 -1.99 118.94 119.37 1ai5 s TRP 4 Ca 0.00 -0.19 -0.00 0.00 2.66 0.00 0.00 56.10 58.57 1ai5 s TRP 4 Cb -0.05 -0.69 -0.01 0.00 -3.10 0.00 0.00 33.47 29.63 1ai5 s TRP 4 CO -0.06 -0.23 -0.13 0.08 -2.66 0.00 0.00 176.95 173.94 1ai5 s VAL 5 N 1.23 2.89 -0.25 -0.66 1.01 0.11 -1.75 120.40 122.97 1ai5 s VAL 5 Ca -0.06 -0.70 -0.02 0.00 0.00 0.00 0.00 61.98 61.19 1ai5 s VAL 5 Cb -0.14 -2.22 0.02 0.00 0.00 0.00 0.00 36.38 34.04 1ai5 s VAL 5 CO -0.02 0.51 -0.05 -0.63 0.00 0.00 0.00 175.10 174.92 1ai5 s ILE 6 N 0.65 2.99 0.23 2.22 1.01 0.25 -0.99 121.20 127.56 1ai5 s ILE 6 Ca -0.07 -0.97 -0.02 0.00 0.00 0.00 0.00 60.65 59.59 1ai5 s ILE 6 Cb -0.16 -2.51 0.05 0.00 0.01 0.00 0.00 42.46 39.85 1ai5 s ILE 6 CO 0.02 0.20 0.31 0.61 0.00 0.00 0.00 174.94 176.09 1ai5 n GLY 7 N 4.69 -0.28 0.34 6.18 0.00 -0.35 -1.18 105.19 114.59 1ai5 n GLY 7 Ca -0.16 -1.82 0.01 0.00 0.00 0.00 0.00 46.02 44.04 1ai5 n GLY 7 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ai5 h LYS 8 N 0.00 -0.03 0.00 1.61 1.57 -1.23 0.11 116.57 118.60 1ai5 h LYS 8 Ca -0.10 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.68 1ai5 h LYS 8 Cb 0.32 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.64 1ai5 h LYS 8 CO 0.09 -0.02 0.00 -1.13 -0.57 0.00 0.00 179.45 177.82 1ai5 n SER 9 N -5.51 0.00 -0.02 0.86 3.41 -1.26 -3.58 113.62 107.51 1ai5 n SER 9 Ca 0.11 0.23 0.02 0.00 -0.26 0.00 0.00 58.87 58.96 1ai5 n SER 9 Cb 0.41 -0.40 -0.01 0.00 -0.26 0.00 0.00 64.21 63.95 1ai5 n SER 9 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1ai5 n LYS 10 N -1.40 4.87 -3.12 4.33 5.02 -0.12 -4.88 118.16 122.87 1ai5 n LYS 10 Ca 0.09 -0.12 -0.39 0.00 -2.02 0.00 0.00 58.31 55.88 1ai5 n LYS 10 Cb 0.26 -0.72 -0.06 0.00 -0.02 0.00 0.00 35.03 34.49 1ai5 n LYS 10 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1ai5 s ALA 11 N -1.14 3.50 -0.16 7.82 0.00 -0.37 -0.81 121.76 130.60 1ai5 s ALA 11 Ca 0.02 0.20 -0.01 0.00 0.00 0.00 0.00 51.96 52.17 1ai5 s ALA 11 Cb 0.03 -2.80 -0.01 0.00 0.00 0.00 0.00 23.12 20.34 1ai5 s ALA 11 CO 0.12 0.34 -0.13 -1.14 0.00 0.00 0.00 175.76 174.96 1ai5 s GLN 12 N -1.26 3.30 -0.92 0.00 2.00 0.54 -4.62 119.66 118.70 1ai5 s GLN 12 Ca 0.34 -0.70 0.00 0.00 -2.00 0.00 0.00 55.36 53.00 1ai5 s GLN 12 Cb -0.21 -2.69 0.00 0.00 0.80 0.00 0.00 33.01 30.91 1ai5 s GLN 12 CO 0.23 0.05 0.00 -0.25 -0.50 0.00 0.00 175.29 174.81 1ai5 n ASP 13 N 4.00 -3.71 -3.63 6.67 8.00 -1.26 -4.35 116.55 122.27 1ai5 n ASP 13 Ca -0.19 0.11 -0.02 0.00 0.71 0.00 0.00 54.79 55.41 1ai5 n ASP 13 Cb 0.52 -2.53 -0.00 0.00 -0.02 0.00 0.00 41.12 39.09 1ai5 n ASP 13 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ai5 s ALA 14 N -2.42 -1.81 -0.12 2.24 0.00 -1.26 -1.58 121.76 116.81 1ai5 s ALA 14 Ca 0.00 0.14 0.19 0.00 0.00 0.00 0.00 51.96 52.29 1ai5 s ALA 14 Cb 0.00 0.61 -0.28 0.00 0.00 0.00 0.00 23.12 23.45 1ai5 s ALA 14 CO 0.00 -1.06 0.24 1.63 0.00 0.00 0.00 175.76 176.58 1ai5 n LYS 15 N -0.55 0.74 -3.63 0.00 5.02 0.16 -4.71 118.16 115.19 1ai5 n LYS 15 Ca -0.05 -0.09 -0.13 0.00 -2.02 0.00 0.00 58.31 56.02 1ai5 n LYS 15 Cb 0.61 -1.50 -0.07 0.00 -0.02 0.00 0.00 35.03 34.05 1ai5 n LYS 15 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1ai5 s ALA 16 N -2.91 -1.83 -0.06 7.82 0.00 -1.16 -1.56 121.76 122.06 1ai5 s ALA 16 Ca -0.09 1.99 0.01 0.00 0.00 0.00 0.00 51.96 53.87 1ai5 s ALA 16 Cb 0.09 -1.25 0.02 0.00 0.00 0.00 0.00 23.12 21.99 1ai5 s ALA 16 CO 0.83 -0.31 -0.05 0.42 0.00 0.00 0.00 175.76 176.65 1ai5 s ILE 17 N 0.33 0.64 -0.11 0.00 1.01 -0.33 -1.18 121.20 121.56 1ai5 s ILE 17 Ca 0.01 -0.16 0.02 0.00 0.00 0.00 0.00 60.65 60.52 1ai5 s ILE 17 Cb -0.05 -0.66 0.01 0.00 0.01 0.00 0.00 42.46 41.77 1ai5 s ILE 17 CO -0.01 0.26 -0.18 -0.32 0.00 0.00 0.00 174.94 174.69 1ai5 s MET 18 N 1.06 2.51 -0.10 2.79 -2.45 -0.74 -0.58 119.30 121.78 1ai5 s MET 18 Ca -0.09 -0.67 0.01 0.00 -1.25 0.00 0.00 55.69 53.69 1ai5 s MET 18 Cb -0.14 -2.06 0.02 0.00 1.25 0.00 0.00 34.83 33.90 1ai5 s MET 18 CO -0.01 -0.01 -0.12 0.08 1.05 0.00 0.00 175.02 176.01 1ai5 s VAL 19 N 0.84 1.25 -0.04 10.11 1.01 -0.72 -1.61 120.40 131.24 1ai5 s VAL 19 Ca -0.09 -0.48 0.05 0.00 0.00 0.00 0.00 61.98 61.46 1ai5 s VAL 19 Cb -0.15 -1.18 -0.01 0.00 0.00 0.00 0.00 36.38 35.04 1ai5 s VAL 19 CO -0.00 0.40 -0.18 0.21 0.00 0.00 0.00 175.10 175.52 1ai5 s ASN 20 N 1.19 2.29 -0.45 3.32 3.84 -0.87 -1.51 114.94 122.75 1ai5 s ASN 20 Ca -0.04 -0.37 0.06 0.00 0.21 0.00 0.00 52.86 52.72 1ai5 s ASN 20 Cb -0.14 -0.57 0.21 0.00 -0.55 0.00 0.00 41.25 40.19 1ai5 s ASN 20 CO -0.03 0.18 0.46 0.61 -2.79 0.00 0.00 177.10 175.53 1ai5 n GLY 21 N 3.03 2.85 3.73 1.21 0.00 0.20 -2.56 105.19 113.64 1ai5 n GLY 21 Ca -0.17 -1.67 -0.42 0.00 0.00 0.00 0.00 46.02 43.76 1ai5 n GLY 21 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1ai5 s PRO 22 N -0.81 4.20 -0.34 1.61 0.04 -1.25 -1.47 135.00 136.97 1ai5 s PRO 22 Ca 0.34 2.41 0.01 0.00 0.04 0.00 0.00 61.00 63.80 1ai5 s PRO 22 Cb 0.09 -3.11 0.09 0.00 0.04 0.00 0.00 34.50 31.61 1ai5 s PRO 22 CO -0.14 -0.59 0.07 -0.65 0.04 0.00 0.00 177.00 175.72 1ai5 s GLN 23 N 0.56 1.92 0.00 4.56 -0.21 -1.26 0.03 119.66 125.26 1ai5 s GLN 23 Ca 0.67 -1.68 0.05 0.00 0.02 0.00 0.00 55.36 54.43 1ai5 s GLN 23 Cb -0.45 -3.28 0.03 0.00 1.00 0.00 0.00 33.01 30.31 1ai5 s GLN 23 CO 0.37 -0.87 0.60 1.19 -2.12 0.00 0.00 175.29 174.45 1ai5 n PHE 24 N 4.45 0.00 0.00 0.91 3.72 -1.26 -4.63 117.46 120.65 1ai5 n PHE 24 Ca -0.04 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.36 1ai5 n PHE 24 Cb 0.42 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.96 1ai5 n PHE 24 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1ai5 n GLY 25 N 0.40 0.97 3.04 1.37 0.00 -1.26 -4.97 105.19 104.74 1ai5 n GLY 25 Ca 0.03 -2.16 -0.28 0.00 0.00 0.00 0.00 46.02 43.60 1ai5 n GLY 25 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1ai5 s TRP 26 N -1.30 1.86 0.11 1.61 0.51 -1.26 -4.59 118.94 115.88 1ai5 s TRP 26 Ca 0.00 -0.85 0.03 0.00 -2.12 0.00 0.00 56.10 53.16 1ai5 s TRP 26 Cb 0.00 -1.35 -0.04 0.00 -0.81 0.00 0.00 33.47 31.26 1ai5 s TRP 26 CO 0.00 -0.45 -0.08 0.71 -0.51 0.00 0.00 176.95 176.62 1ai5 s TYR 27 N 0.99 1.03 -0.07 -1.98 2.02 -1.26 -2.19 117.35 115.90 1ai5 s TYR 27 Ca -0.07 -0.83 -0.01 0.00 -0.37 0.00 0.00 57.07 55.79 1ai5 s TYR 27 Cb -0.15 -0.56 0.03 0.00 -0.40 0.00 0.00 41.96 40.88 1ai5 s TYR 27 CO -0.01 -0.05 0.01 0.00 -1.57 0.00 0.00 175.55 173.92 1ai5 s ALA 28 N -3.37 0.66 0.96 3.71 0.00 0.49 -3.38 121.76 120.84 1ai5 s ALA 28 Ca 0.13 -0.10 -0.12 0.00 0.00 0.00 0.00 51.96 51.86 1ai5 s ALA 28 Cb 0.03 -0.73 0.17 0.00 0.00 0.00 0.00 23.12 22.59 1ai5 s ALA 28 CO -0.02 -0.45 1.11 -1.25 0.00 0.00 0.00 175.76 175.15 1ai5 s PRO 29 N 1.96 0.72 0.43 0.00 0.04 -1.26 -4.22 135.00 132.67 1ai5 s PRO 29 Ca 0.05 0.40 -0.23 0.00 0.04 0.00 0.00 61.00 61.25 1ai5 s PRO 29 Cb -0.12 -1.78 -0.11 0.00 0.04 0.00 0.00 34.50 32.53 1ai5 s PRO 29 CO -0.05 -2.51 0.88 0.00 0.04 0.00 0.00 177.00 175.36 1ai5 n ALA 30 N -4.00 -0.28 -0.23 8.56 0.00 -1.22 -4.91 120.51 118.43 1ai5 n ALA 30 Ca 0.06 0.19 -0.07 0.00 0.00 0.00 0.00 53.44 53.62 1ai5 n ALA 30 Cb 0.58 -2.00 0.04 0.00 0.00 0.00 0.00 19.45 18.07 1ai5 n ALA 30 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 1ai5 h TYR 31 N 1.25 1.01 -1.64 0.00 3.20 -1.83 -3.45 116.97 115.50 1ai5 h TYR 31 Ca -0.44 -0.08 -0.53 0.00 3.14 0.00 0.00 58.73 60.83 1ai5 h TYR 31 Cb 1.36 -0.30 -0.06 0.00 1.54 0.00 0.00 36.73 39.27 1ai5 h TYR 31 CO 0.41 0.80 -0.45 0.95 -1.64 0.00 0.00 178.16 178.22 1ai5 s THR 32 N -5.52 2.69 -0.09 1.81 -4.23 -1.26 -2.34 115.64 106.70 1ai5 s THR 32 Ca -0.13 -1.53 -0.01 0.00 -1.18 0.00 0.00 61.69 58.84 1ai5 s THR 32 Cb 0.14 -3.01 0.03 0.00 1.34 0.00 0.00 72.50 71.00 1ai5 s THR 32 CO 0.81 -0.05 -0.01 -0.47 -0.54 0.00 0.00 174.62 174.36 1ai5 s TYR 33 N -2.49 0.89 0.23 3.99 5.04 0.05 -4.86 117.35 120.20 1ai5 s TYR 33 Ca 0.43 -0.37 -0.30 0.00 -2.44 0.00 0.00 57.07 54.39 1ai5 s TYR 33 Cb -0.01 -0.92 -0.09 0.00 0.35 0.00 0.00 41.96 41.29 1ai5 s TYR 33 CO 0.25 -0.40 0.94 0.20 -1.34 0.00 0.00 175.55 175.20 1ai5 s GLY 34 N 1.90 3.11 -0.28 8.97 0.00 -1.26 -2.49 107.32 117.27 1ai5 s GLY 34 Ca 0.04 0.62 -0.17 0.00 0.00 0.00 0.00 44.72 45.20 1ai5 s GLY 34 CO -0.06 1.20 0.85 -1.50 0.00 0.00 0.00 173.10 173.59 1ai5 s ILE 35 N -1.12 0.00 -0.06 0.90 1.10 -0.78 -4.99 121.20 116.25 1ai5 s ILE 35 Ca 0.41 0.00 0.04 0.00 -0.51 0.00 0.00 60.65 60.59 1ai5 s ILE 35 Cb -0.26 -1.00 -0.02 0.00 0.15 0.00 0.00 42.46 41.33 1ai5 s ILE 35 CO 0.32 0.00 -0.17 -0.83 -2.11 0.00 0.00 174.94 172.14 1ai5 s GLY 36 N 1.30 1.46 -0.12 1.50 0.00 -1.26 -2.84 107.32 107.36 1ai5 s GLY 36 Ca -0.08 -0.99 -0.01 0.00 0.00 0.00 0.00 44.72 43.64 1ai5 s GLY 36 CO -0.15 -0.65 -0.03 1.08 0.00 0.00 0.00 173.10 173.35 1ai5 s LEU 37 N -0.39 1.06 -0.37 0.66 1.43 -0.37 -4.99 118.68 115.71 1ai5 s LEU 37 Ca 0.04 -0.35 0.00 0.00 -1.03 0.00 0.00 54.13 52.79 1ai5 s LEU 37 Cb -0.12 -0.69 0.12 0.00 0.03 0.00 0.00 46.19 45.53 1ai5 s LEU 37 CO 0.02 -0.18 0.18 -1.00 0.23 0.00 0.00 176.35 175.60 1ai5 s HIS 38 N 1.80 1.54 0.00 0.29 3.76 -1.25 -0.67 115.29 120.76 1ai5 s HIS 38 Ca 0.04 -1.94 0.00 0.00 -0.15 0.00 0.00 55.06 53.00 1ai5 s HIS 38 Cb -0.13 -1.58 0.00 0.00 1.11 0.00 0.00 32.58 31.97 1ai5 s HIS 38 CO -0.07 -0.83 0.00 0.41 -0.85 0.00 0.00 174.74 173.40 1ai5 n GLY 39 N 4.19 3.24 3.92 -2.22 0.00 0.34 -5.01 105.19 109.64 1ai5 n GLY 39 Ca 0.05 -1.26 -0.30 0.00 0.00 0.00 0.00 46.02 44.51 1ai5 n GLY 39 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ai5 n ALA 40 N -1.45 -1.30 0.00 4.61 0.00 -1.26 -0.58 120.51 120.53 1ai5 n ALA 40 Ca 0.00 0.19 0.00 0.00 0.00 0.00 0.00 53.44 53.63 1ai5 n ALA 40 Cb 0.00 -4.44 0.00 0.00 0.00 0.00 0.00 19.45 15.01 1ai5 n ALA 40 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ai5 n GLY 41 N -1.69 2.25 3.83 0.00 0.00 -1.26 -5.03 105.19 103.29 1ai5 n GLY 41 Ca 0.04 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.68 1ai5 n GLY 41 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ai5 s TYR 42 N -2.64 3.62 -0.44 1.61 2.02 0.25 -4.84 117.35 116.94 1ai5 s TYR 42 Ca 0.00 0.72 0.05 0.00 -0.37 0.00 0.00 57.07 57.47 1ai5 s TYR 42 Cb 0.00 -2.15 0.19 0.00 -0.40 0.00 0.00 41.96 39.60 1ai5 s TYR 42 CO 0.00 0.61 0.48 -3.47 -1.57 0.00 0.00 175.55 171.59 1ai5 n ASP 43 N 2.23 -1.21 -4.26 2.29 2.03 -1.20 -0.51 116.55 115.92 1ai5 n ASP 43 Ca -0.16 -2.58 -0.15 0.00 0.52 0.00 0.00 54.79 52.42 1ai5 n ASP 43 Cb 0.53 0.08 -0.10 0.00 -0.72 0.00 0.00 41.12 40.91 1ai5 n ASP 43 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 1ai5 s VAL 44 N 0.12 1.26 -0.14 5.18 -7.23 0.15 -4.35 120.40 115.39 1ai5 s VAL 44 Ca 0.33 -2.07 -0.12 0.00 -1.81 0.00 0.00 61.98 58.30 1ai5 s VAL 44 Cb 0.06 -1.87 0.04 0.00 0.56 0.00 0.00 36.38 35.17 1ai5 s VAL 44 CO -0.16 -0.72 0.38 0.28 -0.31 0.00 0.00 175.10 174.58 1ai5 s THR 45 N -3.24 -0.00 -4.75 5.32 -1.32 -1.01 -1.24 115.64 109.40 1ai5 s THR 45 Ca 0.17 0.02 0.00 0.00 -1.21 0.00 0.00 61.69 60.67 1ai5 s THR 45 Cb 0.02 -0.54 0.00 0.00 -1.51 0.00 0.00 72.50 70.47 1ai5 s THR 45 CO 0.02 0.01 0.00 0.61 -2.21 0.00 0.00 174.62 173.04 1ai5 n GLY 46 N 3.09 -0.50 3.14 6.08 0.00 -1.13 -1.86 105.19 114.00 1ai5 n GLY 46 Ca -0.15 -0.92 -0.09 0.00 0.00 0.00 0.00 46.02 44.86 1ai5 n GLY 46 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ai5 s ASN 47 N -4.00 0.21 -0.15 1.61 2.20 -0.47 -1.86 114.94 112.47 1ai5 s ASN 47 Ca 0.00 -0.63 -0.18 0.00 -0.94 0.00 0.00 52.86 51.11 1ai5 s ASN 47 Cb 0.00 0.25 0.05 0.00 -2.00 0.00 0.00 41.25 39.55 1ai5 s ASN 47 CO 0.00 -0.58 0.49 0.28 -2.94 0.00 0.00 177.10 174.35 1ai5 s THR 48 N -3.12 0.01 0.27 0.54 -1.32 -1.04 -2.35 115.64 108.63 1ai5 s THR 48 Ca -0.01 -0.06 -0.30 0.00 -1.21 0.00 0.00 61.69 60.11 1ai5 s THR 48 Cb 0.02 -0.72 -0.13 0.00 -1.51 0.00 0.00 72.50 70.16 1ai5 s THR 48 CO -0.07 -0.04 1.40 -2.65 -2.21 0.00 0.00 174.62 171.05 1ai5 n PRO 49 N 2.42 2.11 -2.30 7.08 -0.02 -1.26 -0.77 135.00 142.26 1ai5 n PRO 49 Ca -0.15 0.75 -0.11 0.00 -2.02 0.00 0.00 63.50 61.96 1ai5 n PRO 49 Cb 0.56 -2.40 -0.01 0.00 -0.02 0.00 0.00 33.50 31.63 1ai5 n PRO 49 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 1ai5 n PHE 50 N 1.61 -1.32 -4.19 6.00 3.72 -0.99 -2.28 117.46 120.01 1ai5 n PHE 50 Ca 0.10 0.00 -0.33 0.00 -0.05 0.00 0.00 57.45 57.17 1ai5 n PHE 50 Cb 0.33 -2.60 -0.04 0.00 -0.94 0.00 0.00 39.48 36.23 1ai5 n PHE 50 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1ai5 n ALA 51 N -1.90 -1.53 -1.39 4.37 0.00 -1.16 -4.91 120.51 114.00 1ai5 n ALA 51 Ca -0.13 -0.13 -0.37 0.00 0.00 0.00 0.00 53.44 52.81 1ai5 n ALA 51 Cb 0.57 -2.62 0.06 0.00 0.00 0.00 0.00 19.45 17.46 1ai5 n ALA 51 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1ai5 n TYR 52 N -4.39 -0.32 -0.25 0.00 4.01 -0.97 -4.88 117.16 110.36 1ai5 n TYR 52 Ca -0.06 0.39 0.05 0.00 -0.16 0.00 0.00 57.90 58.12 1ai5 n TYR 52 Cb 0.56 -1.98 0.18 0.00 -0.31 0.00 0.00 39.34 37.79 1ai5 n TYR 52 CO 0.00 0.00 0.00 -1.35 -0.46 0.00 0.00 176.86 175.05 1ai5 h PRO 53 N -0.05 0.28 -5.88 -0.72 0.11 -1.93 -3.39 132.00 120.41 1ai5 h PRO 53 Ca -0.46 -0.02 -0.63 0.00 0.11 0.00 0.00 66.00 65.00 1ai5 h PRO 53 Cb 1.36 -0.06 -0.06 0.00 0.11 0.00 0.00 31.00 32.35 1ai5 h PRO 53 CO 0.46 0.19 -0.30 0.20 -0.21 0.00 0.00 178.00 178.33 1ai5 s GLY 54 N -3.52 2.37 -0.34 -0.55 0.00 -1.26 -4.90 107.32 99.12 1ai5 s GLY 54 Ca -0.13 -0.37 -0.27 0.00 0.00 0.00 0.00 44.72 43.96 1ai5 s GLY 54 CO 0.76 -0.04 0.98 1.08 0.00 0.00 0.00 173.10 175.88 1ai5 s LEU 55 N -1.06 3.97 0.32 0.66 1.02 -1.26 -4.89 118.68 117.44 1ai5 s LEU 55 Ca 0.21 0.78 0.14 0.00 0.02 0.00 0.00 54.13 55.28 1ai5 s LEU 55 Cb -0.15 -3.37 0.52 0.00 0.02 0.00 0.00 46.19 43.21 1ai5 s LEU 55 CO 0.10 -0.85 1.67 0.58 0.02 0.00 0.00 176.35 177.87 1ai5 h VAL 56 N 5.77 1.18 -3.41 -1.59 2.07 -1.91 -3.43 116.25 114.94 1ai5 h VAL 56 Ca -0.22 -1.82 -0.57 0.00 0.82 0.00 0.00 66.70 64.91 1ai5 h VAL 56 Cb 1.07 2.03 -0.38 0.00 -1.52 0.00 0.00 31.29 32.49 1ai5 h VAL 56 CO 1.00 0.49 -0.79 -0.36 0.02 0.00 0.00 177.57 177.92 1ai5 s PHE 57 N -3.63 1.87 -2.16 1.57 0.08 -0.99 -4.10 117.98 110.62 1ai5 s PHE 57 Ca -0.01 -1.27 0.00 0.00 0.12 0.00 0.00 56.93 55.77 1ai5 s PHE 57 Cb 0.12 -1.38 0.00 0.00 -0.57 0.00 0.00 43.02 41.19 1ai5 s PHE 57 CO 0.73 -0.67 0.00 0.41 -0.10 0.00 0.00 175.22 175.59 1ai5 n GLY 58 N 4.82 -0.75 3.52 4.36 0.00 -1.19 -1.37 105.19 114.58 1ai5 n GLY 58 Ca -0.12 -0.87 -0.10 0.00 0.00 0.00 0.00 46.02 44.94 1ai5 n GLY 58 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1ai5 s HIS 59 N -3.00 -0.19 -0.09 1.61 -3.43 -0.78 -2.37 115.29 107.05 1ai5 s HIS 59 Ca 0.00 -0.15 0.13 0.00 -0.80 0.00 0.00 55.06 54.24 1ai5 s HIS 59 Cb 0.00 0.43 0.19 0.00 -1.43 0.00 0.00 32.58 31.77 1ai5 s HIS 59 CO 0.00 -0.92 1.09 0.27 -2.00 0.00 0.00 174.74 173.18 1ai5 n ASN 60 N -0.35 2.12 0.00 7.38 2.04 -0.85 -2.40 115.26 123.20 1ai5 n ASN 60 Ca -0.11 -2.71 0.00 0.00 -0.44 0.00 0.00 54.58 51.32 1ai5 n ASN 60 Cb 0.63 -0.30 0.00 0.00 -2.53 0.00 0.00 39.78 37.58 1ai5 n ASN 60 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1ai5 n GLY 61 N -1.10 2.71 0.82 4.83 0.00 -1.26 -4.69 105.19 106.49 1ai5 n GLY 61 Ca 0.11 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.08 1ai5 n GLY 61 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1ai5 n VAL 62 N -2.00 0.24 -4.45 1.61 0.31 -1.26 -4.80 118.33 107.98 1ai5 n VAL 62 Ca 0.00 -0.06 -0.25 0.00 -0.01 0.00 0.00 64.34 64.02 1ai5 n VAL 62 Cb 0.00 -1.51 -0.11 0.00 -0.91 0.00 0.00 33.84 31.31 1ai5 n VAL 62 CO 0.00 0.00 0.00 0.27 -1.32 0.00 0.00 176.83 175.78 1ai5 s ILE 63 N -2.08 2.40 0.14 2.52 -4.36 -1.26 -0.84 121.20 117.72 1ai5 s ILE 63 Ca -0.06 -2.28 0.07 0.00 -0.26 0.00 0.00 60.65 58.11 1ai5 s ILE 63 Cb 0.02 -2.23 -0.04 0.00 1.25 0.00 0.00 42.46 41.46 1ai5 s ILE 63 CO 0.08 -0.32 -0.15 -0.94 0.24 0.00 0.00 174.94 173.85 1ai5 s SER 64 N -3.23 2.22 0.06 4.36 1.04 0.55 -2.01 113.70 116.68 1ai5 s SER 64 Ca 0.27 -0.85 -0.03 0.00 0.48 0.00 0.00 55.95 55.82 1ai5 s SER 64 Cb -0.06 -0.09 -0.03 0.00 0.10 0.00 0.00 66.02 65.94 1ai5 s SER 64 CO 0.13 -0.13 0.02 -1.66 0.98 0.00 0.00 173.24 172.59 1ai5 s TRP 65 N -2.25 0.45 0.13 5.02 -2.14 -1.00 -1.40 118.94 117.75 1ai5 s TRP 65 Ca 0.12 -0.97 -0.26 0.00 2.66 0.00 0.00 56.10 57.66 1ai5 s TRP 65 Cb -0.04 -0.32 0.07 0.00 -3.10 0.00 0.00 33.47 30.08 1ai5 s TRP 65 CO 0.04 -0.42 0.98 0.20 -2.66 0.00 0.00 176.95 175.09 1ai5 s GLY 66 N -2.91 -0.26 0.04 3.67 0.00 -1.07 -3.20 107.32 103.59 1ai5 s GLY 66 Ca 0.07 0.21 -0.02 0.00 0.00 0.00 0.00 44.72 44.99 1ai5 s GLY 66 CO -0.10 0.03 -0.01 -0.56 0.00 0.00 0.00 173.10 172.46 1ai5 s SER 67 N -2.92 0.38 0.12 1.64 0.01 -1.26 -1.37 113.70 110.30 1ai5 s SER 67 Ca 0.12 -0.82 -0.02 0.00 1.31 0.00 0.00 55.95 56.54 1ai5 s SER 67 Cb -0.01 0.19 -0.04 0.00 0.21 0.00 0.00 66.02 66.37 1ai5 s SER 67 CO 0.01 -0.53 0.07 0.42 0.41 0.00 0.00 173.24 173.62 1ai5 s THR 68 N -3.23 0.11 0.19 1.44 -4.23 -0.87 -4.74 115.64 104.31 1ai5 s THR 68 Ca 0.01 -1.85 -0.30 0.00 -1.18 0.00 0.00 61.69 58.36 1ai5 s THR 68 Cb 0.03 -1.96 -0.09 0.00 1.34 0.00 0.00 72.50 71.82 1ai5 s THR 68 CO -0.07 -0.52 1.39 0.00 -0.54 0.00 0.00 174.62 174.88 1ai5 s ALA 69 N -4.02 3.59 0.02 3.99 0.00 -1.26 -0.97 121.76 123.11 1ai5 s ALA 69 Ca 0.21 1.20 -0.12 0.00 0.00 0.00 0.00 51.96 53.25 1ai5 s ALA 69 Cb 0.07 -3.53 -0.33 0.00 0.00 0.00 0.00 23.12 19.33 1ai5 s ALA 69 CO 0.00 -0.63 0.95 0.78 0.00 0.00 0.00 175.76 176.86 1ai5 h GLY 70 N 5.72 0.52 -6.30 0.00 0.00 -1.53 -3.41 103.07 98.07 1ai5 h GLY 70 Ca -0.44 -1.32 -0.47 0.00 0.00 0.00 0.00 47.33 45.10 1ai5 h GLY 70 CO 0.81 1.15 -0.80 0.69 0.00 0.00 0.00 176.54 178.39 1ai5 n PHE 71 N -3.64 -2.06 -2.52 5.60 3.72 -1.26 -4.92 117.46 112.39 1ai5 n PHE 71 Ca -0.17 0.86 -0.22 0.00 -0.05 0.00 0.00 57.45 57.87 1ai5 n PHE 71 Cb 1.08 -3.99 0.05 0.00 -0.94 0.00 0.00 39.48 35.68 1ai5 n PHE 71 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 176.76 176.91 1ai5 s GLY 72 N -3.76 1.79 -0.48 1.37 0.00 -1.26 -1.21 107.32 103.77 1ai5 s GLY 72 Ca 0.39 -1.23 -0.22 0.00 0.00 0.00 0.00 44.72 43.66 1ai5 s GLY 72 CO 0.84 -0.91 0.74 -0.35 0.00 0.00 0.00 173.10 173.43 1ai5 s ASP 73 N -4.46 6.33 0.00 1.64 -1.08 -1.26 -4.12 116.67 113.72 1ai5 s ASP 73 Ca 0.58 -0.39 0.00 0.00 -0.52 0.00 0.00 52.55 52.22 1ai5 s ASP 73 Cb -0.10 -2.36 0.00 0.00 -1.46 0.00 0.00 42.92 39.00 1ai5 s ASP 73 CO 0.40 -0.93 0.79 -0.90 0.52 0.00 0.00 175.17 175.05 1ai5 n ASP 74 N 6.62 1.27 -4.03 -0.34 5.68 -1.26 -4.72 116.55 119.76 1ai5 n ASP 74 Ca -0.01 -1.61 -0.24 0.00 -0.50 0.00 0.00 54.79 52.43 1ai5 n ASP 74 Cb 0.47 0.00 -0.16 0.00 -1.14 0.00 0.00 41.12 40.29 1ai5 n ASP 74 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 1ai5 s VAL 75 N -0.61 1.13 0.13 2.12 1.01 -1.26 -1.04 120.40 121.88 1ai5 s VAL 75 Ca 0.00 -0.49 0.04 0.00 0.00 0.00 0.00 61.98 61.53 1ai5 s VAL 75 Cb 0.00 -1.02 -0.04 0.00 0.00 0.00 0.00 36.38 35.32 1ai5 s VAL 75 CO 0.00 0.35 -0.10 -1.81 0.00 0.00 0.00 175.10 173.54 1ai5 s ASP 76 N 0.54 1.69 -0.11 3.32 1.01 -0.76 -4.94 116.67 117.43 1ai5 s ASP 76 Ca -0.12 -0.94 -0.02 0.00 0.71 0.00 0.00 52.55 52.18 1ai5 s ASP 76 Cb -0.15 -0.01 -0.03 0.00 1.01 0.00 0.00 42.92 43.75 1ai5 s ASP 76 CO 0.03 -0.30 -0.03 -0.63 0.21 0.00 0.00 175.17 174.44 1ai5 s ILE 77 N -3.01 3.97 -0.18 0.77 -1.09 -1.26 -0.90 121.20 119.51 1ai5 s ILE 77 Ca 0.13 -0.36 -0.03 0.00 -2.23 0.00 0.00 60.65 58.16 1ai5 s ILE 77 Cb 0.01 -2.69 -0.02 0.00 -1.58 0.00 0.00 42.46 38.18 1ai5 s ILE 77 CO 0.00 0.55 -0.04 -0.36 -1.23 0.00 0.00 174.94 173.86 1ai5 s PHE 78 N -0.32 2.98 -0.58 3.97 0.40 0.14 -2.03 117.98 122.54 1ai5 s PHE 78 Ca 0.06 -0.53 -0.23 0.00 -0.60 0.00 0.00 56.93 55.62 1ai5 s PHE 78 Cb -0.12 -2.00 0.06 0.00 0.51 0.00 0.00 43.02 41.46 1ai5 s PHE 78 CO 0.02 -0.23 0.89 0.00 0.70 0.00 0.00 175.22 176.61 1ai5 s ALA 79 N 0.76 3.19 0.11 5.36 0.00 0.38 -0.93 121.76 130.62 1ai5 s ALA 79 Ca -0.02 -1.55 -0.23 0.00 0.00 0.00 0.00 51.96 50.16 1ai5 s ALA 79 Cb -0.15 -3.71 -0.07 0.00 0.00 0.00 0.00 23.12 19.19 1ai5 s ALA 79 CO 0.02 -2.46 0.70 -1.21 0.00 0.00 0.00 175.76 172.81 1ai5 s GLU 80 N 3.75 4.43 -0.50 0.00 0.41 0.18 0.42 118.70 127.39 1ai5 s GLU 80 Ca 0.25 0.98 -0.26 0.00 -0.41 0.00 0.00 54.97 55.53 1ai5 s GLU 80 Cb -0.15 -3.27 0.03 0.00 -1.78 0.00 0.00 34.13 28.95 1ai5 s GLU 80 CO 0.15 0.54 0.97 0.50 -0.49 0.00 0.00 175.26 176.92 1ai5 s ARG 81 N -0.91 3.49 0.76 1.61 3.52 -1.26 -1.53 118.95 124.62 1ai5 s ARG 81 Ca 0.34 0.08 -0.03 0.00 -0.13 0.00 0.00 55.73 55.99 1ai5 s ARG 81 Cb -0.21 -3.97 0.14 0.00 -1.56 0.00 0.00 34.95 29.35 1ai5 s ARG 81 CO 0.23 -1.35 1.05 -0.51 -0.81 0.00 0.00 175.30 173.91 1ai5 s LEU 82 N 3.97 2.93 -0.04 -0.88 1.43 -0.47 -2.19 118.68 123.44 1ai5 s LEU 82 Ca 0.37 -0.24 -0.01 0.00 -1.03 0.00 0.00 54.13 53.22 1ai5 s LEU 82 Cb -0.10 -2.06 0.03 0.00 0.03 0.00 0.00 46.19 44.08 1ai5 s LEU 82 CO 0.25 -2.00 0.02 -0.55 0.23 0.00 0.00 176.35 174.30 1ai5 s SER 83 N -4.76 0.80 0.32 2.29 0.15 -1.26 -4.92 113.70 106.33 1ai5 s SER 83 Ca 0.67 -0.01 0.07 0.00 0.70 0.00 0.00 55.95 57.38 1ai5 s SER 83 Cb -0.05 -0.23 0.74 0.00 -1.71 0.00 0.00 66.02 64.77 1ai5 s SER 83 CO 0.46 -0.16 1.82 0.00 1.20 0.00 0.00 173.24 176.56 1ai5 h ALA 84 N 7.76 1.72 -3.18 5.45 0.00 -1.97 -3.32 119.26 125.71 1ai5 h ALA 84 Ca -0.31 0.05 -0.65 0.00 0.00 0.00 0.00 54.91 54.00 1ai5 h ALA 84 Cb 1.13 -0.12 -0.14 0.00 0.00 0.00 0.00 17.79 18.65 1ai5 h ALA 84 CO 0.35 -0.03 -0.58 -1.21 0.00 0.00 0.00 179.25 177.78 1ai5 s GLU 85 N -5.80 3.47 -0.02 0.00 2.02 -1.26 -4.60 118.70 112.50 1ai5 s GLU 85 Ca -0.11 -0.34 -0.00 0.00 0.02 0.00 0.00 54.97 54.54 1ai5 s GLU 85 Cb 0.24 -3.02 -0.00 0.00 0.10 0.00 0.00 34.13 31.44 1ai5 s GLU 85 CO 0.80 0.53 0.02 0.36 0.02 0.00 0.00 175.26 176.99 1ai5 n LYS 86 N 2.70 -0.09 -2.52 1.61 2.85 -1.26 -5.03 118.16 116.42 1ai5 n LYS 86 Ca -0.18 0.01 -0.39 0.00 -1.05 0.00 0.00 58.31 56.71 1ai5 n LYS 86 Cb 0.53 -2.32 -0.04 0.00 -0.65 0.00 0.00 35.03 32.55 1ai5 n LYS 86 CO 0.00 0.00 0.00 -2.14 -0.05 0.00 0.00 177.40 175.21 1ai5 s PRO 87 N -3.78 4.47 0.00 -1.58 0.02 -1.25 -3.41 135.00 129.47 1ai5 s PRO 87 Ca 0.00 1.67 0.00 0.00 0.02 0.00 0.00 61.00 62.70 1ai5 s PRO 87 Cb -0.00 -2.95 0.00 0.00 0.02 0.00 0.00 34.50 31.57 1ai5 s PRO 87 CO 0.01 0.10 0.00 0.41 -0.33 0.00 0.00 177.00 177.19 1ai5 n GLY 88 N 0.89 0.85 3.40 0.52 0.00 -1.26 -5.05 105.19 104.54 1ai5 n GLY 88 Ca 0.01 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.81 1ai5 n GLY 88 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1ai5 s TYR 89 N -2.06 2.01 -0.05 1.61 1.51 -1.22 -0.90 117.35 118.25 1ai5 s TYR 89 Ca 0.00 -0.44 -0.16 0.00 -1.01 0.00 0.00 57.07 55.45 1ai5 s TYR 89 Cb 0.00 -0.92 0.03 0.00 -0.11 0.00 0.00 41.96 40.97 1ai5 s TYR 89 CO 0.00 0.51 0.38 1.52 -1.11 0.00 0.00 175.55 176.85 1ai5 s TYR 90 N -2.54 -0.31 0.02 2.71 1.13 0.13 -4.43 117.35 114.07 1ai5 s TYR 90 Ca 0.24 0.58 -0.30 0.00 -1.41 0.00 0.00 57.07 56.18 1ai5 s TYR 90 Cb -0.04 0.15 -0.05 0.00 -1.10 0.00 0.00 41.96 40.92 1ai5 s TYR 90 CO 0.10 -0.37 1.29 -1.17 -2.51 0.00 0.00 175.55 172.90 1ai5 s LEU 91 N -0.90 4.33 -0.17 -3.49 2.96 -0.93 -0.73 118.68 119.75 1ai5 s LEU 91 Ca -0.10 2.05 -0.07 0.00 -0.22 0.00 0.00 54.13 55.80 1ai5 s LEU 91 Cb -0.04 -3.57 0.08 0.00 0.50 0.00 0.00 46.19 43.16 1ai5 s LEU 91 CO 0.04 -0.60 0.37 -2.28 -1.32 0.00 0.00 176.35 172.56 1ai5 s HIS 92 N 1.74 -0.66 -1.34 5.38 5.65 -0.33 -4.32 115.29 121.41 1ai5 s HIS 92 Ca 0.61 1.33 -0.16 0.00 0.25 0.00 0.00 55.06 57.09 1ai5 s HIS 92 Cb -0.30 0.20 0.01 0.00 -1.18 0.00 0.00 32.58 31.31 1ai5 s HIS 92 CO 0.27 -0.42 0.45 0.09 -0.65 0.00 0.00 174.74 174.48 1ai5 n ASN 93 N 5.21 -2.10 -0.24 9.88 5.03 -0.10 -2.30 115.26 130.64 1ai5 n ASN 93 Ca -0.10 -1.19 -0.03 0.00 0.87 0.00 0.00 54.58 54.13 1ai5 n ASN 93 Cb 0.50 -2.21 -0.01 0.00 -1.02 0.00 0.00 39.78 37.04 1ai5 n ASN 93 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1ai5 n GLY 94 N -2.15 0.58 3.10 7.41 0.00 -1.26 -5.02 105.19 107.86 1ai5 n GLY 94 Ca -0.21 -0.28 -0.08 0.00 0.00 0.00 0.00 46.02 45.45 1ai5 n GLY 94 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ai5 s LYS 95 N -1.50 0.65 -0.61 1.61 1.02 -0.97 -5.10 119.74 114.83 1ai5 s LYS 95 Ca 0.00 -1.20 -0.19 0.00 0.02 0.00 0.00 55.97 54.60 1ai5 s LYS 95 Cb 0.00 0.07 0.10 0.00 -0.52 0.00 0.00 37.83 37.49 1ai5 s LYS 95 CO 0.00 -0.08 0.73 -1.58 -0.92 0.00 0.00 175.35 173.51 1ai5 s TRP 96 N -3.59 2.99 0.20 3.18 0.52 -1.26 -1.19 118.94 119.79 1ai5 s TRP 96 Ca 0.06 -0.97 -0.22 0.00 0.02 0.00 0.00 56.10 55.00 1ai5 s TRP 96 Cb 0.05 -4.04 -0.08 0.00 -1.15 0.00 0.00 33.47 28.26 1ai5 s TRP 96 CO -0.08 -1.32 0.74 0.08 0.02 0.00 0.00 176.95 176.39 1ai5 s VAL 97 N 2.72 4.51 0.26 4.03 1.01 0.09 -4.74 120.40 128.28 1ai5 s VAL 97 Ca 0.13 1.43 -0.21 0.00 0.00 0.00 0.00 61.98 63.33 1ai5 s VAL 97 Cb -0.23 -3.96 -0.09 0.00 0.00 0.00 0.00 36.38 32.11 1ai5 s VAL 97 CO 0.06 0.33 0.78 -0.75 0.00 0.00 0.00 175.10 175.52 1ai5 s LYS 98 N -1.65 4.30 0.42 2.72 2.20 -1.26 0.21 119.74 126.68 1ai5 s LYS 98 Ca 0.40 0.96 -0.20 0.00 -0.36 0.00 0.00 55.97 56.77 1ai5 s LYS 98 Cb -0.19 -2.79 -0.11 0.00 -1.51 0.00 0.00 37.83 33.24 1ai5 s LYS 98 CO 0.23 0.33 0.92 -1.64 -0.36 0.00 0.00 175.35 174.83 1ai5 s MET 99 N -2.14 4.20 0.41 4.03 -1.94 -0.08 -4.91 119.30 118.88 1ai5 s MET 99 Ca 0.46 1.06 -0.24 0.00 -1.71 0.00 0.00 55.69 55.27 1ai5 s MET 99 Cb -0.16 -2.21 -0.08 0.00 2.01 0.00 0.00 34.83 34.38 1ai5 s MET 99 CO 0.21 -0.01 1.11 -0.51 -0.01 0.00 0.00 175.02 175.81 1ai5 s LEU 100 N -3.15 4.13 0.06 -0.03 1.43 -0.23 -4.92 118.68 115.96 1ai5 s LEU 100 Ca 0.61 2.18 -0.07 0.00 -1.03 0.00 0.00 54.13 55.82 1ai5 s LEU 100 Cb -0.09 -4.15 -0.01 0.00 0.03 0.00 0.00 46.19 41.97 1ai5 s LEU 100 CO 0.14 -0.64 0.13 -0.94 0.23 0.00 0.00 176.35 175.27 1ai5 s SER 101 N -1.40 0.19 -0.04 2.29 1.04 -1.26 -1.36 113.70 113.16 1ai5 s SER 101 Ca 0.59 -0.65 -0.13 0.00 0.48 0.00 0.00 55.95 56.23 1ai5 s SER 101 Cb -0.26 0.28 0.02 0.00 0.10 0.00 0.00 66.02 66.17 1ai5 s SER 101 CO 0.32 -0.63 0.30 0.00 0.98 0.00 0.00 173.24 174.20 1ai5 s ARG 102 N -3.41 0.58 -0.06 4.02 1.70 -0.64 -4.98 118.95 116.16 1ai5 s ARG 102 Ca 0.02 -0.07 -0.07 0.00 -0.47 0.00 0.00 55.73 55.14 1ai5 s ARG 102 Cb 0.03 0.26 -0.04 0.00 -0.57 0.00 0.00 34.95 34.63 1ai5 s ARG 102 CO -0.08 -0.15 0.20 -1.21 -1.08 0.00 0.00 175.30 172.99 1ai5 s GLU 103 N -0.99 3.52 -0.01 3.89 2.02 -1.26 -1.29 118.70 124.57 1ai5 s GLU 103 Ca -0.11 -0.10 0.05 0.00 0.02 0.00 0.00 54.97 54.83 1ai5 s GLU 103 Cb -0.05 -3.15 -0.01 0.00 0.10 0.00 0.00 34.13 31.02 1ai5 s GLU 103 CO 0.03 0.72 -0.15 -1.21 0.02 0.00 0.00 175.26 174.67 1ai5 s GLU 104 N -1.38 1.21 -0.12 1.61 0.41 0.36 -4.97 118.70 115.81 1ai5 s GLU 104 Ca 0.21 -0.53 0.02 0.00 -0.41 0.00 0.00 54.97 54.26 1ai5 s GLU 104 Cb -0.13 -1.17 -0.00 0.00 -1.78 0.00 0.00 34.13 31.05 1ai5 s GLU 104 CO 0.11 0.32 -0.18 0.99 -0.49 0.00 0.00 175.26 176.00 1ai5 s THR 105 N -0.35 2.51 -0.29 3.63 2.01 -1.26 -1.61 115.64 120.28 1ai5 s THR 105 Ca 0.06 -0.85 -0.12 0.00 0.31 0.00 0.00 61.69 61.09 1ai5 s THR 105 Cb -0.06 -2.02 -0.04 0.00 0.01 0.00 0.00 72.50 70.39 1ai5 s THR 105 CO -0.01 0.54 0.22 -0.63 -0.69 0.00 0.00 174.62 174.05 1ai5 s ILE 106 N 0.47 5.29 0.03 1.82 -1.09 0.48 -4.95 121.20 123.26 1ai5 s ILE 106 Ca -0.13 0.14 -0.19 0.00 -2.23 0.00 0.00 60.65 58.25 1ai5 s ILE 106 Cb -0.17 -3.58 -0.06 0.00 -1.58 0.00 0.00 42.46 37.08 1ai5 s ILE 106 CO 0.05 0.20 0.54 -0.89 -1.23 0.00 0.00 174.94 173.62 1ai5 s THR 107 N 1.78 4.85 -0.16 2.92 2.01 -1.26 -1.17 115.64 124.62 1ai5 s THR 107 Ca 0.08 1.15 0.01 0.00 0.31 0.00 0.00 61.69 63.23 1ai5 s THR 107 Cb -0.16 -3.87 0.02 0.00 0.01 0.00 0.00 72.50 68.50 1ai5 s THR 107 CO 0.11 0.52 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.71 1ai5 s VAL 108 N -0.81 1.69 0.12 3.82 1.01 -1.26 -5.00 120.40 119.97 1ai5 s VAL 108 Ca 0.28 -0.72 -0.33 0.00 0.00 0.00 0.00 61.98 61.22 1ai5 s VAL 108 Cb -0.19 -1.57 -0.12 0.00 0.00 0.00 0.00 36.38 34.50 1ai5 s VAL 108 CO 0.17 0.47 1.75 1.17 0.00 0.00 0.00 175.10 178.66 1ai5 n LYS 109 N 4.73 2.53 -3.96 2.72 3.00 -1.26 -1.50 118.16 124.43 1ai5 n LYS 109 Ca -0.18 0.92 -0.30 0.00 -0.00 0.00 0.00 58.31 58.75 1ai5 n LYS 109 Cb 0.50 -2.76 0.01 0.00 0.00 0.00 0.00 35.03 32.78 1ai5 n LYS 109 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.40 177.49 1ai5 n ASN 110 N 4.80 -3.63 -2.04 3.14 5.03 -1.26 -4.96 115.26 116.34 1ai5 n ASN 110 Ca 0.18 -0.85 -0.07 0.00 0.87 0.00 0.00 54.58 54.70 1ai5 n ASN 110 Cb 0.33 -3.59 -0.01 0.00 -1.02 0.00 0.00 39.78 35.49 1ai5 n ASN 110 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1ai5 n GLY 111 N -1.64 2.54 3.84 7.41 0.00 -0.56 -5.15 105.19 111.63 1ai5 n GLY 111 Ca -0.03 -1.48 -0.35 0.00 0.00 0.00 0.00 46.02 44.16 1ai5 n GLY 111 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1ai5 s GLN 112 N -2.40 3.99 0.59 1.61 0.74 -1.26 -4.63 119.66 118.30 1ai5 s GLN 112 Ca 0.15 0.51 -0.16 0.00 0.05 0.00 0.00 55.36 55.91 1ai5 s GLN 112 Cb -0.01 -2.90 -0.04 0.00 1.10 0.00 0.00 33.01 31.17 1ai5 s GLN 112 CO 0.11 0.45 1.06 0.00 -0.55 0.00 0.00 175.29 176.36 1ai5 s ALA 113 N -1.50 2.74 -0.05 1.58 0.00 -1.26 -4.50 121.76 118.76 1ai5 s ALA 113 Ca 0.39 0.40 0.04 0.00 0.00 0.00 0.00 51.96 52.80 1ai5 s ALA 113 Cb -0.15 -3.23 -0.00 0.00 0.00 0.00 0.00 23.12 19.74 1ai5 s ALA 113 CO 0.19 -0.80 -0.18 -1.21 0.00 0.00 0.00 175.76 173.76 1ai5 s GLU 114 N -4.05 1.95 0.03 0.00 2.02 -0.31 -4.93 118.70 113.40 1ai5 s GLU 114 Ca 0.64 -0.64 0.07 0.00 0.02 0.00 0.00 54.97 55.06 1ai5 s GLU 114 Cb -0.16 -1.66 -0.02 0.00 0.10 0.00 0.00 34.13 32.39 1ai5 s GLU 114 CO 0.36 0.23 -0.22 0.95 0.02 0.00 0.00 175.26 176.61 1ai5 s THR 115 N 0.10 1.73 0.26 3.63 -4.23 -1.26 0.18 115.64 116.06 1ai5 s THR 115 Ca -0.06 -1.16 -0.10 0.00 -1.18 0.00 0.00 61.69 59.19 1ai5 s THR 115 Cb -0.13 -1.49 -0.00 0.00 1.34 0.00 0.00 72.50 72.22 1ai5 s THR 115 CO 0.03 0.29 0.46 0.72 -0.54 0.00 0.00 174.62 175.58 1ai5 s PHE 116 N -0.73 0.54 -0.01 3.99 -0.71 -0.63 -4.99 117.98 115.44 1ai5 s PHE 116 Ca 0.08 -0.88 0.08 0.00 -1.04 0.00 0.00 56.93 55.17 1ai5 s PHE 116 Cb -0.09 0.10 -0.02 0.00 -1.21 0.00 0.00 43.02 41.80 1ai5 s PHE 116 CO 0.01 -1.01 -0.25 0.99 -1.34 0.00 0.00 175.22 173.63 1ai5 s THR 117 N -3.80 2.18 -0.13 -4.49 2.01 -1.26 -0.49 115.64 109.65 1ai5 s THR 117 Ca 0.25 -1.13 -0.03 0.00 0.31 0.00 0.00 61.69 61.09 1ai5 s THR 117 Cb -0.00 -1.78 -0.03 0.00 0.01 0.00 0.00 72.50 70.70 1ai5 s THR 117 CO 0.11 0.54 -0.02 -0.69 -0.69 0.00 0.00 174.62 173.87 1ai5 s VAL 118 N -0.66 4.08 0.02 3.82 1.01 -0.41 -4.96 120.40 123.30 1ai5 s VAL 118 Ca 0.11 -0.31 0.05 0.00 0.00 0.00 0.00 61.98 61.83 1ai5 s VAL 118 Cb -0.10 -2.76 -0.03 0.00 0.00 0.00 0.00 36.38 33.48 1ai5 s VAL 118 CO -0.00 0.53 -0.13 0.26 0.00 0.00 0.00 175.10 175.76 1ai5 s TRP 119 N -0.07 2.70 -0.06 5.22 0.52 -1.26 -1.62 118.94 124.38 1ai5 s TRP 119 Ca 0.03 -0.16 -0.05 0.00 0.02 0.00 0.00 56.10 55.94 1ai5 s TRP 119 Cb -0.13 -1.53 0.02 0.00 -1.15 0.00 0.00 33.47 30.68 1ai5 s TRP 119 CO 0.02 0.30 0.15 0.50 0.02 0.00 0.00 176.95 177.94 1ai5 s ARG 120 N -1.41 0.16 0.05 4.98 3.52 -0.46 -0.71 118.95 125.08 1ai5 s ARG 120 Ca 0.16 0.23 0.00 0.00 -0.13 0.00 0.00 55.73 55.99 1ai5 s ARG 120 Cb -0.11 0.06 0.00 0.00 -1.56 0.00 0.00 34.95 33.34 1ai5 s ARG 120 CO 0.06 -0.04 0.02 0.25 -0.81 0.00 0.00 175.30 174.79 1ai5 n THR 121 N 3.14 0.00 0.29 4.11 -2.24 -0.61 -1.07 114.28 117.89 1ai5 n THR 121 Ca -0.14 -0.22 0.17 0.00 -2.27 0.00 0.00 64.05 61.59 1ai5 n THR 121 Cb 0.58 -0.27 0.88 0.00 -2.10 0.00 0.00 70.33 69.43 1ai5 n THR 121 CO 0.00 0.00 0.00 1.62 -0.57 0.00 0.00 175.07 176.12 1ai5 h VAL 122 N 0.70 0.26 0.00 2.28 3.04 -2.00 -2.31 116.25 118.22 1ai5 h VAL 122 Ca -0.04 -0.34 -0.25 0.00 -1.01 0.00 0.00 66.70 65.07 1ai5 h VAL 122 Cb 0.12 1.26 -0.04 0.00 -2.01 0.00 0.00 31.29 30.62 1ai5 h VAL 122 CO 0.06 0.05 -1.35 0.45 -1.01 0.00 0.00 177.57 175.77 1ai5 h HIS 123 N 0.00 0.00 0.00 3.17 3.86 -1.94 -3.51 115.15 116.73 1ai5 h HIS 123 Ca -0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 1ai5 h HIS 123 Cb 0.25 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.72 1ai5 h HIS 123 CO 0.00 0.97 0.00 0.41 0.86 0.00 0.00 177.93 180.17 1ai5 n GLY 124 N 1.45 -0.20 3.75 2.45 0.00 -0.87 -3.85 105.19 107.91 1ai5 n GLY 124 Ca -0.09 -1.67 -0.38 0.00 0.00 0.00 0.00 46.02 43.89 1ai5 n GLY 124 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1ai5 s ASN 125 N -2.31 5.22 -0.18 1.61 -0.87 -1.26 -1.58 114.94 115.57 1ai5 s ASN 125 Ca 0.00 2.74 -0.28 0.00 -1.57 0.00 0.00 52.86 53.75 1ai5 s ASN 125 Cb 0.00 -2.63 -0.00 0.00 -0.02 0.00 0.00 41.25 38.60 1ai5 s ASN 125 CO 0.00 -1.60 0.99 -0.63 -2.57 0.00 0.00 177.10 173.29 1ai5 s ILE 126 N -1.32 4.75 -0.09 0.60 -1.09 0.11 -1.37 121.20 122.78 1ai5 s ILE 126 Ca 0.73 1.96 -0.10 0.00 -2.23 0.00 0.00 60.65 61.01 1ai5 s ILE 126 Cb -0.40 -4.28 -0.08 0.00 -1.58 0.00 0.00 42.46 36.13 1ai5 s ILE 126 CO 0.47 -0.08 0.35 -0.07 -1.23 0.00 0.00 174.94 174.37 1ai5 h LEU 127 N 8.80 -0.10 -7.65 2.97 3.38 -0.88 -3.45 115.31 118.38 1ai5 h LEU 127 Ca -0.25 -0.20 -0.06 0.00 0.09 0.00 0.00 57.88 57.46 1ai5 h LEU 127 Cb 1.10 0.03 -0.13 0.00 0.09 0.00 0.00 40.66 41.75 1ai5 h LEU 127 CO 0.91 0.47 -0.18 0.00 0.09 0.00 0.00 178.44 179.74 1ai5 s GLN 128 N -2.22 1.06 0.06 1.13 -2.07 -1.25 -5.00 119.66 111.39 1ai5 s GLN 128 Ca -0.06 -0.87 0.04 0.00 -1.82 0.00 0.00 55.36 52.66 1ai5 s GLN 128 Cb -0.00 0.43 -0.03 0.00 -1.09 0.00 0.00 33.01 32.32 1ai5 s GLN 128 CO 0.21 -0.40 -0.13 0.95 -1.32 0.00 0.00 175.29 174.61 1ai5 s THR 129 N -3.85 0.99 -0.35 3.63 -4.23 -1.26 0.10 115.64 110.66 1ai5 s THR 129 Ca 0.06 -1.25 0.03 0.00 -1.18 0.00 0.00 61.69 59.36 1ai5 s THR 129 Cb 0.03 -0.97 0.10 0.00 1.34 0.00 0.00 72.50 73.00 1ai5 s THR 129 CO -0.09 -0.25 0.07 -0.62 -0.54 0.00 0.00 174.62 173.19 1ai5 s ASP 130 N -1.68 4.79 0.23 3.99 -1.08 0.46 -4.96 116.67 118.41 1ai5 s ASP 130 Ca -0.04 -2.19 -0.06 0.00 -0.52 0.00 0.00 52.55 49.74 1ai5 s ASP 130 Cb -0.10 -1.65 0.23 0.00 -1.46 0.00 0.00 42.92 39.95 1ai5 s ASP 130 CO 0.02 -0.39 1.81 1.56 0.52 0.00 0.00 175.17 178.69 1ai5 h GLN 131 N 7.59 1.12 -0.40 4.34 4.20 -1.96 0.50 115.11 130.51 1ai5 h GLN 131 Ca -0.05 -0.19 0.08 0.00 0.06 0.00 0.00 58.65 58.54 1ai5 h GLN 131 Cb 1.02 -0.19 -0.07 0.00 0.30 0.00 0.00 27.48 28.54 1ai5 h GLN 131 CO 0.54 0.91 -0.03 1.79 -0.67 0.00 0.00 178.83 181.37 1ai5 h THR 132 N 1.10 0.67 -0.01 -0.54 1.35 -1.94 -1.72 112.91 111.81 1ai5 h THR 132 Ca 0.26 -0.02 0.00 0.00 -0.55 0.00 0.00 66.41 66.09 1ai5 h THR 132 Cb 0.20 0.59 0.00 0.00 -1.73 0.00 0.00 68.15 67.21 1ai5 h THR 132 CO -0.02 0.01 -0.17 0.35 -0.25 0.00 0.00 175.52 175.44 1ai5 n THR 133 N -5.23 0.00 -3.70 6.82 -2.24 -1.03 -4.96 114.28 103.95 1ai5 n THR 133 Ca 0.03 -0.23 -0.25 0.00 -2.27 0.00 0.00 64.05 61.33 1ai5 n THR 133 Cb 0.21 0.67 0.03 0.00 -2.10 0.00 0.00 70.33 69.14 1ai5 n THR 133 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1ai5 n GLN 134 N -0.06 -3.17 -4.87 -0.78 1.13 0.16 -4.89 117.38 104.91 1ai5 n GLN 134 Ca 0.14 0.55 -0.26 0.00 -1.94 0.00 0.00 57.00 55.49 1ai5 n GLN 134 Cb 0.39 -4.76 -0.16 0.00 0.11 0.00 0.00 30.24 25.82 1ai5 n GLN 134 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 1ai5 s THR 135 N -3.64 1.44 -0.02 5.09 2.01 -0.50 -1.36 115.64 118.66 1ai5 s THR 135 Ca 0.19 -0.76 0.06 0.00 0.31 0.00 0.00 61.69 61.49 1ai5 s THR 135 Cb -0.06 -1.21 -0.01 0.00 0.01 0.00 0.00 72.50 71.22 1ai5 s THR 135 CO 0.84 0.41 -0.18 0.00 -0.69 0.00 0.00 174.62 175.00 1ai5 s ALA 136 N -0.24 1.51 -0.21 7.40 0.00 -0.58 0.17 121.76 129.81 1ai5 s ALA 136 Ca 0.03 -0.78 -0.09 0.00 0.00 0.00 0.00 51.96 51.12 1ai5 s ALA 136 Cb -0.09 -0.39 -0.04 0.00 0.00 0.00 0.00 23.12 22.60 1ai5 s ALA 136 CO 0.00 0.37 0.11 0.71 0.00 0.00 0.00 175.76 176.95 1ai5 s TYR 137 N -0.40 3.29 -0.17 0.00 2.02 0.29 0.50 117.35 122.87 1ai5 s TYR 137 Ca 0.06 0.14 -0.06 0.00 -0.37 0.00 0.00 57.07 56.84 1ai5 s TYR 137 Cb -0.07 -2.17 -0.04 0.00 -0.40 0.00 0.00 41.96 39.28 1ai5 s TYR 137 CO -0.01 0.12 0.04 0.00 -1.57 0.00 0.00 175.55 174.14 1ai5 s ALA 138 N 0.68 3.34 -0.24 3.71 0.00 -0.11 -0.13 121.76 129.01 1ai5 s ALA 138 Ca 0.06 -0.76 -0.24 0.00 0.00 0.00 0.00 51.96 51.02 1ai5 s ALA 138 Cb -0.13 -1.83 -0.01 0.00 0.00 0.00 0.00 23.12 21.15 1ai5 s ALA 138 CO 0.01 0.22 0.79 0.21 0.00 0.00 0.00 175.76 176.99 1ai5 s LYS 139 N 0.26 4.18 -0.23 0.00 2.20 -0.47 -0.68 119.74 125.00 1ai5 s LYS 139 Ca 0.02 0.87 -0.02 0.00 -0.36 0.00 0.00 55.97 56.49 1ai5 s LYS 139 Cb -0.13 -3.64 0.01 0.00 -1.51 0.00 0.00 37.83 32.57 1ai5 s LYS 139 CO 0.01 -0.47 -0.08 0.45 -0.36 0.00 0.00 175.35 174.90 1ai5 s SER 140 N 1.34 4.12 -0.12 1.43 0.15 -0.07 -4.12 113.70 116.42 1ai5 s SER 140 Ca 0.33 -0.67 -0.08 0.00 0.70 0.00 0.00 55.95 56.24 1ai5 s SER 140 Cb -0.15 -1.66 -0.04 0.00 -1.71 0.00 0.00 66.02 62.45 1ai5 s SER 140 CO 0.08 -0.07 0.16 -0.13 1.20 0.00 0.00 173.24 174.48 1ai5 s ARG 141 N 1.37 3.55 0.51 5.44 0.52 -1.26 -1.82 118.95 127.26 1ai5 s ARG 141 Ca 0.03 -0.10 0.29 0.00 -0.52 0.00 0.00 55.73 55.43 1ai5 s ARG 141 Cb -0.15 -3.22 1.25 0.00 0.52 0.00 0.00 34.95 33.35 1ai5 s ARG 141 CO -0.05 0.72 1.95 0.00 0.02 0.00 0.00 175.30 177.94 1ai5 h ALA 142 N 5.14 1.05 -0.06 2.13 0.00 -1.37 -2.75 119.26 123.41 1ai5 h ALA 142 Ca -0.53 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.28 1ai5 h ALA 142 Cb 1.22 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.99 1ai5 h ALA 142 CO 0.60 0.14 0.00 -2.67 0.00 0.00 0.00 179.25 177.32 1ai5 n TRP 143 N -3.30 0.05 -1.68 0.00 4.27 -1.26 -4.86 117.44 110.66 1ai5 n TRP 143 Ca -0.00 -0.03 -0.45 0.00 -3.89 0.00 0.00 57.50 53.14 1ai5 n TRP 143 Cb 0.33 0.00 -0.04 0.00 -1.36 0.00 0.00 31.31 30.25 1ai5 n TRP 143 CO 0.00 0.00 0.00 -3.47 -2.29 0.00 0.00 177.69 171.93 1ai5 n ASP 144 N 0.62 3.74 0.00 -0.67 2.03 -1.04 -1.43 116.55 119.79 1ai5 n ASP 144 Ca 0.17 0.99 0.00 0.00 0.52 0.00 0.00 54.79 56.47 1ai5 n ASP 144 Cb 0.44 -1.48 0.00 0.00 -0.72 0.00 0.00 41.12 39.36 1ai5 n ASP 144 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1ai5 n GLY 145 N 4.17 0.67 0.26 0.27 0.00 -1.26 -4.90 105.19 104.41 1ai5 n GLY 145 Ca 0.19 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.22 1ai5 n GLY 145 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1ai5 n LYS 146 N -2.05 0.37 0.08 1.61 5.02 -0.52 -4.83 118.16 117.85 1ai5 n LYS 146 Ca 0.00 -1.08 -0.12 0.00 -2.02 0.00 0.00 58.31 55.09 1ai5 n LYS 146 Cb 0.00 -0.66 -0.05 0.00 -0.02 0.00 0.00 35.03 34.30 1ai5 n LYS 146 CO 0.00 0.00 0.00 0.93 -0.52 0.00 0.00 177.40 177.81 1ai5 h GLU 147 N 0.00 -0.33 -0.56 1.97 3.07 -1.91 -1.56 114.58 115.26 1ai5 h GLU 147 Ca 0.00 0.02 -0.10 0.00 -0.50 0.00 0.00 59.36 58.78 1ai5 h GLU 147 Cb 1.17 0.08 -0.02 0.00 -0.84 0.00 0.00 28.75 29.13 1ai5 h GLU 147 CO 0.00 -0.22 -0.05 0.28 -1.40 0.00 0.00 179.01 177.61 1ai5 h VAL 148 N -0.35 1.26 0.00 3.13 2.07 -1.95 -1.78 116.25 118.64 1ai5 h VAL 148 Ca 0.04 -1.19 -0.06 0.00 0.82 0.00 0.00 66.70 66.31 1ai5 h VAL 148 Cb 0.39 0.89 -0.01 0.00 -1.52 0.00 0.00 31.29 31.05 1ai5 h VAL 148 CO -0.15 0.42 -0.27 0.00 0.02 0.00 0.00 177.57 177.60 1ai5 h ALA 149 N 1.02 1.55 -0.30 1.67 0.00 -1.87 -0.98 119.26 120.34 1ai5 h ALA 149 Ca 0.15 -0.24 -0.17 0.00 0.00 0.00 0.00 54.91 54.65 1ai5 h ALA 149 Cb 0.60 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.35 1ai5 h ALA 149 CO 0.04 0.33 -0.50 0.77 0.00 0.00 0.00 179.25 179.89 1ai5 h SER 150 N 0.00 0.93 -0.41 0.00 0.02 -0.45 0.21 113.55 113.84 1ai5 h SER 150 Ca -0.00 -0.47 0.03 0.00 -0.84 0.00 0.00 61.79 60.51 1ai5 h SER 150 Cb 0.48 -0.26 -0.04 0.00 0.14 0.00 0.00 62.40 62.72 1ai5 h SER 150 CO 0.03 1.26 0.20 0.25 -1.14 0.00 0.00 176.83 177.43 1ai5 h LEU 151 N 0.66 0.28 -0.66 5.07 6.46 -0.85 -1.94 115.31 124.33 1ai5 h LEU 151 Ca 0.03 0.02 -0.13 0.00 -0.12 0.00 0.00 57.88 57.68 1ai5 h LEU 151 Cb 1.10 -0.03 -0.01 0.00 -0.73 0.00 0.00 40.66 40.99 1ai5 h LEU 151 CO 0.11 0.21 -0.34 -0.07 -0.62 0.00 0.00 178.44 177.73 1ai5 h LEU 152 N 0.40 0.70 -1.09 2.25 3.38 -1.10 -2.36 115.31 117.49 1ai5 h LEU 152 Ca 0.18 -0.29 -0.03 0.00 0.09 0.00 0.00 57.88 57.83 1ai5 h LEU 152 Cb 0.10 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.62 1ai5 h LEU 152 CO -0.13 0.98 0.25 0.00 0.09 0.00 0.00 178.44 179.63 1ai5 h ALA 153 N 1.06 1.29 0.00 1.53 0.00 -0.25 -0.69 119.26 122.19 1ai5 h ALA 153 Ca 0.06 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.76 1ai5 h ALA 153 Cb 0.85 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.39 1ai5 h ALA 153 CO 0.07 0.53 -0.25 2.35 0.00 0.00 0.00 179.25 181.95 1ai5 h TRP 154 N 0.88 0.00 0.00 0.00 2.91 -1.10 -1.97 115.95 116.68 1ai5 h TRP 154 Ca 0.21 0.00 -0.00 0.00 1.13 0.00 0.00 58.89 60.23 1ai5 h TRP 154 Cb 0.16 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 28.81 1ai5 h TRP 154 CO 0.01 0.25 -0.00 1.15 -1.03 0.00 0.00 178.44 178.82 1ai5 h THR 155 N 0.00 1.64 -0.40 2.65 2.02 -0.90 -3.37 112.91 114.55 1ai5 h THR 155 Ca -0.00 -2.05 -0.02 0.00 0.77 0.00 0.00 66.41 65.11 1ai5 h THR 155 Cb 0.61 3.00 -0.02 0.00 -1.74 0.00 0.00 68.15 70.00 1ai5 h THR 155 CO 0.03 0.52 0.15 0.45 0.37 0.00 0.00 175.52 177.05 1ai5 h HIS 156 N -0.90 0.55 -0.02 3.16 3.86 -1.10 -2.60 115.15 118.11 1ai5 h HIS 156 Ca -0.00 -0.02 0.01 0.00 -1.16 0.00 0.00 60.37 59.20 1ai5 h HIS 156 Cb 0.86 -0.17 -0.00 0.00 1.06 0.00 0.00 27.41 29.15 1ai5 h HIS 156 CO 0.23 0.44 0.02 -0.56 0.86 0.00 0.00 177.93 178.92 1ai5 h GLN 157 N 0.56 0.00 0.00 2.45 -0.00 -1.51 0.27 115.11 116.87 1ai5 h GLN 157 Ca 0.14 0.00 -0.00 0.00 -0.00 0.00 0.00 58.65 58.79 1ai5 h GLN 157 Cb 0.12 0.00 -0.00 0.00 -0.00 0.00 0.00 27.48 27.60 1ai5 h GLN 157 CO -0.01 0.00 -0.01 0.52 -0.00 0.00 0.00 178.83 179.33 1ai5 h MET 158 N 0.00 0.00 0.00 0.06 0.00 -1.62 -2.26 114.93 111.11 1ai5 h MET 158 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 59.70 59.71 1ai5 h MET 158 Cb 0.05 0.00 0.00 0.00 0.00 0.00 0.00 31.60 31.65 1ai5 h MET 158 CO -0.00 0.01 -0.42 1.63 0.00 0.00 0.00 176.91 178.13 1ai5 n LYS 159 N -3.22 0.09 -1.92 1.72 5.02 0.08 -4.78 118.16 115.15 1ai5 n LYS 159 Ca -0.03 0.03 -0.37 0.00 -2.02 0.00 0.00 58.31 55.93 1ai5 n LYS 159 Cb 0.11 -1.56 0.04 0.00 -0.02 0.00 0.00 35.03 33.59 1ai5 n LYS 159 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1ai5 s ALA 160 N -3.05 2.64 0.00 7.82 0.00 -0.85 -4.94 121.76 123.38 1ai5 s ALA 160 Ca 0.10 1.14 0.00 0.00 0.00 0.00 0.00 51.96 53.20 1ai5 s ALA 160 Cb 0.16 -3.50 0.00 0.00 0.00 0.00 0.00 23.12 19.79 1ai5 s ALA 160 CO 0.67 -1.25 0.43 1.63 0.00 0.00 0.00 175.76 177.24 1ai5 n LYS 161 N -1.36 -0.42 -3.56 0.00 5.02 -1.26 -4.66 118.16 111.92 1ai5 n LYS 161 Ca 0.12 -0.43 -0.09 0.00 -2.02 0.00 0.00 58.31 55.89 1ai5 n LYS 161 Cb 0.48 -0.93 0.02 0.00 -0.02 0.00 0.00 35.03 34.57 1ai5 n LYS 161 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 1ai5 n ASN 162 N -0.06 -1.90 0.01 4.39 2.04 -1.26 -4.83 115.26 113.64 1ai5 n ASN 162 Ca 0.00 -2.50 -0.12 0.00 -0.44 0.00 0.00 54.58 51.52 1ai5 n ASN 162 Cb 0.02 3.22 -0.07 0.00 -2.53 0.00 0.00 39.78 40.42 1ai5 n ASN 162 CO 0.00 0.00 0.00 -0.25 -0.44 0.00 0.00 177.26 176.57 1ai5 h TRP 163 N 1.90 0.07 -0.71 -2.53 2.91 -1.98 0.42 115.95 116.04 1ai5 h TRP 163 Ca -0.29 -0.00 0.01 0.00 1.13 0.00 0.00 58.89 59.74 1ai5 h TRP 163 Cb 1.11 -0.02 -0.04 0.00 -0.51 0.00 0.00 29.16 29.70 1ai5 h TRP 163 CO 0.00 0.15 0.46 1.96 -1.03 0.00 0.00 178.44 179.99 1ai5 h GLN 164 N -0.03 0.91 -0.29 2.65 4.20 -1.99 0.63 115.11 121.19 1ai5 h GLN 164 Ca 0.02 -0.05 -0.16 0.00 0.06 0.00 0.00 58.65 58.51 1ai5 h GLN 164 Cb 0.11 -0.21 -0.01 0.00 0.30 0.00 0.00 27.48 27.67 1ai5 h GLN 164 CO -0.00 0.60 -0.46 1.96 -0.67 0.00 0.00 178.83 180.27 1ai5 h GLN 165 N 0.94 0.76 -0.38 1.46 4.20 -1.79 -2.89 115.11 117.41 1ai5 h GLN 165 Ca 0.27 -0.43 -0.12 0.00 0.06 0.00 0.00 58.65 58.43 1ai5 h GLN 165 Cb -0.08 0.03 -0.01 0.00 0.30 0.00 0.00 27.48 27.72 1ai5 h GLN 165 CO -0.07 1.05 -0.25 2.35 -0.67 0.00 0.00 178.83 181.25 1ai5 h TRP 166 N 0.61 0.90 0.00 2.96 7.01 0.65 -2.76 115.95 125.31 1ai5 h TRP 166 Ca 0.04 -0.21 -0.01 0.00 2.11 0.00 0.00 58.89 60.81 1ai5 h TRP 166 Cb 1.02 -0.21 -0.00 0.00 -2.10 0.00 0.00 29.16 27.87 1ai5 h TRP 166 CO 0.05 0.95 -0.07 1.79 -2.79 0.00 0.00 178.44 178.38 1ai5 h THR 167 N 0.68 0.16 -0.16 2.65 1.35 0.37 0.15 112.91 118.11 1ai5 h THR 167 Ca 0.09 -0.73 -0.04 0.00 -0.55 0.00 0.00 66.41 65.19 1ai5 h THR 167 Cb 0.77 1.62 -0.01 0.00 -1.73 0.00 0.00 68.15 68.80 1ai5 h THR 167 CO 0.06 0.06 -0.07 1.56 -0.25 0.00 0.00 175.52 176.89 1ai5 h GLN 168 N 0.00 0.25 0.00 4.72 4.20 -1.28 0.93 115.11 123.92 1ai5 h GLN 168 Ca -0.00 -0.05 -0.23 0.00 0.06 0.00 0.00 58.65 58.43 1ai5 h GLN 168 Cb 0.62 -0.04 -0.04 0.00 0.30 0.00 0.00 27.48 28.32 1ai5 h GLN 168 CO 0.01 0.33 -1.26 1.96 -0.67 0.00 0.00 178.83 179.20 1ai5 h GLN 169 N 0.24 0.00 -0.28 1.46 1.08 -0.71 -3.25 115.11 113.64 1ai5 h GLN 169 Ca 0.05 0.00 -0.08 0.00 -1.45 0.00 0.00 58.65 57.17 1ai5 h GLN 169 Cb 0.28 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 27.69 1ai5 h GLN 169 CO 0.01 0.77 -0.17 0.00 -0.95 0.00 0.00 178.83 178.48 1ai5 h ALA 170 N 1.03 1.18 0.00 3.87 0.00 -0.45 -1.04 119.26 123.85 1ai5 h ALA 170 Ca -0.12 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1ai5 h ALA 170 Cb 1.84 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 19.50 1ai5 h ALA 170 CO 0.11 0.52 0.00 0.00 0.00 0.00 0.00 179.25 179.88 1ai5 n ALA 171 N -2.48 1.38 0.75 0.00 0.00 0.24 -1.31 120.51 119.09 1ai5 n ALA 171 Ca 0.00 0.06 0.10 0.00 0.00 0.00 0.00 53.44 53.60 1ai5 n ALA 171 Cb 0.36 -1.25 -0.12 0.00 0.00 0.00 0.00 19.45 18.44 1ai5 n ALA 171 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1ai5 n LYS 172 N -1.90 0.47 -2.64 0.00 5.02 -0.41 -4.87 118.16 113.83 1ai5 n LYS 172 Ca 0.01 -0.04 -0.43 0.00 -2.02 0.00 0.00 58.31 55.83 1ai5 n LYS 172 Cb 0.12 -1.45 -0.02 0.00 -0.02 0.00 0.00 35.03 33.66 1ai5 n LYS 172 CO 0.00 0.00 0.00 -1.14 -0.52 0.00 0.00 177.40 175.74 1ai5 s GLN 173 N -2.99 4.14 0.00 1.97 -0.44 -0.43 -4.25 119.66 117.66 1ai5 s GLN 173 Ca 0.04 1.19 0.23 0.00 -2.50 0.00 0.00 55.36 54.32 1ai5 s GLN 173 Cb 0.15 -3.70 0.07 0.00 -1.64 0.00 0.00 33.01 27.88 1ai5 s GLN 173 CO 0.82 -0.80 1.14 0.00 0.50 0.00 0.00 175.29 176.95 1ai5 n ALA 174 N 6.68 3.43 -2.25 1.58 0.00 -1.26 -2.83 120.51 125.85 1ai5 n ALA 174 Ca 0.12 -0.63 -0.27 0.00 0.00 0.00 0.00 53.44 52.65 1ai5 n ALA 174 Cb 0.47 -0.82 0.00 0.00 0.00 0.00 0.00 19.45 19.10 1ai5 n ALA 174 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1ai5 s LEU 175 N -2.44 3.60 -0.85 0.00 1.43 -1.26 -1.78 118.68 117.39 1ai5 s LEU 175 Ca 0.20 0.93 -0.24 0.00 -1.03 0.00 0.00 54.13 53.99 1ai5 s LEU 175 Cb 0.18 -3.89 0.05 0.00 0.03 0.00 0.00 46.19 42.57 1ai5 s LEU 175 CO 0.54 -0.60 1.29 0.28 0.23 0.00 0.00 176.35 178.09 1ai5 s THR 176 N -2.76 3.96 -0.01 5.49 -1.32 -1.26 -3.46 115.64 116.28 1ai5 s THR 176 Ca 0.48 -0.30 0.00 0.00 -1.21 0.00 0.00 61.69 60.66 1ai5 s THR 176 Cb -0.10 -4.93 0.01 0.00 -1.51 0.00 0.00 72.50 65.97 1ai5 s THR 176 CO 0.45 -1.81 0.01 -0.63 -2.21 0.00 0.00 174.62 170.43 1ai5 s ILE 177 N 4.98 0.04 0.19 5.08 -1.09 -1.22 -1.43 121.20 127.74 1ai5 s ILE 177 Ca 0.37 0.07 -0.28 0.00 -2.23 0.00 0.00 60.65 58.59 1ai5 s ILE 177 Cb -0.06 -0.10 -0.08 0.00 -1.58 0.00 0.00 42.46 40.64 1ai5 s ILE 177 CO 0.03 0.06 0.86 0.20 -1.23 0.00 0.00 174.94 174.86 1ai5 s ASN 178 N 0.51 7.50 -0.00 3.58 0.01 -0.14 -1.00 114.94 125.39 1ai5 s ASN 178 Ca -0.04 1.78 0.07 0.00 -0.71 0.00 0.00 52.86 53.96 1ai5 s ASN 178 Cb -0.07 -2.55 -0.02 0.00 0.41 0.00 0.00 41.25 39.02 1ai5 s ASN 178 CO -0.01 0.15 -0.23 0.26 -1.51 0.00 0.00 177.10 175.76 1ai5 s TRP 179 N -0.99 2.02 0.05 2.20 0.52 -0.15 -2.05 118.94 120.55 1ai5 s TRP 179 Ca 0.39 -0.38 0.05 0.00 0.02 0.00 0.00 56.10 56.18 1ai5 s TRP 179 Cb -0.24 -1.28 -0.02 0.00 -1.15 0.00 0.00 33.47 30.77 1ai5 s TRP 179 CO 0.29 0.00 -0.15 0.71 0.02 0.00 0.00 176.95 177.82 1ai5 s TYR 180 N -0.60 1.26 -0.02 -1.98 1.51 -0.47 -1.84 117.35 115.21 1ai5 s TYR 180 Ca 0.09 -0.39 0.06 0.00 -1.01 0.00 0.00 57.07 55.82 1ai5 s TYR 180 Cb -0.09 -0.74 -0.01 0.00 -0.11 0.00 0.00 41.96 41.01 1ai5 s TYR 180 CO -0.00 0.05 -0.19 -0.47 -1.11 0.00 0.00 175.55 173.83 1ai5 s TYR 181 N -0.99 1.75 0.06 2.71 6.14 -0.22 -2.61 117.35 124.19 1ai5 s TYR 181 Ca 0.01 -0.35 -0.05 0.00 0.64 0.00 0.00 57.07 57.31 1ai5 s TYR 181 Cb -0.09 -1.13 -0.02 0.00 0.42 0.00 0.00 41.96 41.15 1ai5 s TYR 181 CO 0.02 -0.05 0.09 0.00 0.64 0.00 0.00 175.55 176.25 1ai5 s ALA 182 N -0.40 0.04 0.27 3.97 0.00 -0.49 -1.33 121.76 123.82 1ai5 s ALA 182 Ca 0.06 -0.77 -0.02 0.00 0.00 0.00 0.00 51.96 51.23 1ai5 s ALA 182 Cb -0.08 0.34 -0.02 0.00 0.00 0.00 0.00 23.12 23.36 1ai5 s ALA 182 CO -0.00 -0.40 0.30 0.16 0.00 0.00 0.00 175.76 175.82 1ai5 s ASP 183 N -2.62 0.58 0.60 0.00 1.47 -0.80 -0.33 116.67 115.57 1ai5 s ASP 183 Ca 0.02 -1.40 0.36 0.00 1.18 0.00 0.00 52.55 52.71 1ai5 s ASP 183 Cb 0.04 0.52 1.92 0.00 -0.34 0.00 0.00 42.92 45.06 1ai5 s ASP 183 CO -0.08 -1.04 2.23 0.58 0.68 0.00 0.00 175.17 177.53 1ai5 h VAL 184 N 2.34 0.27 -0.09 2.11 2.07 -1.33 -0.60 116.25 121.02 1ai5 h VAL 184 Ca -0.30 -0.19 0.00 0.00 0.82 0.00 0.00 66.70 67.03 1ai5 h VAL 184 Cb 1.24 1.15 0.00 0.00 -1.52 0.00 0.00 31.29 32.16 1ai5 h VAL 184 CO 0.43 0.03 0.00 0.59 0.02 0.00 0.00 177.57 178.64 1ai5 n ASN 185 N -3.41 1.63 0.00 0.57 3.02 -1.26 -4.54 115.26 111.28 1ai5 n ASN 185 Ca -0.02 -1.61 0.00 0.00 -0.03 0.00 0.00 54.58 52.92 1ai5 n ASN 185 Cb 0.14 -0.05 0.00 0.00 -0.61 0.00 0.00 39.78 39.26 1ai5 n ASN 185 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1ai5 n GLY 186 N 1.16 0.71 3.82 7.41 0.00 -0.23 -4.95 105.19 113.12 1ai5 n GLY 186 Ca 0.18 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.87 1ai5 n GLY 186 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1ai5 s ASN 187 N -2.12 6.48 0.06 1.61 0.01 -1.26 -3.15 114.94 116.58 1ai5 s ASN 187 Ca 0.00 1.69 0.01 0.00 -0.71 0.00 0.00 52.86 53.84 1ai5 s ASN 187 Cb 0.00 -2.53 -0.03 0.00 0.41 0.00 0.00 41.25 39.10 1ai5 s ASN 187 CO 0.00 -0.68 -0.05 0.27 -1.51 0.00 0.00 177.10 175.12 1ai5 s ILE 188 N -2.42 0.45 0.11 0.60 -4.36 -1.26 -1.91 121.20 112.41 1ai5 s ILE 188 Ca 0.61 -1.57 -0.25 0.00 -0.26 0.00 0.00 60.65 59.19 1ai5 s ILE 188 Cb -0.12 -1.20 0.08 0.00 1.25 0.00 0.00 42.46 42.47 1ai5 s ILE 188 CO 0.27 -0.75 0.70 -0.83 0.24 0.00 0.00 174.94 174.58 1ai5 s GLY 189 N -2.46 -0.55 -0.07 6.27 0.00 -0.44 -0.54 107.32 109.53 1ai5 s GLY 189 Ca 0.02 0.61 -0.07 0.00 0.00 0.00 0.00 44.72 45.28 1ai5 s GLY 189 CO -0.04 0.20 0.19 -0.47 0.00 0.00 0.00 173.10 172.98 1ai5 s TYR 190 N -3.56 -0.19 -0.04 1.90 5.04 -0.43 -1.06 117.35 119.01 1ai5 s TYR 190 Ca 0.03 0.47 0.01 0.00 -2.44 0.00 0.00 57.07 55.14 1ai5 s TYR 190 Cb -0.01 0.06 0.02 0.00 0.35 0.00 0.00 41.96 42.39 1ai5 s TYR 190 CO -0.11 -0.12 -0.02 0.08 -1.34 0.00 0.00 175.55 174.04 1ai5 s VAL 191 N -0.03 0.35 -0.79 3.14 1.01 -0.77 -1.55 120.40 121.76 1ai5 s VAL 191 Ca -0.01 -0.02 -0.20 0.00 0.00 0.00 0.00 61.98 61.74 1ai5 s VAL 191 Cb -0.02 -0.41 0.10 0.00 0.00 0.00 0.00 36.38 36.05 1ai5 s VAL 191 CO 0.00 0.18 1.02 -2.28 0.00 0.00 0.00 175.10 174.03 1ai5 s HIS 192 N 0.92 2.92 1.01 5.22 2.46 0.03 -0.97 115.29 126.88 1ai5 s HIS 192 Ca -0.11 -1.00 -0.15 0.00 0.47 0.00 0.00 55.06 54.27 1ai5 s HIS 192 Cb -0.14 -4.27 0.19 0.00 -0.13 0.00 0.00 32.58 28.24 1ai5 s HIS 192 CO -0.01 -1.54 1.15 0.95 -2.47 0.00 0.00 174.74 172.82 1ai5 s THR 193 N 3.27 1.90 0.00 0.89 -4.23 -0.17 -4.34 115.64 112.96 1ai5 s THR 193 Ca 0.27 0.00 0.00 0.00 -1.18 0.00 0.00 61.69 60.78 1ai5 s THR 193 Cb -0.11 -2.69 0.00 0.00 1.34 0.00 0.00 72.50 71.04 1ai5 s THR 193 CO -0.00 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.69 1ai5 n GLY 194 N -1.98 2.41 3.62 3.99 0.00 -1.13 -3.43 105.19 108.67 1ai5 n GLY 194 Ca 0.09 -2.15 -0.39 0.00 0.00 0.00 0.00 46.02 43.57 1ai5 n GLY 194 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ai5 s ALA 195 N -1.90 3.56 -0.06 4.61 0.00 -0.73 -4.91 121.76 122.34 1ai5 s ALA 195 Ca 0.00 -0.80 0.04 0.00 0.00 0.00 0.00 51.96 51.21 1ai5 s ALA 195 Cb 0.00 -2.66 -0.02 0.00 0.00 0.00 0.00 23.12 20.44 1ai5 s ALA 195 CO 0.00 -0.57 -0.18 0.71 0.00 0.00 0.00 175.76 175.72 1ai5 s TYR 196 N 1.87 2.59 0.57 0.00 2.02 -1.26 -4.67 117.35 118.48 1ai5 s TYR 196 Ca 0.14 -0.37 -0.19 0.00 -0.37 0.00 0.00 57.07 56.28 1ai5 s TYR 196 Cb -0.15 -1.62 -0.04 0.00 -0.40 0.00 0.00 41.96 39.74 1ai5 s TYR 196 CO 0.09 0.02 1.18 -1.25 -1.57 0.00 0.00 175.55 174.02 1ai5 s PRO 197 N -0.47 3.12 -0.59 -1.71 0.04 -1.26 -0.67 135.00 133.46 1ai5 s PRO 197 Ca 0.06 1.74 -0.13 0.00 0.04 0.00 0.00 61.00 62.70 1ai5 s PRO 197 Cb -0.12 -1.96 0.15 0.00 0.04 0.00 0.00 34.50 32.61 1ai5 s PRO 197 CO 0.01 -1.07 0.52 0.34 0.04 0.00 0.00 177.00 176.85 1ai5 s ASP 198 N -1.68 6.15 0.38 6.66 2.15 0.60 -4.43 116.67 126.51 1ai5 s ASP 198 Ca 0.75 -2.07 -0.13 0.00 0.43 0.00 0.00 52.55 51.54 1ai5 s ASP 198 Cb -0.28 -2.15 -0.08 0.00 -0.30 0.00 0.00 42.92 40.12 1ai5 s ASP 198 CO 0.31 -0.74 0.78 -0.13 -0.17 0.00 0.00 175.17 175.22 1ai5 s ARG 199 N 1.15 3.91 0.57 4.34 0.52 -1.26 -0.58 118.95 127.61 1ai5 s ARG 199 Ca 0.08 0.62 -0.20 0.00 -0.52 0.00 0.00 55.73 55.71 1ai5 s ARG 199 Cb -0.24 -2.38 -0.04 0.00 0.52 0.00 0.00 34.95 32.81 1ai5 s ARG 199 CO -0.01 0.03 1.26 -0.65 0.02 0.00 0.00 175.30 175.96 1ai5 s GLN 200 N -3.45 3.03 0.16 3.54 -1.52 -1.26 -4.88 119.66 115.29 1ai5 s GLN 200 Ca 0.54 1.98 -0.34 0.00 -1.95 0.00 0.00 55.36 55.59 1ai5 s GLN 200 Cb -0.10 -2.06 -0.14 0.00 -0.22 0.00 0.00 33.01 30.49 1ai5 s GLN 200 CO 0.24 -1.20 1.55 0.43 -0.25 0.00 0.00 175.29 176.06 1ai5 n SER 201 N -1.36 2.97 0.00 5.90 7.64 -1.26 -2.27 113.62 125.24 1ai5 n SER 201 Ca 0.12 1.09 0.00 0.00 1.01 0.00 0.00 58.87 61.09 1ai5 n SER 201 Cb 0.48 -1.41 0.00 0.00 -1.01 0.00 0.00 64.21 62.27 1ai5 n SER 201 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1ai5 n GLY 202 N 3.25 0.83 3.62 0.23 0.00 -1.26 -5.02 105.19 106.83 1ai5 n GLY 202 Ca 0.17 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.76 1ai5 n GLY 202 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 1ai5 s HIS 203 N -2.48 1.97 -0.40 1.61 5.04 -0.96 -4.99 115.29 115.08 1ai5 s HIS 203 Ca 0.00 0.55 -0.20 0.00 -1.54 0.00 0.00 55.06 53.88 1ai5 s HIS 203 Cb 0.00 -4.06 0.01 0.00 0.04 0.00 0.00 32.58 28.57 1ai5 s HIS 203 CO 0.00 -2.98 0.59 0.34 -2.34 0.00 0.00 174.74 170.35 1ai5 s ASP 204 N 4.99 6.33 0.00 9.88 -1.08 -1.26 -4.94 116.67 130.59 1ai5 s ASP 204 Ca 0.75 -0.20 0.17 0.00 -0.52 0.00 0.00 52.55 52.75 1ai5 s ASP 204 Cb -0.24 -2.30 1.04 0.00 -1.46 0.00 0.00 42.92 39.96 1ai5 s ASP 204 CO 0.32 -0.66 1.47 -0.81 0.52 0.00 0.00 175.17 176.01 1ai5 n PRO 205 N 6.04 0.66 0.00 4.34 -0.04 -1.26 -2.95 135.00 141.79 1ai5 n PRO 205 Ca -0.03 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.55 1ai5 n PRO 205 Cb 0.48 -1.41 0.27 0.00 -0.04 0.00 0.00 33.50 32.80 1ai5 n PRO 205 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1ai5 n ARG 206 N -0.91 0.34 -4.18 0.54 1.74 -1.26 -4.82 116.66 108.11 1ai5 n ARG 206 Ca 0.13 -0.21 -0.11 0.00 -0.77 0.00 0.00 57.85 56.90 1ai5 n ARG 206 Cb 0.06 -1.50 -0.10 0.00 -1.02 0.00 0.00 32.46 29.90 1ai5 n ARG 206 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1ai5 s LEU 207 N -2.80 2.01 0.75 0.55 1.43 -1.15 -5.01 118.68 114.46 1ai5 s LEU 207 Ca 0.16 -1.16 -0.13 0.00 -1.03 0.00 0.00 54.13 51.96 1ai5 s LEU 207 Cb 0.18 0.14 0.05 0.00 0.03 0.00 0.00 46.19 46.59 1ai5 s LEU 207 CO 0.64 -0.64 1.15 -2.84 0.23 0.00 0.00 176.35 174.89 1ai5 s PRO 208 N -3.98 2.10 0.05 1.29 0.02 -1.26 -4.83 135.00 128.39 1ai5 s PRO 208 Ca 0.22 1.54 0.06 0.00 0.02 0.00 0.00 61.00 62.84 1ai5 s PRO 208 Cb 0.07 -1.85 -0.02 0.00 0.02 0.00 0.00 34.50 32.71 1ai5 s PRO 208 CO 0.01 -1.82 -0.18 0.14 -0.33 0.00 0.00 177.00 174.83 1ai5 s VAL 209 N -2.34 1.41 0.31 3.83 -7.23 -0.86 -4.97 120.40 110.55 1ai5 s VAL 209 Ca 0.69 -1.14 -0.29 0.00 -1.81 0.00 0.00 61.98 59.43 1ai5 s VAL 209 Cb -0.24 -1.25 -0.12 0.00 0.56 0.00 0.00 36.38 35.33 1ai5 s VAL 209 CO 0.48 0.08 1.49 -2.65 -0.31 0.00 0.00 175.10 174.20 1ai5 n PRO 210 N 1.79 2.49 -0.56 4.82 -0.02 -1.26 0.14 135.00 142.40 1ai5 n PRO 210 Ca -0.18 0.88 0.08 0.00 -2.02 0.00 0.00 63.50 62.26 1ai5 n PRO 210 Cb 0.54 -2.60 0.31 0.00 -0.02 0.00 0.00 33.50 31.73 1ai5 n PRO 210 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1ai5 n GLY 211 N 1.54 2.38 0.00 -1.23 0.00 0.17 -4.45 105.19 103.60 1ai5 n GLY 211 Ca 0.07 -0.73 0.11 0.00 0.00 0.00 0.00 46.02 45.47 1ai5 n GLY 211 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1ai5 n THR 212 N 0.89 0.33 0.00 2.61 -2.24 -1.26 -4.75 114.28 109.85 1ai5 n THR 212 Ca 0.22 0.08 0.00 0.00 -2.27 0.00 0.00 64.05 62.09 1ai5 n THR 212 Cb 0.82 -0.68 0.00 0.00 -2.10 0.00 0.00 70.33 68.36 1ai5 n THR 212 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ai5 n GLY 213 N 0.84 2.14 0.19 3.38 0.00 -1.26 -0.92 105.19 109.55 1ai5 n GLY 213 Ca 0.08 -0.29 0.07 0.00 0.00 0.00 0.00 46.02 45.88 1ai5 n GLY 213 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ai5 h LYS 214 N 0.00 0.00 -0.02 1.61 6.56 -1.90 -3.05 116.57 119.76 1ai5 h LYS 214 Ca 0.00 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.59 1ai5 h LYS 214 Cb 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.66 1ai5 h LYS 214 CO 0.00 0.34 -0.05 0.91 -2.06 0.00 0.00 179.45 178.59 1ai5 n TRP 215 N -3.32 0.00 -1.65 -1.35 7.02 -1.26 -4.98 117.44 111.89 1ai5 n TRP 215 Ca 0.01 0.00 -0.42 0.00 -1.02 0.00 0.00 57.50 56.07 1ai5 n TRP 215 Cb 0.57 -0.01 0.00 0.00 -2.42 0.00 0.00 31.31 29.45 1ai5 n TRP 215 CO 0.00 0.00 0.00 -0.25 -2.02 0.00 0.00 177.69 175.42 1ai5 n ASP 216 N 0.68 1.95 -4.57 -0.99 8.00 -1.16 -4.74 116.55 115.71 1ai5 n ASP 216 Ca 0.16 1.12 -0.33 0.00 0.71 0.00 0.00 54.79 56.45 1ai5 n ASP 216 Cb 0.48 -1.41 0.14 0.00 -0.02 0.00 0.00 41.12 40.30 1ai5 n ASP 216 CO 0.00 0.00 0.00 0.79 -0.39 0.00 0.00 177.20 177.60 1ai5 n TRP 217 N -0.12 0.06 0.28 1.24 8.01 -1.26 -4.60 117.44 121.05 1ai5 n TRP 217 Ca 0.08 0.34 0.11 0.00 -1.31 0.00 0.00 57.50 56.72 1ai5 n TRP 217 Cb 0.37 -1.95 -0.00 0.00 -2.01 0.00 0.00 31.31 27.72 1ai5 n TRP 217 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 177.69 178.31 1ai5 n LYS 218 N -2.88 0.49 -1.01 -0.99 5.02 0.25 -4.99 118.16 114.05 1ai5 n LYS 218 Ca 0.10 0.03 0.00 0.00 -2.02 0.00 0.00 58.31 56.43 1ai5 n LYS 218 Cb 0.52 -1.69 0.00 0.00 -0.02 0.00 0.00 35.03 33.83 1ai5 n LYS 218 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1ai5 n GLY 219 N 1.27 -0.15 3.29 0.72 0.00 -1.25 -4.98 105.19 104.09 1ai5 n GLY 219 Ca 0.00 -1.10 -0.26 0.00 0.00 0.00 0.00 46.02 44.66 1ai5 n GLY 219 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ai5 s LEU 220 N 0.00 2.21 0.70 0.99 1.43 -1.26 -0.29 118.68 122.45 1ai5 s LEU 220 Ca 0.00 -0.59 -0.12 0.00 -1.03 0.00 0.00 54.13 52.39 1ai5 s LEU 220 Cb 0.00 -1.04 0.01 0.00 0.03 0.00 0.00 46.19 45.19 1ai5 s LEU 220 CO 0.00 0.16 1.08 -0.76 0.23 0.00 0.00 176.35 177.06 1ai5 s LEU 221 N -1.42 3.20 0.77 1.79 1.43 0.16 -4.70 118.68 119.91 1ai5 s LEU 221 Ca 0.09 1.76 -0.11 0.00 -1.03 0.00 0.00 54.13 54.84 1ai5 s LEU 221 Cb -0.09 -4.52 0.05 0.00 0.03 0.00 0.00 46.19 41.66 1ai5 s LEU 221 CO 0.03 -1.60 1.09 -2.16 0.23 0.00 0.00 176.35 173.93 1ai5 s PRO 222 N -4.71 2.29 0.52 1.29 0.04 -1.26 -4.74 135.00 128.42 1ai5 s PRO 222 Ca 0.61 0.69 0.26 0.00 0.04 0.00 0.00 61.00 62.60 1ai5 s PRO 222 Cb -0.16 -1.94 1.41 0.00 0.04 0.00 0.00 34.50 33.85 1ai5 s PRO 222 CO 0.50 -1.49 2.06 0.35 0.04 0.00 0.00 177.00 178.46 1ai5 h PHE 223 N -1.00 0.00 -0.02 0.56 3.57 -1.95 -1.80 116.94 116.31 1ai5 h PHE 223 Ca -0.46 0.00 -0.02 0.00 3.53 0.00 0.00 57.97 61.02 1ai5 h PHE 223 Cb 1.26 0.00 -0.00 0.00 2.79 0.00 0.00 35.95 39.99 1ai5 h PHE 223 CO 0.50 0.13 -0.07 1.49 -2.23 0.00 0.00 178.31 178.12 1ai5 h GLU 224 N 0.00 0.02 0.00 1.11 4.81 -2.02 -1.78 114.58 116.72 1ai5 h GLU 224 Ca -0.00 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1ai5 h GLU 224 Cb 0.34 -0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.72 1ai5 h GLU 224 CO 0.02 0.10 0.00 0.52 -0.73 0.00 0.00 179.01 178.91 1ai5 h MET 225 N 0.02 0.00 -6.47 1.92 2.86 -1.69 -3.45 114.93 108.12 1ai5 h MET 225 Ca 0.01 0.00 -0.54 0.00 -2.06 0.00 0.00 59.70 57.11 1ai5 h MET 225 Cb 0.14 0.00 0.01 0.00 0.06 0.00 0.00 31.60 31.81 1ai5 h MET 225 CO 0.01 0.00 0.71 -0.80 1.06 0.00 0.00 176.91 177.89 1ai5 s ASN 226 N -4.75 6.90 0.18 1.22 -0.87 -0.67 -4.93 114.94 112.03 1ai5 s ASN 226 Ca 0.07 2.17 -0.33 0.00 -1.57 0.00 0.00 52.86 53.19 1ai5 s ASN 226 Cb 0.10 -2.58 -0.15 0.00 -0.02 0.00 0.00 41.25 38.61 1ai5 s ASN 226 CO 0.52 -0.62 1.37 -2.65 -2.57 0.00 0.00 177.10 173.15 1ai5 n PRO 227 N 4.41 1.69 -3.53 -0.60 -0.02 -1.26 -4.83 135.00 130.86 1ai5 n PRO 227 Ca 0.11 0.61 -0.16 0.00 -2.02 0.00 0.00 63.50 62.04 1ai5 n PRO 227 Cb 0.44 -2.25 -0.05 0.00 -0.02 0.00 0.00 33.50 31.62 1ai5 n PRO 227 CO 0.00 0.00 0.00 -1.59 1.98 0.00 0.00 175.50 175.89 1ai5 s LYS 228 N 0.05 1.06 -0.12 -0.52 -2.85 -1.26 -0.79 119.74 115.30 1ai5 s LYS 228 Ca 0.75 0.02 -0.15 0.00 -1.00 0.00 0.00 55.97 55.59 1ai5 s LYS 228 Cb -0.76 0.49 0.04 0.00 -2.06 0.00 0.00 37.83 35.54 1ai5 s LYS 228 CO 0.47 -0.36 0.40 0.54 0.10 0.00 0.00 175.35 176.49 1ai5 s VAL 229 N -1.83 0.01 -0.08 1.79 0.11 -0.60 -5.00 120.40 114.80 1ai5 s VAL 229 Ca -0.08 -0.08 0.02 0.00 -2.93 0.00 0.00 61.98 58.91 1ai5 s VAL 229 Cb -0.01 -0.59 0.01 0.00 -1.53 0.00 0.00 36.38 34.27 1ai5 s VAL 229 CO 0.04 -0.04 -0.13 -0.47 -3.33 0.00 0.00 175.10 171.16 1ai5 s TYR 230 N -0.10 1.65 -1.12 1.54 5.04 -1.26 -1.32 117.35 121.79 1ai5 s TYR 230 Ca -0.03 -0.68 -0.21 0.00 -2.44 0.00 0.00 57.07 53.72 1ai5 s TYR 230 Cb -0.03 -1.21 -0.00 0.00 0.35 0.00 0.00 41.96 41.07 1ai5 s TYR 230 CO 0.01 -0.35 0.78 0.09 -1.34 0.00 0.00 175.55 174.74 1ai5 n ASN 231 N 3.97 -5.33 -4.61 4.32 3.02 0.30 -4.90 115.26 112.03 1ai5 n ASN 231 Ca -0.21 -1.01 -0.40 0.00 -0.03 0.00 0.00 54.58 52.93 1ai5 n ASN 231 Cb 0.52 -3.24 0.02 0.00 -0.61 0.00 0.00 39.78 36.47 1ai5 n ASN 231 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 1ai5 n PRO 232 N -4.11 1.29 -0.19 3.52 -0.04 -1.26 -4.90 135.00 129.31 1ai5 n PRO 232 Ca -0.10 0.47 0.14 0.00 -0.04 0.00 0.00 63.50 63.97 1ai5 n PRO 232 Cb 0.59 -2.09 0.46 0.00 -0.04 0.00 0.00 33.50 32.43 1ai5 n PRO 232 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 1ai5 h GLN 233 N 1.34 0.49 0.00 0.54 4.20 -1.95 -1.92 115.11 117.81 1ai5 h GLN 233 Ca -0.46 -0.03 -0.03 0.00 0.06 0.00 0.00 58.65 58.20 1ai5 h GLN 233 Cb 1.34 -0.11 -0.00 0.00 0.30 0.00 0.00 27.48 29.01 1ai5 h GLN 233 CO 0.56 0.32 -0.12 0.66 -0.67 0.00 0.00 178.83 179.57 1ai5 h SER 234 N 0.50 0.00 0.00 1.46 4.64 -2.03 -3.47 113.55 114.66 1ai5 h SER 234 Ca 0.38 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.70 1ai5 h SER 234 Cb 0.76 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.85 1ai5 h SER 234 CO -0.14 0.12 0.00 0.61 -0.87 0.00 0.00 176.83 176.56 1ai5 n GLY 235 N -1.10 0.71 3.39 -0.77 0.00 -0.72 -4.94 105.19 101.75 1ai5 n GLY 235 Ca -0.03 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.88 1ai5 n GLY 235 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1ai5 s TYR 236 N -2.59 -0.43 -0.13 1.61 -0.85 -1.26 -1.21 117.35 112.49 1ai5 s TYR 236 Ca 0.00 0.20 0.01 0.00 -0.52 0.00 0.00 57.07 56.76 1ai5 s TYR 236 Cb 0.00 0.46 0.02 0.00 0.38 0.00 0.00 41.96 42.82 1ai5 s TYR 236 CO 0.00 -0.80 -0.15 0.42 -1.52 0.00 0.00 175.55 173.50 1ai5 s ILE 237 N -3.71 1.57 -0.00 -3.49 1.01 -0.16 -4.90 121.20 111.51 1ai5 s ILE 237 Ca 0.01 -0.65 0.04 0.00 0.00 0.00 0.00 60.65 60.05 1ai5 s ILE 237 Cb -0.00 -1.45 -0.01 0.00 0.01 0.00 0.00 42.46 41.01 1ai5 s ILE 237 CO -0.12 0.46 -0.13 0.00 0.00 0.00 0.00 174.94 175.15 1ai5 s ALA 238 N 1.24 1.04 -0.11 9.38 0.00 -1.26 0.04 121.76 132.10 1ai5 s ALA 238 Ca -0.01 -0.58 -0.14 0.00 0.00 0.00 0.00 51.96 51.24 1ai5 s ALA 238 Cb -0.14 -0.25 0.03 0.00 0.00 0.00 0.00 23.12 22.77 1ai5 s ALA 238 CO -0.06 0.25 0.37 1.21 0.00 0.00 0.00 175.76 177.52 1ai5 s ASN 239 N -0.42 -0.35 -0.29 0.00 3.84 -0.84 -5.02 114.94 111.86 1ai5 s ASN 239 Ca 0.04 0.59 0.20 0.00 0.21 0.00 0.00 52.86 53.91 1ai5 s ASN 239 Cb -0.05 0.65 0.48 0.00 -0.55 0.00 0.00 41.25 41.78 1ai5 s ASN 239 CO -0.00 -0.22 1.09 1.87 -2.79 0.00 0.00 177.10 177.04 1ai5 n TRP 240 N 2.42 0.94 -1.91 0.43 -0.00 -1.26 -2.32 117.44 115.74 1ai5 n TRP 240 Ca -0.15 -2.33 -0.10 0.00 -0.00 0.00 0.00 57.50 54.92 1ai5 n TRP 240 Cb 0.57 -0.13 -0.02 0.00 -0.00 0.00 0.00 31.31 31.73 1ai5 n TRP 240 CO 0.00 0.00 0.00 0.09 -0.00 0.00 0.00 177.69 177.78 1ai5 n ASN 241 N -0.47 -3.55 -4.53 5.87 3.02 -1.23 -4.63 115.26 109.74 1ai5 n ASN 241 Ca 0.06 0.07 -0.25 0.00 -0.03 0.00 0.00 54.58 54.43 1ai5 n ASN 241 Cb 0.81 -2.54 0.13 0.00 -0.61 0.00 0.00 39.78 37.57 1ai5 n ASN 241 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1ai5 s ASN 242 N -2.66 4.01 0.37 6.41 4.22 -1.26 -5.00 114.94 121.02 1ai5 s ASN 242 Ca 0.00 -0.27 -0.28 0.00 -2.14 0.00 0.00 52.86 50.17 1ai5 s ASN 242 Cb 0.00 0.00 -0.10 0.00 1.28 0.00 0.00 41.25 42.43 1ai5 s ASN 242 CO 0.00 -2.10 1.34 -0.55 -2.04 0.00 0.00 177.10 173.75 1ai5 s SER 243 N -4.79 6.52 0.17 3.54 0.15 -1.26 -4.92 113.70 113.09 1ai5 s SER 243 Ca 0.69 2.75 -0.13 0.00 0.70 0.00 0.00 55.95 59.95 1ai5 s SER 243 Cb -0.04 -2.65 0.06 0.00 -1.71 0.00 0.00 66.02 61.68 1ai5 s SER 243 CO 0.47 -0.72 1.75 -0.65 1.20 0.00 0.00 173.24 175.29 1ai5 h PRO 244 N 3.05 0.79 -2.55 5.44 0.11 -1.93 -3.48 132.00 133.43 1ai5 h PRO 244 Ca -0.50 -0.11 -0.01 0.00 0.11 0.00 0.00 66.00 65.50 1ai5 h PRO 244 Cb 1.24 -0.14 -0.15 0.00 0.11 0.00 0.00 31.00 32.05 1ai5 h PRO 244 CO 0.64 0.64 0.26 -1.14 -0.21 0.00 0.00 178.00 178.19 1ai5 s GLN 245 N -5.73 1.12 -0.03 1.05 0.74 -1.26 -5.01 119.66 110.53 1ai5 s GLN 245 Ca -0.13 -0.21 -0.33 0.00 0.05 0.00 0.00 55.36 54.74 1ai5 s GLN 245 Cb 0.12 0.52 -0.11 0.00 1.10 0.00 0.00 33.01 34.64 1ai5 s GLN 245 CO 0.77 -0.45 1.89 1.17 -0.55 0.00 0.00 175.29 178.12 1ai5 n LYS 246 N 0.06 2.38 -0.79 1.67 4.81 -1.26 -1.52 118.16 123.51 1ai5 n LYS 246 Ca -0.16 0.87 0.00 0.00 -0.87 0.00 0.00 58.31 58.15 1ai5 n LYS 246 Cb 0.62 -2.74 0.00 0.00 0.02 0.00 0.00 35.03 32.93 1ai5 n LYS 246 CO 0.00 0.00 0.00 -0.25 1.17 0.00 0.00 177.40 178.32 1ai5 n ASP 247 N 6.65 -1.88 -4.71 3.14 8.00 -1.26 -5.02 116.55 121.47 1ai5 n ASP 247 Ca 0.21 0.00 -0.41 0.00 0.71 0.00 0.00 54.79 55.31 1ai5 n ASP 247 Cb 0.33 -0.31 -0.04 0.00 -0.02 0.00 0.00 41.12 41.07 1ai5 n ASP 247 CO 0.00 0.00 0.00 -0.47 -0.39 0.00 0.00 177.20 176.34 1ai5 s TYR 248 N -2.32 3.62 0.19 1.24 5.04 -0.57 -5.03 117.35 119.51 1ai5 s TYR 248 Ca 0.00 1.48 -0.21 0.00 -2.44 0.00 0.00 57.07 55.90 1ai5 s TYR 248 Cb 0.00 -2.97 -0.08 0.00 0.35 0.00 0.00 41.96 39.26 1ai5 s TYR 248 CO 0.00 0.03 0.73 -1.25 -1.34 0.00 0.00 175.55 173.72 1ai5 s PRO 249 N 0.92 4.35 0.64 4.97 0.04 -1.26 -4.94 135.00 139.72 1ai5 s PRO 249 Ca 0.45 0.95 -0.02 0.00 0.04 0.00 0.00 61.00 62.42 1ai5 s PRO 249 Cb -0.19 -3.03 0.06 0.00 0.04 0.00 0.00 34.50 31.37 1ai5 s PRO 249 CO 0.23 0.47 0.90 0.00 0.04 0.00 0.00 177.00 178.64 1ai5 s ALA 250 N -1.37 3.58 0.57 8.56 0.00 -1.26 -4.13 121.76 127.71 1ai5 s ALA 250 Ca 0.39 -1.24 -0.18 0.00 0.00 0.00 0.00 51.96 50.93 1ai5 s ALA 250 Cb -0.19 -2.26 -0.14 0.00 0.00 0.00 0.00 23.12 20.53 1ai5 s ALA 250 CO 0.22 -1.08 -0.07 0.45 0.00 0.00 0.00 175.76 175.29 1ai5 n SER 251 N -2.64 -3.41 0.00 0.00 2.88 -0.35 -4.23 113.62 105.87 1ai5 n SER 251 Ca 0.09 0.62 0.15 0.00 -1.33 0.00 0.00 58.87 58.40 1ai5 n SER 251 Cb 0.60 -0.90 0.87 0.00 -0.75 0.00 0.00 64.21 64.02 1ai5 n SER 251 CO 0.00 0.00 0.00 -0.90 -1.23 0.00 0.00 175.04 172.91 1ai5 n ASP 252 N 2.18 0.00 -4.63 -3.46 5.68 -1.26 -4.89 116.55 110.16 1ai5 n ASP 252 Ca 0.08 -0.83 -0.47 0.00 -0.50 0.00 0.00 54.79 53.07 1ai5 n ASP 252 Cb 0.48 -0.04 -0.04 0.00 -1.14 0.00 0.00 41.12 40.39 1ai5 n ASP 252 CO 0.00 0.00 0.00 0.18 -1.33 0.00 0.00 177.20 176.05 1ai5 n LEU 253 N -1.04 2.48 0.13 -2.12 4.77 -1.26 -4.87 117.00 115.09 1ai5 n LEU 253 Ca 0.21 1.13 0.00 0.00 -0.03 0.00 0.00 56.01 57.33 1ai5 n LEU 253 Cb 0.12 -1.34 0.30 0.00 -2.33 0.00 0.00 43.42 40.17 1ai5 n LEU 253 CO 0.18 -0.77 0.70 2.19 -1.33 0.00 0.00 177.39 178.36 1ai5 h PHE 254 N 4.16 0.16 -0.09 -1.77 -5.15 -1.98 -0.28 116.94 111.99 1ai5 h PHE 254 Ca -0.45 -0.04 0.00 0.00 -0.20 0.00 0.00 57.97 57.29 1ai5 h PHE 254 Cb 1.30 -0.04 0.00 0.00 0.22 0.00 0.00 35.95 37.43 1ai5 h PHE 254 CO 0.57 0.49 0.00 0.00 -2.00 0.00 0.00 178.31 177.36 1ai5 n ALA 255 N -2.47 2.50 -3.69 12.09 0.00 -1.26 -4.81 120.51 122.87 1ai5 n ALA 255 Ca -0.01 -0.20 -0.30 0.00 0.00 0.00 0.00 53.44 52.93 1ai5 n ALA 255 Cb 0.43 -1.04 -0.17 0.00 0.00 0.00 0.00 19.45 18.67 1ai5 n ALA 255 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.50 177.62 1ai5 s PHE 256 N -1.87 2.16 0.02 0.00 2.19 -0.12 -4.62 117.98 115.74 1ai5 s PHE 256 Ca 0.12 -1.05 -0.01 0.00 0.33 0.00 0.00 56.93 56.31 1ai5 s PHE 256 Cb 0.06 -1.53 -0.02 0.00 -1.31 0.00 0.00 43.02 40.22 1ai5 s PHE 256 CO 0.09 -0.53 -0.01 -0.51 1.83 0.00 0.00 175.22 176.09 1ai5 s LEU 257 N 0.99 2.16 -0.34 6.12 1.43 -1.26 -4.75 118.68 123.03 1ai5 s LEU 257 Ca -0.06 -0.47 0.00 0.00 -1.03 0.00 0.00 54.13 52.58 1ai5 s LEU 257 Cb -0.15 0.17 0.09 0.00 0.03 0.00 0.00 46.19 46.33 1ai5 s LEU 257 CO -0.03 -0.31 0.06 0.26 0.23 0.00 0.00 176.35 176.56 1ai5 s TRP 258 N -1.49 3.52 0.00 0.29 0.51 -1.26 -5.05 118.94 115.47 1ai5 s TRP 258 Ca -0.16 -2.47 0.00 0.00 -2.12 0.00 0.00 56.10 51.36 1ai5 s TRP 258 Cb -0.09 -2.68 0.00 0.00 -0.81 0.00 0.00 33.47 29.89 1ai5 s TRP 258 CO -0.01 -0.91 0.00 0.41 -0.51 0.00 0.00 176.95 175.93 1ai5 n GLY 259 N 4.46 4.75 0.22 0.98 0.00 -1.26 -5.05 105.19 109.29 1ai5 n GLY 259 Ca -0.04 -1.84 0.09 0.00 0.00 0.00 0.00 46.02 44.23 1ai5 n GLY 259 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 1ai5 h GLY 260 N 0.00 0.00 -7.18 -0.02 0.00 -1.98 -3.38 103.07 90.51 1ai5 h GLY 260 Ca 0.00 0.00 -0.66 0.00 0.00 0.00 0.00 47.33 46.67 1ai5 h GLY 260 CO 0.00 0.00 0.03 0.00 0.00 0.00 0.00 176.54 176.57 1ai5 s ALA 261 N -3.77 3.40 -0.04 3.60 0.00 -1.26 -5.04 121.76 118.64 1ai5 s ALA 261 Ca -0.00 -1.19 -0.03 0.00 0.00 0.00 0.00 51.96 50.74 1ai5 s ALA 261 Cb 0.11 -3.18 0.02 0.00 0.00 0.00 0.00 23.12 20.07 1ai5 s ALA 261 CO 0.65 -1.58 0.10 0.34 0.00 0.00 0.00 175.76 175.27 1ai5 s ASP 262 N 1.89 -0.08 0.05 0.00 -1.08 -1.26 -4.94 116.67 111.26 1ai5 s ASP 262 Ca 0.20 0.21 0.11 0.00 -0.52 0.00 0.00 52.55 52.56 1ai5 s ASP 262 Cb -0.15 0.16 0.51 0.00 -1.46 0.00 0.00 42.92 41.97 1ai5 s ASP 262 CO 0.16 -0.09 1.36 -2.11 0.52 0.00 0.00 175.17 175.02 1ai5 n ARG 263 N 3.62 0.03 0.28 4.34 1.85 -1.26 -2.85 116.66 122.67 1ai5 n ARG 263 Ca -0.20 0.38 0.17 0.00 -1.00 0.00 0.00 57.85 57.20 1ai5 n ARG 263 Cb 0.55 -1.58 0.68 0.00 -1.05 0.00 0.00 32.46 31.07 1ai5 n ARG 263 CO 0.00 0.00 0.00 -0.24 -0.01 0.00 0.00 177.63 177.38 1ai5 h VAL 264 N 0.00 0.00 -0.38 8.89 3.04 -1.96 -2.76 116.25 123.07 1ai5 h VAL 264 Ca 0.00 -0.52 0.06 0.00 -1.01 0.00 0.00 66.70 65.23 1ai5 h VAL 264 Cb 0.17 1.52 -0.02 0.00 -2.01 0.00 0.00 31.29 30.95 1ai5 h VAL 264 CO 0.00 0.00 0.26 0.74 -1.01 0.00 0.00 177.57 177.56 1ai5 h THR 265 N 0.00 0.93 -0.44 3.17 2.02 -1.96 0.11 112.91 116.75 1ai5 h THR 265 Ca -0.00 -0.08 -0.02 0.00 0.77 0.00 0.00 66.41 67.08 1ai5 h THR 265 Cb 0.52 0.67 -0.02 0.00 -1.74 0.00 0.00 68.15 67.57 1ai5 h THR 265 CO 0.00 0.05 0.20 -0.33 0.37 0.00 0.00 175.52 175.81 1ai5 h GLU 266 N 0.25 0.61 0.14 6.66 4.39 -1.74 -0.84 114.58 124.04 1ai5 h GLU 266 Ca 0.17 -0.07 -0.19 0.00 0.34 0.00 0.00 59.36 59.61 1ai5 h GLU 266 Cb 0.36 -0.12 0.02 0.00 -0.10 0.00 0.00 28.75 28.91 1ai5 h GLU 266 CO -0.03 0.48 -0.87 0.82 -1.16 0.00 0.00 179.01 178.25 1ai5 h ILE 267 N 0.61 1.47 -0.54 3.13 2.04 -0.99 -3.29 117.51 119.94 1ai5 h ILE 267 Ca 0.15 -2.52 0.11 0.00 1.00 0.00 0.00 64.86 63.60 1ai5 h ILE 267 Cb 0.08 3.15 -0.09 0.00 -0.74 0.00 0.00 36.82 39.22 1ai5 h ILE 267 CO -0.02 0.71 -0.03 0.44 0.00 0.00 0.00 178.15 179.25 1ai5 h ASP 268 N -0.38 -0.30 -0.81 1.72 3.32 -1.06 -1.75 116.42 117.16 1ai5 h ASP 268 Ca -0.16 0.14 0.06 0.00 0.02 0.00 0.00 57.03 57.09 1ai5 h ASP 268 Cb 1.64 0.26 -0.06 0.00 0.22 0.00 0.00 39.33 41.39 1ai5 h ASP 268 CO 0.14 -0.11 0.49 0.03 -1.72 0.00 0.00 179.24 178.07 1ai5 h ARG 269 N 0.09 0.87 -0.01 3.56 3.08 -1.26 0.19 114.38 120.90 1ai5 h ARG 269 Ca 0.27 -0.05 -0.14 0.00 0.07 0.00 0.00 59.98 60.13 1ai5 h ARG 269 Cb 0.42 -0.20 -0.02 0.00 0.08 0.00 0.00 29.97 30.26 1ai5 h ARG 269 CO -0.48 0.58 -0.66 -0.07 -1.07 0.00 0.00 179.97 178.26 1ai5 h LEU 270 N 0.90 0.06 0.00 3.04 3.38 -1.42 -2.18 115.31 119.09 1ai5 h LEU 270 Ca 0.35 -0.04 -0.12 0.00 0.09 0.00 0.00 57.88 58.16 1ai5 h LEU 270 Cb 0.17 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 40.88 1ai5 h LEU 270 CO -0.17 0.71 -0.76 -0.07 0.09 0.00 0.00 178.44 178.23 1ai5 h LEU 271 N 0.04 0.00 0.00 1.67 3.38 -0.65 -3.14 115.31 116.61 1ai5 h LEU 271 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1ai5 h LEU 271 Cb 1.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.92 1ai5 h LEU 271 CO 0.09 0.53 -0.34 -0.62 0.09 0.00 0.00 178.44 178.18 1ai5 n GLU 272 N -3.13 0.25 0.05 1.13 1.02 0.60 -4.03 120.64 116.52 1ai5 n GLU 272 Ca -0.01 0.13 0.02 0.00 -0.02 0.00 0.00 57.16 57.27 1ai5 n GLU 272 Cb 0.76 -1.71 0.36 0.00 -0.02 0.00 0.00 31.44 30.83 1ai5 n GLU 272 CO 0.00 0.00 0.00 1.96 1.18 0.00 0.00 177.13 180.27 1ai5 h GLN 273 N 0.00 0.41 -6.10 3.49 4.20 -1.33 -3.42 115.11 112.35 1ai5 h GLN 273 Ca 0.00 -0.08 -0.68 0.00 0.06 0.00 0.00 58.65 57.95 1ai5 h GLN 273 Cb 0.71 -0.06 -0.31 0.00 0.30 0.00 0.00 27.48 28.12 1ai5 h GLN 273 CO 0.00 0.44 -0.88 0.15 -0.67 0.00 0.00 178.83 177.87 1ai5 s LYS 274 N -4.96 2.37 0.18 1.46 1.02 -1.26 -5.04 119.74 113.51 1ai5 s LYS 274 Ca -0.07 -0.89 -0.13 0.00 0.02 0.00 0.00 55.97 54.90 1ai5 s LYS 274 Cb 0.16 -2.08 0.15 0.00 -0.52 0.00 0.00 37.83 35.54 1ai5 s LYS 274 CO 0.74 0.41 1.76 -1.35 -0.92 0.00 0.00 175.35 176.00 1ai5 h PRO 275 N 5.93 0.39 -5.14 -1.68 0.11 -1.87 -3.43 132.00 126.32 1ai5 h PRO 275 Ca -0.35 -0.02 -0.35 0.00 0.11 0.00 0.00 66.00 65.39 1ai5 h PRO 275 Cb 1.16 -0.09 -0.17 0.00 0.11 0.00 0.00 31.00 32.01 1ai5 h PRO 275 CO 0.47 0.26 -0.74 1.03 -0.21 0.00 0.00 178.00 178.81 1ai5 s ARG 276 N -6.13 0.96 0.09 1.05 0.52 -1.26 -4.71 118.95 109.47 1ai5 s ARG 276 Ca -0.13 -1.26 0.09 0.00 -0.52 0.00 0.00 55.73 53.91 1ai5 s ARG 276 Cb 0.14 -0.68 -0.03 0.00 0.52 0.00 0.00 34.95 34.90 1ai5 s ARG 276 CO 0.73 0.11 -0.23 -0.51 0.02 0.00 0.00 175.30 175.42 1ai5 s LEU 277 N -2.63 2.27 0.62 2.53 1.02 0.01 -4.86 118.68 117.63 1ai5 s LEU 277 Ca 0.09 -0.66 0.02 0.00 0.02 0.00 0.00 54.13 53.60 1ai5 s LEU 277 Cb -0.02 -1.01 0.08 0.00 0.02 0.00 0.00 46.19 45.26 1ai5 s LEU 277 CO 0.01 0.12 0.85 0.42 0.02 0.00 0.00 176.35 177.78 1ai5 s THR 278 N -1.04 2.38 0.19 5.49 -4.23 -1.26 -0.34 115.64 116.83 1ai5 s THR 278 Ca 0.09 -0.71 -0.12 0.00 -1.18 0.00 0.00 61.69 59.76 1ai5 s THR 278 Cb -0.10 -2.67 0.10 0.00 1.34 0.00 0.00 72.50 71.17 1ai5 s THR 278 CO 0.04 0.00 1.80 0.00 -0.54 0.00 0.00 174.62 175.92 1ai5 h ALA 279 N -0.12 0.74 -0.51 3.99 0.00 -1.95 0.65 119.26 122.06 1ai5 h ALA 279 Ca -0.37 0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.51 1ai5 h ALA 279 Cb 1.28 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 18.94 1ai5 h ALA 279 CO 0.45 -0.02 0.14 -0.44 0.00 0.00 0.00 179.25 179.38 1ai5 h ASP 280 N 0.59 0.70 0.07 0.00 3.32 -1.96 0.10 116.42 119.24 1ai5 h ASP 280 Ca 0.25 -0.11 -0.22 0.00 0.02 0.00 0.00 57.03 56.97 1ai5 h ASP 280 Cb 0.13 -0.18 0.01 0.00 0.22 0.00 0.00 39.33 39.50 1ai5 h ASP 280 CO -0.15 0.68 -0.82 1.56 -1.72 0.00 0.00 179.24 178.79 1ai5 h GLN 281 N 0.74 0.61 -0.47 3.56 4.20 -1.77 -1.92 115.11 120.05 1ai5 h GLN 281 Ca 0.17 -0.53 -0.03 0.00 0.06 0.00 0.00 58.65 58.31 1ai5 h GLN 281 Cb 0.24 0.12 -0.02 0.00 0.30 0.00 0.00 27.48 28.12 1ai5 h GLN 281 CO -0.01 1.15 0.15 0.00 -0.67 0.00 0.00 178.83 179.45 1ai5 h ALA 282 N 0.69 1.38 -0.29 3.87 0.00 -0.13 -2.10 119.26 122.69 1ai5 h ALA 282 Ca -0.06 -0.16 -0.10 0.00 0.00 0.00 0.00 54.91 54.59 1ai5 h ALA 282 Cb 1.43 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 19.02 1ai5 h ALA 282 CO 0.15 0.46 -0.23 2.35 0.00 0.00 0.00 179.25 181.99 1ai5 h TRP 283 N 0.68 0.78 -0.03 0.00 2.91 -0.65 -3.11 115.95 116.53 1ai5 h TRP 283 Ca 0.16 -0.22 0.01 0.00 1.13 0.00 0.00 58.89 59.97 1ai5 h TRP 283 Cb 0.20 -0.17 -0.00 0.00 -0.51 0.00 0.00 29.16 28.68 1ai5 h TRP 283 CO 0.01 0.94 0.04 0.22 -1.03 0.00 0.00 178.44 178.61 1ai5 h ASP 284 N 0.40 0.00 -0.11 2.65 3.58 -0.66 0.69 116.42 122.97 1ai5 h ASP 284 Ca 0.05 0.00 0.03 0.00 0.42 0.00 0.00 57.03 57.53 1ai5 h ASP 284 Cb 0.78 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.82 1ai5 h ASP 284 CO 0.06 0.00 0.15 0.58 -2.88 0.00 0.00 179.24 177.15 1ai5 h VAL 285 N 0.00 0.37 -0.25 2.25 2.07 -1.41 -1.49 116.25 117.78 1ai5 h VAL 285 Ca 0.01 0.00 -0.07 0.00 0.82 0.00 0.00 66.70 67.47 1ai5 h VAL 285 Cb 0.09 0.87 -0.01 0.00 -1.52 0.00 0.00 31.29 30.73 1ai5 h VAL 285 CO -0.00 0.00 -0.10 0.40 0.02 0.00 0.00 177.57 177.89 1ai5 h ILE 286 N 0.00 1.30 -0.23 4.57 2.04 -1.03 -2.27 117.51 121.88 1ai5 h ILE 286 Ca 0.05 -1.16 -0.02 0.00 1.00 0.00 0.00 64.86 64.73 1ai5 h ILE 286 Cb 0.35 1.53 -0.01 0.00 -0.74 0.00 0.00 36.82 37.95 1ai5 h ILE 286 CO -0.00 0.36 0.05 -0.09 0.00 0.00 0.00 178.15 178.47 1ai5 h ARG 287 N 0.24 0.38 0.41 2.37 2.43 -1.43 -1.42 114.38 117.37 1ai5 h ARG 287 Ca 0.06 -0.09 -0.02 0.00 -0.81 0.00 0.00 59.98 59.12 1ai5 h ARG 287 Cb 0.59 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.10 1ai5 h ARG 287 CO 0.03 0.49 -0.20 1.96 -1.51 0.00 0.00 179.97 180.75 1ai5 h GLN 288 N 0.20 -0.53 -0.36 0.20 4.20 -1.46 -3.11 115.11 114.26 1ai5 h GLN 288 Ca 0.07 0.04 -0.03 0.00 0.06 0.00 0.00 58.65 58.79 1ai5 h GLN 288 Cb 0.29 0.12 -0.02 0.00 0.30 0.00 0.00 27.48 28.17 1ai5 h GLN 288 CO 0.00 -0.31 0.10 1.79 -0.67 0.00 0.00 178.83 179.74 1ai5 h THR 289 N -0.62 1.16 -1.00 -0.54 1.35 -1.48 -2.08 112.91 109.69 1ai5 h THR 289 Ca -0.06 -0.55 0.23 0.00 -0.55 0.00 0.00 66.41 65.48 1ai5 h THR 289 Cb 0.46 0.78 -0.12 0.00 -1.73 0.00 0.00 68.15 67.55 1ai5 h THR 289 CO 0.09 0.20 0.59 0.28 -0.25 0.00 0.00 175.52 176.44 1ai5 h SER 290 N 0.51 0.70 -0.02 5.36 0.02 -1.18 -3.10 113.55 115.84 1ai5 h SER 290 Ca 0.12 0.12 0.00 0.00 -0.84 0.00 0.00 61.79 61.20 1ai5 h SER 290 Cb 0.18 0.01 0.00 0.00 0.14 0.00 0.00 62.40 62.73 1ai5 h SER 290 CO -0.01 0.16 -0.25 0.54 -1.14 0.00 0.00 176.83 176.13 1ai5 n ARG 291 N -4.85 1.59 -2.47 3.45 1.74 -0.82 -1.07 116.66 114.22 1ai5 n ARG 291 Ca 0.26 -1.16 -0.42 0.00 -0.77 0.00 0.00 57.85 55.76 1ai5 n ARG 291 Cb 0.69 -1.36 -0.03 0.00 -1.02 0.00 0.00 32.46 30.74 1ai5 n ARG 291 CO 0.00 0.00 0.00 -1.14 -1.52 0.00 0.00 177.63 174.97 1ai5 s GLN 292 N -1.95 4.41 0.12 5.56 2.00 -0.96 -0.92 119.66 127.91 1ai5 s GLN 292 Ca 0.18 1.69 -0.31 0.00 -2.00 0.00 0.00 55.36 54.92 1ai5 s GLN 292 Cb 0.15 -3.45 -0.07 0.00 0.80 0.00 0.00 33.01 30.44 1ai5 s GLN 292 CO 0.39 -0.32 1.31 0.34 -0.50 0.00 0.00 175.29 176.52 1ai5 s ASP 293 N 1.24 6.92 0.25 6.67 -1.08 -0.19 -4.93 116.67 125.54 1ai5 s ASP 293 Ca 0.57 2.24 0.24 0.00 -0.52 0.00 0.00 52.55 55.08 1ai5 s ASP 293 Cb -0.26 -2.59 0.43 0.00 -1.46 0.00 0.00 42.92 39.03 1ai5 s ASP 293 CO 0.26 -0.57 1.49 -0.07 0.52 0.00 0.00 175.17 176.81 1ai5 h LEU 294 N 6.52 0.00 0.00 -1.34 3.38 -1.95 -3.38 115.31 118.54 1ai5 h LEU 294 Ca -0.42 -0.05 -0.00 0.00 0.09 0.00 0.00 57.88 57.49 1ai5 h LEU 294 Cb 1.21 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.96 1ai5 h LEU 294 CO 0.83 0.03 -1.87 0.59 0.09 0.00 0.00 178.44 178.10 1ai5 n ASN 295 N -2.53 0.11 0.01 -0.43 3.02 -1.26 -4.51 115.26 109.67 1ai5 n ASN 295 Ca 0.04 0.04 -0.12 0.00 -0.03 0.00 0.00 54.58 54.51 1ai5 n ASN 295 Cb 0.48 1.80 -0.05 0.00 -0.61 0.00 0.00 39.78 41.39 1ai5 n ASN 295 CO 0.00 0.00 0.00 0.25 -2.62 0.00 0.00 177.26 174.89 1ai5 h LEU 296 N 0.00 -1.20 -0.86 3.41 5.85 -1.99 -2.34 115.31 118.18 1ai5 h LEU 296 Ca -0.00 0.16 0.16 0.00 0.84 0.00 0.00 57.88 59.04 1ai5 h LEU 296 Cb 1.00 0.49 -0.10 0.00 0.37 0.00 0.00 40.66 42.43 1ai5 h LEU 296 CO 0.00 -0.41 0.43 -0.09 -0.34 0.00 0.00 178.44 178.03 1ai5 h ARG 297 N -0.47 0.56 -0.09 1.25 2.43 -1.85 -1.21 114.38 115.01 1ai5 h ARG 297 Ca 0.08 -0.03 -0.02 0.00 -0.81 0.00 0.00 59.98 59.20 1ai5 h ARG 297 Cb 0.60 -0.13 -0.00 0.00 -0.42 0.00 0.00 29.97 30.02 1ai5 h ARG 297 CO -0.37 0.37 -0.02 -0.07 -1.51 0.00 0.00 179.97 178.37 1ai5 h LEU 298 N 0.58 0.17 -1.35 3.80 3.38 -1.67 -3.37 115.31 116.84 1ai5 h LEU 298 Ca 0.48 -0.37 0.00 0.00 0.09 0.00 0.00 57.88 58.08 1ai5 h LEU 298 Cb 0.74 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 41.44 1ai5 h LEU 298 CO -0.40 0.50 0.00 0.49 0.09 0.00 0.00 178.44 179.12 1ai5 n PHE 299 N -4.79 0.02 -0.09 1.13 3.72 -1.08 -4.74 117.46 111.64 1ai5 n PHE 299 Ca -0.07 -0.06 -0.10 0.00 -0.05 0.00 0.00 57.45 57.18 1ai5 n PHE 299 Cb 0.23 -0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.74 1ai5 n PHE 299 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 176.76 177.96 1ai5 h LEU 300 N 0.70 0.38 -1.50 4.37 5.85 -1.39 -2.09 115.31 121.64 1ai5 h LEU 300 Ca 0.00 -0.16 0.17 0.00 0.84 0.00 0.00 57.88 58.73 1ai5 h LEU 300 Cb 0.20 -0.10 -0.06 0.00 0.37 0.00 0.00 40.66 41.07 1ai5 h LEU 300 CO 0.00 0.44 0.55 -0.65 -0.34 0.00 0.00 178.44 178.44 1ai5 h PRO 301 N 0.30 0.45 -0.24 5.25 0.11 -1.84 -1.08 132.00 134.96 1ai5 h PRO 301 Ca 0.09 -0.03 -0.18 0.00 0.11 0.00 0.00 66.00 66.00 1ai5 h PRO 301 Cb 0.17 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 31.18 1ai5 h PRO 301 CO -0.01 0.30 -0.57 1.15 -0.21 0.00 0.00 178.00 178.66 1ai5 h THR 302 N 0.46 1.29 -0.19 -1.15 2.02 -1.72 -1.92 112.91 111.71 1ai5 h THR 302 Ca 0.42 -1.79 -0.20 0.00 0.77 0.00 0.00 66.41 65.61 1ai5 h THR 302 Cb 0.94 1.72 0.00 0.00 -1.74 0.00 0.00 68.15 69.07 1ai5 h THR 302 CO -0.16 0.57 -0.68 -0.07 0.37 0.00 0.00 175.52 175.55 1ai5 h LEU 303 N 0.57 0.88 -0.32 2.58 3.38 -0.83 -1.93 115.31 119.64 1ai5 h LEU 303 Ca 0.01 -0.53 -0.04 0.00 0.09 0.00 0.00 57.88 57.41 1ai5 h LEU 303 Cb 1.16 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.64 1ai5 h LEU 303 CO 0.12 1.32 0.05 1.56 0.09 0.00 0.00 178.44 181.58 1ai5 h GLN 304 N 0.54 0.53 -0.27 1.13 4.20 -1.02 -2.72 115.11 117.49 1ai5 h GLN 304 Ca -0.02 -0.14 -0.14 0.00 0.06 0.00 0.00 58.65 58.41 1ai5 h GLN 304 Cb 1.29 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 29.00 1ai5 h GLN 304 CO 0.14 0.62 -0.39 0.00 -0.67 0.00 0.00 178.83 178.53 1ai5 h ALA 305 N 0.88 0.81 0.00 3.87 0.00 -1.29 -2.46 119.26 121.07 1ai5 h ALA 305 Ca 0.10 -0.44 -0.09 0.00 0.00 0.00 0.00 54.91 54.48 1ai5 h ALA 305 Cb 0.35 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1ai5 h ALA 305 CO 0.01 0.65 -0.43 0.00 0.00 0.00 0.00 179.25 179.47 1ai5 h ALA 306 N 1.04 1.24 -0.29 0.00 0.00 -1.30 -3.05 119.26 116.90 1ai5 h ALA 306 Ca 0.05 -0.39 0.00 0.00 0.00 0.00 0.00 54.91 54.56 1ai5 h ALA 306 Cb 0.91 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.63 1ai5 h ALA 306 CO 0.08 0.54 0.00 0.25 0.00 0.00 0.00 179.25 180.12 1ai5 n THR 307 N -3.96 0.48 -0.06 0.00 -2.24 -1.03 -4.57 114.28 102.89 1ai5 n THR 307 Ca -0.02 -0.74 0.07 0.00 -2.27 0.00 0.00 64.05 61.09 1ai5 n THR 307 Cb 0.47 0.96 0.43 0.00 -2.10 0.00 0.00 70.33 70.09 1ai5 n THR 307 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1ai5 h SER 308 N 3.51 0.48 -0.47 3.42 4.64 -1.33 -2.43 113.55 121.37 1ai5 h SER 308 Ca 0.00 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1ai5 h SER 308 Cb 0.83 -0.11 0.00 0.00 -0.31 0.00 0.00 62.40 62.81 1ai5 h SER 308 CO 0.00 0.32 0.00 0.61 -0.87 0.00 0.00 176.83 176.89 1ai5 n GLY 309 N -1.48 1.29 3.90 -0.77 0.00 -1.26 -4.95 105.19 101.92 1ai5 n GLY 309 Ca 0.07 -0.55 -0.28 0.00 0.00 0.00 0.00 46.02 45.26 1ai5 n GLY 309 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ai5 s LEU 310 N -1.08 3.60 0.58 0.99 1.43 -0.92 -5.08 118.68 118.20 1ai5 s LEU 310 Ca 0.34 1.01 -0.10 0.00 -1.03 0.00 0.00 54.13 54.35 1ai5 s LEU 310 Cb 0.18 -3.97 -0.04 0.00 0.03 0.00 0.00 46.19 42.39 1ai5 s LEU 310 CO 0.24 -0.60 0.96 0.42 0.23 0.00 0.00 176.35 177.60 1ai5 s THR 311 N -2.76 4.76 0.46 5.49 -4.23 -1.26 -4.99 115.64 113.11 1ai5 s THR 311 Ca 0.49 0.70 0.12 0.00 -1.18 0.00 0.00 61.69 61.82 1ai5 s THR 311 Cb -0.10 -3.87 0.25 0.00 1.34 0.00 0.00 72.50 70.12 1ai5 s THR 311 CO 0.45 -1.06 2.08 -0.61 -0.54 0.00 0.00 174.62 174.94 1ai5 h GLN 312 N -0.14 0.22 -0.03 3.99 4.15 -1.98 -0.91 115.11 120.41 1ai5 h GLN 312 Ca -0.45 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 58.95 1ai5 h GLN 312 Cb 1.19 -0.05 0.00 0.00 0.21 0.00 0.00 27.48 28.84 1ai5 h GLN 312 CO 0.62 0.18 0.00 -1.13 -1.93 0.00 0.00 178.83 176.57 1ai5 n SER 313 N -4.48 0.71 -4.66 -0.69 3.41 -1.26 -4.71 113.62 101.94 1ai5 n SER 313 Ca -0.01 -1.33 -0.43 0.00 -0.26 0.00 0.00 58.87 56.84 1ai5 n SER 313 Cb 0.11 -0.02 -0.02 0.00 -0.26 0.00 0.00 64.21 64.02 1ai5 n SER 313 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1ai5 s ASP 314 N -1.86 7.09 0.28 4.04 -1.08 -0.35 -4.92 116.67 119.87 1ai5 s ASP 314 Ca 0.39 1.36 0.02 0.00 -0.52 0.00 0.00 52.55 53.80 1ai5 s ASP 314 Cb 0.19 -2.54 0.63 0.00 -1.46 0.00 0.00 42.92 39.74 1ai5 s ASP 314 CO 0.32 -0.69 1.78 -0.65 0.52 0.00 0.00 175.17 176.45 1ai5 h PRO 315 N 7.50 0.74 -0.92 4.34 0.11 -1.87 -1.73 132.00 140.17 1ai5 h PRO 315 Ca -0.19 -0.04 0.12 0.00 0.11 0.00 0.00 66.00 66.00 1ai5 h PRO 315 Cb 1.06 -0.17 -0.07 0.00 0.11 0.00 0.00 31.00 31.93 1ai5 h PRO 315 CO 0.98 0.49 0.59 0.00 -0.21 0.00 0.00 178.00 179.85 1ai5 h ARG 316 N 0.76 0.80 -0.07 1.05 3.08 -1.91 0.20 114.38 118.29 1ai5 h ARG 316 Ca 0.52 -0.05 -0.19 0.00 0.07 0.00 0.00 59.98 60.33 1ai5 h ARG 316 Cb 0.73 -0.18 -0.00 0.00 0.08 0.00 0.00 29.97 30.60 1ai5 h ARG 316 CO -0.35 0.53 -0.77 -0.09 -1.07 0.00 0.00 179.97 178.21 1ai5 h ARG 317 N 0.82 0.43 -0.66 0.04 2.43 -1.63 -2.73 114.38 113.08 1ai5 h ARG 317 Ca 0.45 -0.37 -0.08 0.00 -0.81 0.00 0.00 59.98 59.17 1ai5 h ARG 317 Cb 0.57 0.08 -0.03 0.00 -0.42 0.00 0.00 29.97 30.18 1ai5 h ARG 317 CO -0.21 1.01 0.12 1.96 -1.51 0.00 0.00 179.97 181.34 1ai5 h GLN 318 N 0.28 1.09 -0.81 0.20 4.20 -0.65 -1.45 115.11 117.98 1ai5 h GLN 318 Ca -0.04 -0.29 0.04 0.00 0.06 0.00 0.00 58.65 58.42 1ai5 h GLN 318 Cb 1.36 -0.13 -0.05 0.00 0.30 0.00 0.00 27.48 28.96 1ai5 h GLN 318 CO 0.13 1.00 0.51 -0.07 -0.67 0.00 0.00 178.83 179.73 1ai5 h LEU 319 N 1.01 0.84 -1.21 1.46 3.38 -1.23 -1.11 115.31 118.45 1ai5 h LEU 319 Ca 0.20 -0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.11 1ai5 h LEU 319 Cb 0.43 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.99 1ai5 h LEU 319 CO 0.01 0.57 -0.31 0.58 0.09 0.00 0.00 178.44 179.38 1ai5 h VAL 320 N 0.99 0.87 0.02 1.22 2.07 -1.12 -2.81 116.25 117.49 1ai5 h VAL 320 Ca 0.33 -1.24 -0.23 0.00 0.82 0.00 0.00 66.70 66.38 1ai5 h VAL 320 Cb 0.03 1.75 -0.03 0.00 -1.52 0.00 0.00 31.29 31.52 1ai5 h VAL 320 CO -0.12 0.31 -1.09 -0.33 0.02 0.00 0.00 177.57 176.36 1ai5 h GLU 321 N 0.00 0.04 0.05 1.57 5.08 -0.18 -0.78 114.58 120.36 1ai5 h GLU 321 Ca -0.00 -0.08 0.01 0.00 -1.00 0.00 0.00 59.36 58.30 1ai5 h GLU 321 Cb 0.72 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.98 1ai5 h GLU 321 CO 0.04 1.01 -0.13 1.15 -1.00 0.00 0.00 179.01 180.08 1ai5 h THR 322 N 0.01 0.69 -0.79 1.13 2.02 -1.18 -2.24 112.91 112.55 1ai5 h THR 322 Ca -0.05 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.18 1ai5 h THR 322 Cb 1.82 0.69 -0.05 0.00 -1.74 0.00 0.00 68.15 68.87 1ai5 h THR 322 CO 0.14 0.00 0.52 -0.07 0.37 0.00 0.00 175.52 176.48 1ai5 h LEU 323 N -0.25 0.80 -1.14 2.58 3.38 -1.27 -2.26 115.31 117.16 1ai5 h LEU 323 Ca 0.03 -0.00 -0.08 0.00 0.09 0.00 0.00 57.88 57.91 1ai5 h LEU 323 Cb 0.28 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 1ai5 h LEU 323 CO -0.09 0.54 -0.30 0.74 0.09 0.00 0.00 178.44 179.41 1ai5 h THR 324 N 0.92 1.26 0.00 0.22 2.02 -0.92 -2.48 112.91 113.93 1ai5 h THR 324 Ca 0.33 -1.23 0.00 0.00 0.77 0.00 0.00 66.41 66.28 1ai5 h THR 324 Cb 0.13 1.50 0.00 0.00 -1.74 0.00 0.00 68.15 68.04 1ai5 h THR 324 CO -0.10 0.37 0.00 0.03 0.37 0.00 0.00 175.52 176.19 1ai5 h ARG 325 N 0.20 0.00 -6.59 6.66 3.08 -0.80 -3.46 114.38 113.46 1ai5 h ARG 325 Ca 0.03 0.00 -0.51 0.00 0.07 0.00 0.00 59.98 59.56 1ai5 h ARG 325 Cb 0.64 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.66 1ai5 h ARG 325 CO 0.05 0.00 0.06 -0.46 -1.07 0.00 0.00 179.97 178.54 1ai5 s TRP 326 N -3.19 3.50 -2.42 3.04 -0.00 -0.94 -4.99 118.94 113.93 1ai5 s TRP 326 Ca 0.08 1.22 0.22 0.00 -0.00 0.00 0.00 56.10 57.63 1ai5 s TRP 326 Cb 0.11 -2.52 0.54 0.00 -0.00 0.00 0.00 33.47 31.61 1ai5 s TRP 326 CO 0.55 0.23 1.45 -0.40 -0.00 0.00 0.00 176.95 178.79 1ai5 n ASP 327 N 0.17 2.69 0.00 5.86 5.68 -1.26 -4.95 116.55 124.74 1ai5 n ASP 327 Ca 0.00 -1.88 0.00 0.00 -0.50 0.00 0.00 54.79 52.41 1ai5 n ASP 327 Cb 0.52 -0.18 0.00 0.00 -1.14 0.00 0.00 41.12 40.32 1ai5 n ASP 327 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1ai5 n GLY 328 N 1.34 1.87 3.64 6.12 0.00 -1.26 -4.95 105.19 111.96 1ai5 n GLY 328 Ca 0.18 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.77 1ai5 n GLY 328 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ai5 s ILE 329 N -3.08 4.53 0.34 -0.61 -1.09 -1.26 -1.03 121.20 119.01 1ai5 s ILE 329 Ca 0.00 1.74 -0.25 0.00 -2.23 0.00 0.00 60.65 59.91 1ai5 s ILE 329 Cb 0.00 -4.40 -0.10 0.00 -1.58 0.00 0.00 42.46 36.38 1ai5 s ILE 329 CO 0.00 -0.45 0.95 0.20 -1.23 0.00 0.00 174.94 174.41 1ai5 s ASN 330 N 1.61 7.26 -0.02 3.58 0.01 -0.10 -4.98 114.94 122.31 1ai5 s ASN 330 Ca 0.45 1.82 -0.01 0.00 -0.71 0.00 0.00 52.86 54.40 1ai5 s ASN 330 Cb -0.12 -2.57 0.01 0.00 0.41 0.00 0.00 41.25 38.97 1ai5 s ASN 330 CO 0.14 -0.12 0.04 -0.76 -1.51 0.00 0.00 177.10 174.89 1ai5 s LEU 331 N -2.25 1.64 0.44 0.60 1.43 -1.26 -4.86 118.68 114.43 1ai5 s LEU 331 Ca 0.52 0.08 -0.22 0.00 -1.03 0.00 0.00 54.13 53.48 1ai5 s LEU 331 Cb -0.17 0.11 -0.09 0.00 0.03 0.00 0.00 46.19 46.07 1ai5 s LEU 331 CO 0.22 -0.04 1.04 -0.76 0.23 0.00 0.00 176.35 177.04 1ai5 s LEU 332 N 0.29 3.99 1.20 1.79 1.43 -1.26 -1.91 118.68 124.21 1ai5 s LEU 332 Ca -0.02 1.98 -0.20 0.00 -1.03 0.00 0.00 54.13 54.86 1ai5 s LEU 332 Cb -0.03 -4.37 0.29 0.00 0.03 0.00 0.00 46.19 42.11 1ai5 s LEU 332 CO -0.01 -0.64 1.16 0.20 0.23 0.00 0.00 176.35 177.30 1ai5 s ASN 333 N -1.77 0.97 0.58 2.29 0.01 0.15 -4.73 114.94 112.44 1ai5 s ASN 333 Ca 0.63 0.43 0.38 0.00 -0.71 0.00 0.00 52.86 53.58 1ai5 s ASN 333 Cb -0.19 -0.52 1.86 0.00 0.41 0.00 0.00 41.25 42.81 1ai5 s ASN 333 CO 0.24 -4.07 2.15 0.44 -1.51 0.00 0.00 177.10 174.34 1ai5 h ASP 334 N -2.55 0.00 0.80 -1.22 3.32 -1.97 -2.43 116.42 112.37 1ai5 h ASP 334 Ca -0.43 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.62 1ai5 h ASP 334 Cb 1.27 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.82 1ai5 h ASP 334 CO 0.29 0.00 0.00 -0.90 -1.72 0.00 0.00 179.24 176.91 1ai5 n ASP 335 N -3.00 0.23 -1.07 6.45 5.68 -1.26 -4.89 116.55 118.69 1ai5 n ASP 335 Ca -0.01 0.54 -0.12 0.00 -0.50 0.00 0.00 54.79 54.69 1ai5 n ASP 335 Cb 0.17 -0.60 -0.04 0.00 -1.14 0.00 0.00 41.12 39.52 1ai5 n ASP 335 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1ai5 n GLY 336 N 0.58 0.97 0.00 6.12 0.00 -0.91 -4.79 105.19 107.15 1ai5 n GLY 336 Ca 0.04 -0.43 0.00 0.00 0.00 0.00 0.00 46.02 45.64 1ai5 n GLY 336 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1ai5 n LYS 337 N -2.53 0.00 -4.28 1.61 2.85 -1.26 -4.91 118.16 109.63 1ai5 n LYS 337 Ca -0.13 0.00 -0.20 0.00 -1.05 0.00 0.00 58.31 56.93 1ai5 n LYS 337 Cb 0.46 -0.08 -0.11 0.00 -0.65 0.00 0.00 35.03 34.65 1ai5 n LYS 337 CO 0.00 0.00 0.00 0.95 -0.05 0.00 0.00 177.40 178.30 1ai5 s THR 338 N 0.00 1.57 0.29 0.58 -4.23 -1.26 -1.65 115.64 110.93 1ai5 s THR 338 Ca 0.00 -1.77 -0.18 0.00 -1.18 0.00 0.00 61.69 58.56 1ai5 s THR 338 Cb 0.00 -1.65 -0.09 0.00 1.34 0.00 0.00 72.50 72.10 1ai5 s THR 338 CO 0.00 -0.32 0.76 0.26 -0.54 0.00 0.00 174.62 174.77 1ai5 s TRP 339 N -1.95 3.50 0.33 3.99 0.51 0.77 0.32 118.94 126.41 1ai5 s TRP 339 Ca 0.11 1.35 0.01 0.00 -2.12 0.00 0.00 56.10 55.45 1ai5 s TRP 339 Cb -0.06 -2.62 0.56 0.00 -0.81 0.00 0.00 33.47 30.54 1ai5 s TRP 339 CO 0.05 0.19 1.98 1.96 -0.51 0.00 0.00 176.95 180.62 1ai5 h GLN 340 N 2.77 0.90 -6.22 4.98 4.20 -1.67 -3.38 115.11 116.69 1ai5 h GLN 340 Ca -0.48 -0.07 -0.58 0.00 0.06 0.00 0.00 58.65 57.58 1ai5 h GLN 340 Cb 1.18 -0.20 -0.23 0.00 0.30 0.00 0.00 27.48 28.53 1ai5 h GLN 340 CO 0.65 0.62 -0.84 -0.65 -0.67 0.00 0.00 178.83 177.94 1ai5 s GLN 341 N -5.73 1.26 0.00 1.46 -1.52 -1.26 -5.03 119.66 108.83 1ai5 s GLN 341 Ca -0.10 -1.10 0.18 0.00 -1.95 0.00 0.00 55.36 52.38 1ai5 s GLN 341 Cb 0.17 -1.49 0.95 0.00 -0.22 0.00 0.00 33.01 32.42 1ai5 s GLN 341 CO 0.78 0.36 1.63 -0.35 -0.25 0.00 0.00 175.29 177.45 1ai5 n PRO 342 N 1.34 1.22 -0.32 2.91 -0.04 -1.26 -4.61 135.00 134.24 1ai5 n PRO 342 Ca -0.19 -0.32 0.13 0.00 -0.04 0.00 0.00 63.50 63.08 1ai5 n PRO 342 Cb 0.53 -1.31 0.31 0.00 -0.04 0.00 0.00 33.50 32.99 1ai5 n PRO 342 CO 0.00 0.00 0.00 0.78 -0.04 0.00 0.00 175.50 176.24 1ai5 h GLY 343 N 5.33 1.61 1.16 0.55 0.00 -1.97 -1.56 103.07 108.19 1ai5 h GLY 343 Ca 0.00 -0.24 -0.20 0.00 0.00 0.00 0.00 47.33 46.89 1ai5 h GLY 343 CO 0.00 -0.19 -0.61 1.76 0.00 0.00 0.00 176.54 177.50 1ai5 h SER 344 N 0.53 0.98 -0.45 0.19 0.02 -1.98 -1.01 113.55 111.83 1ai5 h SER 344 Ca 0.56 -0.56 -0.04 0.00 -0.84 0.00 0.00 61.79 60.91 1ai5 h SER 344 Cb 0.99 -0.28 -0.02 0.00 0.14 0.00 0.00 62.40 63.22 1ai5 h SER 344 CO -0.46 1.36 0.11 0.00 -1.14 0.00 0.00 176.83 176.69 1ai5 h ALA 345 N 0.65 0.60 -0.31 3.77 0.00 -1.65 0.05 119.26 122.36 1ai5 h ALA 345 Ca -0.00 -0.20 0.04 0.00 0.00 0.00 0.00 54.91 54.75 1ai5 h ALA 345 Cb 1.23 -0.17 -0.04 0.00 0.00 0.00 0.00 17.79 18.80 1ai5 h ALA 345 CO 0.13 0.28 0.07 0.82 0.00 0.00 0.00 179.25 180.56 1ai5 h ILE 346 N 0.60 0.87 -0.28 0.00 2.04 -1.15 -1.68 117.51 117.89 1ai5 h ILE 346 Ca 0.14 -0.07 -0.07 0.00 1.00 0.00 0.00 64.86 65.87 1ai5 h ILE 346 Cb 0.33 0.66 -0.02 0.00 -0.74 0.00 0.00 36.82 37.05 1ai5 h ILE 346 CO 0.00 0.03 -0.12 -0.07 0.00 0.00 0.00 178.15 178.00 1ai5 h LEU 347 N 0.19 0.46 0.58 1.44 3.38 -1.09 0.37 115.31 120.63 1ai5 h LEU 347 Ca 0.14 -0.12 -0.03 0.00 0.09 0.00 0.00 57.88 57.97 1ai5 h LEU 347 Cb 0.15 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 40.78 1ai5 h LEU 347 CO -0.18 0.61 -0.29 -1.13 0.09 0.00 0.00 178.44 177.54 1ai5 h ASN 348 N 0.44 -0.71 -0.31 -0.43 -0.00 -0.72 0.73 115.58 114.59 1ai5 h ASN 348 Ca 0.08 0.03 -0.11 0.00 -0.00 0.00 0.00 56.30 56.31 1ai5 h ASN 348 Cb 0.48 0.19 -0.02 0.00 -0.00 0.00 0.00 38.32 38.97 1ai5 h ASN 348 CO 0.03 -0.49 -0.18 0.58 -0.00 0.00 0.00 177.43 177.37 1ai5 h VAL 349 N -0.80 1.27 -0.19 2.57 2.07 -0.98 -2.00 116.25 118.18 1ai5 h VAL 349 Ca -0.08 -1.27 -0.00 0.00 0.82 0.00 0.00 66.70 66.17 1ai5 h VAL 349 Cb 0.62 1.15 -0.01 0.00 -1.52 0.00 0.00 31.29 31.53 1ai5 h VAL 349 CO 0.12 0.43 0.11 -0.25 0.02 0.00 0.00 177.57 178.00 1ai5 h TRP 350 N 0.68 0.26 -0.56 1.57 7.01 -0.82 -1.71 115.95 122.37 1ai5 h TRP 350 Ca 0.10 -0.00 -0.09 0.00 2.11 0.00 0.00 58.89 61.01 1ai5 h TRP 350 Cb 0.68 -0.08 -0.02 0.00 -2.10 0.00 0.00 29.16 27.63 1ai5 h TRP 350 CO 0.03 0.22 -0.00 1.25 -2.79 0.00 0.00 178.44 177.15 1ai5 h LEU 351 N 0.22 0.95 -0.84 0.65 5.85 -0.81 0.94 115.31 122.27 1ai5 h LEU 351 Ca 0.07 -0.26 -0.02 0.00 0.84 0.00 0.00 57.88 58.51 1ai5 h LEU 351 Cb 0.04 -0.26 -0.04 0.00 0.37 0.00 0.00 40.66 40.77 1ai5 h LEU 351 CO -0.01 1.01 0.44 0.74 -0.34 0.00 0.00 178.44 180.28 1ai5 h THR 352 N 0.90 1.25 -0.28 1.05 2.02 -1.05 0.02 112.91 116.82 1ai5 h THR 352 Ca 0.16 -0.66 -0.10 0.00 0.77 0.00 0.00 66.41 66.59 1ai5 h THR 352 Cb 0.53 0.14 -0.01 0.00 -1.74 0.00 0.00 68.15 67.07 1ai5 h THR 352 CO 0.03 0.29 -0.22 -1.28 0.37 0.00 0.00 175.52 174.71 1ai5 h SER 353 N 1.18 0.67 -0.98 4.18 0.87 -0.89 -2.15 113.55 116.44 1ai5 h SER 353 Ca 0.29 -0.45 0.02 0.00 -1.23 0.00 0.00 61.79 60.42 1ai5 h SER 353 Cb 0.06 -0.19 -0.05 0.00 -0.44 0.00 0.00 62.40 61.78 1ai5 h SER 353 CO -0.04 0.98 0.65 0.24 -0.53 0.00 0.00 176.83 178.13 1ai5 h MET 354 N 0.37 1.26 -0.20 2.24 2.07 -0.55 -1.53 114.93 118.59 1ai5 h MET 354 Ca 0.05 -0.08 -0.20 0.00 -2.07 0.00 0.00 59.70 57.40 1ai5 h MET 354 Cb 0.77 -0.28 0.01 0.00 -1.87 0.00 0.00 31.60 30.22 1ai5 h MET 354 CO 0.06 0.83 -0.66 -0.07 1.07 0.00 0.00 176.91 178.14 1ai5 h LEU 355 N 1.30 0.93 -1.17 1.22 3.38 -0.91 -1.79 115.31 118.27 1ai5 h LEU 355 Ca 0.37 -0.59 -0.03 0.00 0.09 0.00 0.00 57.88 57.72 1ai5 h LEU 355 Cb -0.09 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.36 1ai5 h LEU 355 CO -0.10 1.36 0.22 0.50 0.09 0.00 0.00 178.44 180.51 1ai5 h LYS 356 N 0.55 0.81 0.00 1.13 3.64 -1.21 -1.58 116.57 119.91 1ai5 h LYS 356 Ca -0.02 -0.12 -0.06 0.00 -1.27 0.00 0.00 60.65 59.18 1ai5 h LYS 356 Cb 1.28 -0.14 -0.01 0.00 -0.41 0.00 0.00 32.23 32.95 1ai5 h LYS 356 CO 0.14 0.66 -0.28 0.00 -2.27 0.00 0.00 179.45 177.71 1ai5 h ARG 357 N 0.80 0.00 0.00 1.90 3.08 -1.18 -3.31 114.38 115.66 1ai5 h ARG 357 Ca 0.19 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.24 1ai5 h ARG 357 Cb 0.16 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.21 1ai5 h ARG 357 CO -0.02 0.28 0.00 0.25 -1.07 0.00 0.00 179.97 179.41 1ai5 n THR 358 N -3.32 0.00 0.06 2.04 -2.24 -0.68 -4.71 114.28 105.43 1ai5 n THR 358 Ca 0.01 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.66 1ai5 n THR 358 Cb 0.52 -0.51 -0.07 0.00 -2.10 0.00 0.00 70.33 68.16 1ai5 n THR 358 CO 0.00 0.00 0.00 0.58 -0.57 0.00 0.00 175.07 175.08 1ai5 h VAL 359 N 0.00 0.99 -0.88 2.28 2.07 -1.72 -2.84 116.25 116.16 1ai5 h VAL 359 Ca 0.00 -0.13 0.08 0.00 0.82 0.00 0.00 66.70 67.47 1ai5 h VAL 359 Cb 0.00 1.07 -0.07 0.00 -1.52 0.00 0.00 31.29 30.77 1ai5 h VAL 359 CO 0.00 0.03 0.54 0.58 0.02 0.00 0.00 177.57 178.74 1ai5 h VAL 360 N -0.12 1.00 0.00 2.57 2.07 -1.54 -2.45 116.25 117.78 1ai5 h VAL 360 Ca -0.01 -0.33 -0.07 0.00 0.82 0.00 0.00 66.70 67.12 1ai5 h VAL 360 Cb 0.10 -0.03 -0.01 0.00 -1.52 0.00 0.00 31.29 29.83 1ai5 h VAL 360 CO 0.01 0.17 -0.34 0.00 0.02 0.00 0.00 177.57 177.43 1ai5 h ALA 361 N 1.44 1.34 0.00 1.67 0.00 -1.59 -2.94 119.26 119.18 1ai5 h ALA 361 Ca 0.40 -0.31 0.00 0.00 0.00 0.00 0.00 54.91 55.00 1ai5 h ALA 361 Cb 0.26 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.99 1ai5 h ALA 361 CO -0.20 0.43 -0.11 0.00 0.00 0.00 0.00 179.25 179.37 1ai5 n ALA 362 N -2.43 2.45 -2.82 0.00 0.00 -0.93 -4.83 120.51 111.94 1ai5 n ALA 362 Ca -0.02 -0.09 -0.34 0.00 0.00 0.00 0.00 53.44 52.99 1ai5 n ALA 362 Cb 0.40 -1.41 -0.11 0.00 0.00 0.00 0.00 19.45 18.33 1ai5 n ALA 362 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1ai5 s VAL 363 N -3.07 4.25 0.50 0.00 1.01 -1.11 -5.08 120.40 116.89 1ai5 s VAL 363 Ca 0.11 -0.24 -0.23 0.00 0.00 0.00 0.00 61.98 61.62 1ai5 s VAL 363 Cb 0.15 -2.85 -0.06 0.00 0.00 0.00 0.00 36.38 33.62 1ai5 s VAL 363 CO 0.60 0.53 1.29 -2.16 0.00 0.00 0.00 175.10 175.36 1ai5 s PRO 364 N -0.09 3.46 0.36 2.72 0.04 -1.26 -4.23 135.00 136.00 1ai5 s PRO 364 Ca 0.04 2.08 -0.27 0.00 0.04 0.00 0.00 61.00 62.89 1ai5 s PRO 364 Cb -0.13 -2.37 -0.09 0.00 0.04 0.00 0.00 34.50 31.95 1ai5 s PRO 364 CO 0.02 -0.89 1.17 -1.64 0.04 0.00 0.00 177.00 175.70 1ai5 s MET 365 N -2.75 4.24 -0.23 4.56 -1.94 -1.26 -1.26 119.30 120.67 1ai5 s MET 365 Ca 0.67 1.87 0.15 0.00 -1.71 0.00 0.00 55.69 56.67 1ai5 s MET 365 Cb -0.36 -2.85 0.82 0.00 2.01 0.00 0.00 34.83 34.45 1ai5 s MET 365 CO 0.44 -0.17 1.75 -0.35 -0.01 0.00 0.00 175.02 176.67 1ai5 n PRO 366 N 0.43 4.81 0.15 2.03 -0.04 -1.26 -4.90 135.00 136.21 1ai5 n PRO 366 Ca 0.02 -3.15 0.13 0.00 -0.04 0.00 0.00 63.50 60.46 1ai5 n PRO 366 Cb 0.45 -2.24 0.39 0.00 -0.04 0.00 0.00 33.50 32.07 1ai5 n PRO 366 CO 0.00 0.00 0.00 0.74 -0.04 0.00 0.00 175.50 176.20 1ai5 h PHE 367 N 4.04 0.00 -0.32 0.54 0.04 -1.51 -3.24 116.94 116.49 1ai5 h PHE 367 Ca 0.00 0.00 0.02 0.00 2.80 0.00 0.00 57.97 60.79 1ai5 h PHE 367 Cb 1.94 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 40.07 1ai5 h PHE 367 CO 1.07 0.00 0.21 0.38 -0.60 0.00 0.00 178.31 179.37 1ai5 h ASP 368 N 0.00 0.32 0.41 2.17 2.03 -1.66 -0.99 116.42 118.69 1ai5 h ASP 368 Ca 0.00 -0.01 0.00 0.00 -0.73 0.00 0.00 57.03 56.29 1ai5 h ASP 368 Cb 0.72 -0.08 0.00 0.00 -0.83 0.00 0.00 39.33 39.14 1ai5 h ASP 368 CO 0.00 0.22 0.00 0.11 -1.03 0.00 0.00 179.24 178.54 1ai5 h LYS 369 N 0.37 0.00 0.00 4.15 6.56 -1.90 -1.77 116.57 123.98 1ai5 h LYS 369 Ca 0.12 0.00 0.00 0.00 -1.06 0.00 0.00 60.65 59.71 1ai5 h LYS 369 Cb 0.04 0.00 0.00 0.00 -0.57 0.00 0.00 32.23 31.70 1ai5 h LYS 369 CO -0.03 0.00 0.00 -1.49 -2.06 0.00 0.00 179.45 175.87 1ai5 h TRP 370 N 0.00 0.00 -0.04 -1.35 6.55 -1.40 -3.32 115.95 116.40 1ai5 h TRP 370 Ca 0.00 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.84 1ai5 h TRP 370 Cb 0.20 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.50 1ai5 h TRP 370 CO 0.00 0.00 0.00 0.66 -1.05 0.00 0.00 178.44 178.05 1ai5 n TYR 371 N -2.98 0.05 1.13 0.49 4.01 -0.67 -4.70 117.16 114.49 1ai5 n TYR 371 Ca 0.01 -0.35 0.12 0.00 -0.16 0.00 0.00 57.90 57.53 1ai5 n TYR 371 Cb 0.34 -0.03 0.31 0.00 -0.31 0.00 0.00 39.34 39.64 1ai5 n TYR 371 CO 0.00 0.00 0.00 -1.13 -0.46 0.00 0.00 176.86 175.27 1ai5 n SER 372 N -0.22 0.82 -4.79 7.72 3.41 -1.21 -4.31 113.62 115.05 1ai5 n SER 372 Ca 0.01 -0.64 -0.37 0.00 -0.26 0.00 0.00 58.87 57.62 1ai5 n SER 372 Cb 0.20 0.21 -0.06 0.00 -0.26 0.00 0.00 64.21 64.30 1ai5 n SER 372 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1ai5 s ALA 373 N -2.72 3.24 -0.23 7.33 0.00 -1.26 -4.87 121.76 123.26 1ai5 s ALA 373 Ca 0.18 0.47 0.20 0.00 0.00 0.00 0.00 51.96 52.81 1ai5 s ALA 373 Cb 0.18 -3.13 0.03 0.00 0.00 0.00 0.00 23.12 20.20 1ai5 s ALA 373 CO 0.60 0.20 1.13 0.66 0.00 0.00 0.00 175.76 178.35 1ai5 h SER 374 N 3.19 0.00 0.00 0.00 4.64 -1.91 -3.43 113.55 116.04 1ai5 h SER 374 Ca -0.47 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.85 1ai5 h SER 374 Cb 1.19 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.28 1ai5 h SER 374 CO 0.65 0.23 0.00 0.61 -0.87 0.00 0.00 176.83 177.45 1ai5 n GLY 375 N 1.23 0.81 0.26 -0.77 0.00 -1.26 -4.49 105.19 100.98 1ai5 n GLY 375 Ca -0.02 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.05 1ai5 n GLY 375 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1ai5 n TYR 376 N -1.08 0.00 -1.68 1.61 4.02 -1.26 -4.70 117.16 114.07 1ai5 n TYR 376 Ca 0.00 0.00 -0.45 0.00 -0.01 0.00 0.00 57.90 57.44 1ai5 n TYR 376 Cb 0.00 0.00 -0.04 0.00 -0.02 0.00 0.00 39.34 39.28 1ai5 n TYR 376 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 176.86 176.24 1ai5 n GLU 377 N -0.07 2.40 -3.30 -0.72 4.71 -1.26 -4.96 120.64 117.44 1ai5 n GLU 377 Ca 0.04 0.87 -0.10 0.00 -0.01 0.00 0.00 57.16 57.96 1ai5 n GLU 377 Cb 0.21 -2.69 -0.02 0.00 -1.01 0.00 0.00 31.44 27.93 1ai5 n GLU 377 CO 0.00 0.00 0.00 0.25 0.09 0.00 0.00 177.13 177.47 1ai5 n THR 378 N 4.07 0.00 -3.73 2.62 -2.24 -1.26 -4.86 114.28 108.88 1ai5 n THR 378 Ca 0.18 -1.23 0.00 0.00 -2.27 0.00 0.00 64.05 60.73 1ai5 n THR 378 Cb 0.32 0.80 0.00 0.00 -2.10 0.00 0.00 70.33 69.35 1ai5 n THR 378 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1ai5 n THR 379 N -0.42 0.00 0.16 4.28 -2.24 -1.26 -4.97 114.28 109.83 1ai5 n THR 379 Ca -0.01 0.00 0.03 0.00 -2.27 0.00 0.00 64.05 61.80 1ai5 n THR 379 Cb 0.43 0.00 0.38 0.00 -2.10 0.00 0.00 70.33 69.05 1ai5 n THR 379 CO 0.00 0.00 0.00 -0.61 -0.57 0.00 0.00 175.07 173.89 1ai5 h GLN 380 N 0.00 0.10 0.00 -0.78 4.15 -2.01 -0.82 115.11 115.75 1ai5 h GLN 380 Ca 0.00 -0.03 0.00 0.00 0.77 0.00 0.00 58.65 59.39 1ai5 h GLN 380 Cb 0.00 -0.01 0.00 0.00 0.21 0.00 0.00 27.48 27.68 1ai5 h GLN 380 CO 0.00 0.36 0.00 -0.25 -1.93 0.00 0.00 178.83 177.01 1ai5 n ASP 381 N -4.19 0.75 0.00 -0.69 8.00 -1.26 -4.68 116.55 114.47 1ai5 n ASP 381 Ca -0.02 0.62 0.00 0.00 0.71 0.00 0.00 54.79 56.10 1ai5 n ASP 381 Cb 0.34 -0.80 0.00 0.00 -0.02 0.00 0.00 41.12 40.64 1ai5 n ASP 381 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1ai5 n GLY 382 N 0.69 0.22 3.54 0.44 0.00 -0.31 -3.17 105.19 106.60 1ai5 n GLY 382 Ca 0.04 -1.92 -0.40 0.00 0.00 0.00 0.00 46.02 43.75 1ai5 n GLY 382 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1ai5 n PRO 383 N 0.28 0.87 0.00 1.61 -0.02 -1.26 -4.35 135.00 132.13 1ai5 n PRO 383 Ca 0.00 0.32 0.13 0.00 -2.02 0.00 0.00 63.50 61.93 1ai5 n PRO 383 Cb 0.00 -1.86 0.41 0.00 -0.02 0.00 0.00 33.50 32.03 1ai5 n PRO 383 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1ai5 n THR 384 N -1.12 0.00 -1.57 3.45 -2.24 -1.26 -4.85 114.28 106.69 1ai5 n THR 384 Ca 0.11 -0.07 0.00 0.00 -2.27 0.00 0.00 64.05 61.82 1ai5 n THR 384 Cb 0.43 0.20 0.00 0.00 -2.10 0.00 0.00 70.33 68.86 1ai5 n THR 384 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ai5 n GLY 385 N 1.38 3.49 3.78 3.38 0.00 -1.26 -4.18 105.19 111.77 1ai5 n GLY 385 Ca 0.11 -0.68 -0.35 0.00 0.00 0.00 0.00 46.02 45.10 1ai5 n GLY 385 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1ai5 s SER 386 N 1.87 5.66 0.17 1.61 1.04 -1.26 -4.98 113.70 117.81 1ai5 s SER 386 Ca 0.00 2.12 -0.28 0.00 0.48 0.00 0.00 55.95 58.27 1ai5 s SER 386 Cb 0.00 -2.57 -0.08 0.00 0.10 0.00 0.00 66.02 63.47 1ai5 s SER 386 CO 0.00 -1.26 0.86 -0.76 0.98 0.00 0.00 173.24 173.06 1ai5 s LEU 387 N -3.99 4.58 0.31 2.42 1.02 -1.26 -5.07 118.68 116.70 1ai5 s LEU 387 Ca 0.71 1.75 0.04 0.00 0.02 0.00 0.00 54.13 56.65 1ai5 s LEU 387 Cb -0.22 -3.44 -0.03 0.00 0.02 0.00 0.00 46.19 42.52 1ai5 s LEU 387 CO 0.29 0.13 0.30 0.21 0.02 0.00 0.00 176.35 177.30 1ai5 s ASN 388 N -0.87 1.30 -0.23 2.29 3.04 -1.26 -5.08 114.94 114.12 1ai5 s ASN 388 Ca 0.39 -1.65 -0.19 0.00 0.04 0.00 0.00 52.86 51.46 1ai5 s ASN 388 Cb -0.24 0.55 -0.03 0.00 -1.54 0.00 0.00 41.25 40.00 1ai5 s ASN 388 CO 0.28 -1.07 0.56 -0.63 -3.04 0.00 0.00 177.10 173.20 1ai5 s ILE 389 N -3.49 5.05 0.81 -5.21 1.01 -1.26 -4.81 121.20 113.31 1ai5 s ILE 389 Ca 0.38 1.01 -0.13 0.00 0.00 0.00 0.00 60.65 61.91 1ai5 s ILE 389 Cb 0.02 -3.87 0.09 0.00 0.01 0.00 0.00 42.46 38.71 1ai5 s ILE 389 CO 0.24 0.10 1.18 -0.94 0.00 0.00 0.00 174.94 175.52 1ai5 s SER 390 N 1.36 3.66 0.20 3.58 1.04 -1.26 -4.78 113.70 117.50 1ai5 s SER 390 Ca 0.24 2.27 -0.11 0.00 0.48 0.00 0.00 55.95 58.84 1ai5 s SER 390 Cb -0.16 -2.58 0.23 0.00 0.10 0.00 0.00 66.02 63.62 1ai5 s SER 390 CO 0.09 -2.62 1.75 0.58 0.98 0.00 0.00 173.24 174.02 1ai5 h VAL 391 N -1.00 0.80 -0.19 5.02 2.07 -1.88 0.93 116.25 122.00 1ai5 h VAL 391 Ca -0.46 -0.14 0.05 0.00 0.82 0.00 0.00 66.70 66.98 1ai5 h VAL 391 Cb 1.28 0.37 -0.06 0.00 -1.52 0.00 0.00 31.29 31.37 1ai5 h VAL 391 CO 0.46 0.07 -0.17 1.23 0.02 0.00 0.00 177.57 179.19 1ai5 h GLY 392 N 0.39 -0.05 1.87 2.17 0.00 -1.83 -0.08 103.07 105.54 1ai5 h GLY 392 Ca 0.28 0.20 -0.04 0.00 0.00 0.00 0.00 47.33 47.77 1ai5 h GLY 392 CO -0.28 -0.16 -0.13 0.00 0.00 0.00 0.00 176.54 175.97 1ai5 h ALA 393 N 0.92 1.59 -0.22 3.60 0.00 -1.65 0.31 119.26 123.82 1ai5 h ALA 393 Ca 0.12 -0.18 -0.20 0.00 0.00 0.00 0.00 54.91 54.64 1ai5 h ALA 393 Cb 0.35 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.08 1ai5 h ALA 393 CO -0.30 0.30 -0.67 0.87 0.00 0.00 0.00 179.25 179.46 1ai5 h LYS 394 N 0.16 0.83 -0.52 0.00 1.57 -0.22 -1.04 116.57 117.35 1ai5 h LYS 394 Ca 0.03 -0.60 -0.05 0.00 -1.87 0.00 0.00 60.65 58.17 1ai5 h LYS 394 Cb 0.33 0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.72 1ai5 h LYS 394 CO 0.02 1.22 0.13 0.82 -0.57 0.00 0.00 179.45 181.07 1ai5 h ILE 395 N 0.60 1.24 -0.26 1.86 2.04 -0.41 -3.09 117.51 119.50 1ai5 h ILE 395 Ca -0.02 -0.86 -0.04 0.00 1.00 0.00 0.00 64.86 64.95 1ai5 h ILE 395 Cb 1.28 0.80 -0.01 0.00 -0.74 0.00 0.00 36.82 38.15 1ai5 h ILE 395 CO 0.14 0.31 0.00 0.25 0.00 0.00 0.00 178.15 178.86 1ai5 h LEU 396 N 0.73 0.35 -1.01 1.44 5.85 -0.27 -2.07 115.31 120.33 1ai5 h LEU 396 Ca 0.16 -0.05 -0.09 0.00 0.84 0.00 0.00 57.88 58.74 1ai5 h LEU 396 Cb 0.33 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.26 1ai5 h LEU 396 CO 0.00 0.41 -0.30 0.22 -0.34 0.00 0.00 178.44 178.43 1ai5 h TYR 397 N 0.37 0.39 -0.27 1.25 3.20 -1.11 -0.79 116.97 120.02 1ai5 h TYR 397 Ca 0.09 -0.09 -0.05 0.00 3.14 0.00 0.00 58.73 61.81 1ai5 h TYR 397 Cb 0.24 -0.10 -0.01 0.00 1.54 0.00 0.00 36.73 38.41 1ai5 h TYR 397 CO 0.01 0.62 -0.04 0.93 -1.64 0.00 0.00 178.16 178.03 1ai5 h GLU 398 N 0.31 0.51 -0.72 1.82 4.39 -1.34 -2.60 114.58 116.95 1ai5 h GLU 398 Ca 0.04 -0.18 0.02 0.00 0.34 0.00 0.00 59.36 59.57 1ai5 h GLU 398 Cb 0.68 -0.04 -0.04 0.00 -0.10 0.00 0.00 28.75 29.26 1ai5 h GLU 398 CO 0.05 0.70 0.47 0.00 -1.16 0.00 0.00 179.01 179.07 1ai5 h ALA 399 N 0.79 0.92 0.00 3.43 0.00 -1.24 -0.69 119.26 122.47 1ai5 h ALA 399 Ca 0.07 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1ai5 h ALA 399 Cb 0.50 -0.27 0.00 0.00 0.00 0.00 0.00 17.79 18.02 1ai5 h ALA 399 CO 0.02 0.30 0.00 1.33 0.00 0.00 0.00 179.25 180.90 1ai5 n VAL 400 N -4.61 0.44 0.94 0.00 0.24 -0.34 -2.26 118.33 112.76 1ai5 n VAL 400 Ca 0.07 0.11 0.13 0.00 -2.04 0.00 0.00 64.34 62.61 1ai5 n VAL 400 Cb 0.04 -0.75 0.41 0.00 -1.47 0.00 0.00 33.84 32.07 1ai5 n VAL 400 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1ai5 n GLN 401 N -1.40 0.04 0.00 7.34 1.13 -0.27 -5.02 117.38 119.19 1ai5 n GLN 401 Ca 0.07 0.02 0.00 0.00 -1.94 0.00 0.00 57.00 55.15 1ai5 n GLN 401 Cb 0.22 -1.53 0.00 0.00 0.11 0.00 0.00 30.24 29.03 1ai5 n GLN 401 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1ai5 n GLY 402 N 1.48 2.67 0.32 1.08 0.00 -0.96 -2.25 105.19 107.53 1ai5 n GLY 402 Ca 0.06 -0.34 0.04 0.00 0.00 0.00 0.00 46.02 45.77 1ai5 n GLY 402 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1ai5 n ASP 403 N 3.88 0.93 0.07 1.61 5.68 -1.26 -2.80 116.55 124.66 1ai5 n ASP 403 Ca 0.00 -1.94 0.12 0.00 -0.50 0.00 0.00 54.79 52.47 1ai5 n ASP 403 Cb 0.00 -0.11 0.25 0.00 -1.14 0.00 0.00 41.12 40.12 1ai5 n ASP 403 CO 0.00 0.00 0.00 1.17 -1.33 0.00 0.00 177.20 177.04 1ai5 n LYS 404 N -0.02 0.27 -2.96 0.11 3.00 -0.96 -4.81 118.16 112.80 1ai5 n LYS 404 Ca 0.07 0.12 -0.40 0.00 -0.00 0.00 0.00 58.31 58.11 1ai5 n LYS 404 Cb 0.15 -1.72 -0.05 0.00 0.00 0.00 0.00 35.03 33.42 1ai5 n LYS 404 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.40 177.85 1ai5 s SER 405 N -4.27 7.31 0.00 3.14 0.15 -1.12 -4.97 113.70 113.93 1ai5 s SER 405 Ca 0.08 1.55 0.23 0.00 0.70 0.00 0.00 55.95 58.51 1ai5 s SER 405 Cb 0.13 -2.49 1.07 0.00 -1.71 0.00 0.00 66.02 63.02 1ai5 s SER 405 CO 0.68 0.08 1.75 -0.81 1.20 0.00 0.00 173.24 176.14 1ai5 n PRO 406 N 2.37 0.16 -3.24 5.44 -0.04 -1.26 -4.72 135.00 133.71 1ai5 n PRO 406 Ca -0.03 0.09 -0.41 0.00 -0.04 0.00 0.00 63.50 63.10 1ai5 n PRO 406 Cb 0.50 -1.50 -0.08 0.00 -0.04 0.00 0.00 33.50 32.38 1ai5 n PRO 406 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 1ai5 s ILE 407 N -2.79 5.01 0.17 0.52 -1.09 -1.26 -5.02 121.20 116.74 1ai5 s ILE 407 Ca 0.16 0.30 -0.34 0.00 -2.23 0.00 0.00 60.65 58.55 1ai5 s ILE 407 Cb 0.15 -3.98 -0.14 0.00 -1.58 0.00 0.00 42.46 36.91 1ai5 s ILE 407 CO 0.39 -0.24 1.48 -2.65 -1.23 0.00 0.00 174.94 172.69 1ai5 n PRO 408 N 5.75 1.92 -3.03 2.79 -0.02 -1.26 -4.86 135.00 136.28 1ai5 n PRO 408 Ca -0.05 0.69 -0.45 0.00 -2.02 0.00 0.00 63.50 61.68 1ai5 n PRO 408 Cb 0.49 -2.40 -0.02 0.00 -0.02 0.00 0.00 33.50 31.55 1ai5 n PRO 408 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1ai5 s GLN 409 N 0.47 3.76 0.24 -0.52 -1.52 -1.26 -4.85 119.66 115.98 1ai5 s GLN 409 Ca 0.77 -2.19 -0.07 0.00 -1.95 0.00 0.00 55.36 51.93 1ai5 s GLN 409 Cb -0.72 -4.84 0.22 0.00 -0.22 0.00 0.00 33.01 27.45 1ai5 s GLN 409 CO 0.43 -1.65 1.86 0.00 -0.25 0.00 0.00 175.29 175.68 1ai5 h ALA 410 N 8.10 1.18 -4.28 6.09 0.00 -2.05 -3.40 119.26 124.90 1ai5 h ALA 410 Ca 0.19 -0.13 -0.69 0.00 0.00 0.00 0.00 54.91 54.27 1ai5 h ALA 410 Cb 0.98 -0.36 -0.27 0.00 0.00 0.00 0.00 17.79 18.14 1ai5 h ALA 410 CO 1.07 0.67 -0.83 0.14 0.00 0.00 0.00 179.25 180.30 1ai5 s VAL 411 N -5.84 2.58 -0.23 0.00 -7.23 -1.26 -5.09 120.40 103.32 1ai5 s VAL 411 Ca -0.13 -0.91 -0.29 0.00 -1.81 0.00 0.00 61.98 58.85 1ai5 s VAL 411 Cb 0.17 -1.96 -0.01 0.00 0.56 0.00 0.00 36.38 35.14 1ai5 s VAL 411 CO 0.83 0.58 1.26 -0.62 -0.31 0.00 0.00 175.10 176.85 1ai5 s ASP 412 N -0.64 6.83 0.41 4.85 2.15 -1.26 -4.90 116.67 124.11 1ai5 s ASP 412 Ca 0.10 1.45 0.22 0.00 0.43 0.00 0.00 52.55 54.74 1ai5 s ASP 412 Cb -0.11 -2.54 0.43 0.00 -0.30 0.00 0.00 42.92 40.41 1ai5 s ASP 412 CO 0.00 -0.90 1.63 -0.07 -0.17 0.00 0.00 175.17 175.66 1ai5 h LEU 413 N 10.23 0.00 -0.23 -1.34 3.38 -1.95 -2.59 115.31 122.81 1ai5 h LEU 413 Ca -0.26 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.71 1ai5 h LEU 413 Cb 1.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.85 1ai5 h LEU 413 CO 1.00 0.17 -0.08 0.49 0.09 0.00 0.00 178.44 180.11 1ai5 n PHE 414 N -3.17 0.00 -3.83 1.13 3.72 -1.26 -4.48 117.46 109.56 1ai5 n PHE 414 Ca 0.03 0.00 -0.25 0.00 -0.05 0.00 0.00 57.45 57.18 1ai5 n PHE 414 Cb 0.55 -0.16 0.01 0.00 -0.94 0.00 0.00 39.48 38.95 1ai5 n PHE 414 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1ai5 n ALA 415 N -0.91 -1.83 0.00 4.37 0.00 -0.98 -1.73 120.51 119.43 1ai5 n ALA 415 Ca 0.16 -0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.49 1ai5 n ALA 415 Cb 0.26 -2.42 0.00 0.00 0.00 0.00 0.00 19.45 17.29 1ai5 n ALA 415 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ai5 n GLY 416 N -1.69 2.50 3.83 0.00 0.00 -1.26 -5.03 105.19 103.54 1ai5 n GLY 416 Ca -0.21 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.45 1ai5 n GLY 416 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ai5 s LYS 417 N -0.28 4.10 0.37 1.61 1.02 -0.71 -5.03 119.74 120.82 1ai5 s LYS 417 Ca 0.00 0.66 -0.28 0.00 0.02 0.00 0.00 55.97 56.38 1ai5 s LYS 417 Cb 0.00 -2.91 -0.11 0.00 -0.52 0.00 0.00 37.83 34.29 1ai5 s LYS 417 CO 0.00 0.44 1.35 -0.35 -0.92 0.00 0.00 175.35 175.87 1ai5 n PRO 418 N 0.77 2.28 -0.18 -1.68 -0.04 -1.26 -4.84 135.00 130.05 1ai5 n PRO 418 Ca -0.04 0.80 -0.02 0.00 -0.04 0.00 0.00 63.50 64.20 1ai5 n PRO 418 Cb 0.51 -2.45 0.06 0.00 -0.04 0.00 0.00 33.50 31.58 1ai5 n PRO 418 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 1ai5 h GLN 419 N 2.60 0.04 -0.99 0.54 4.20 -1.95 -2.32 115.11 117.22 1ai5 h GLN 419 Ca -0.48 -0.00 0.14 0.00 0.06 0.00 0.00 58.65 58.37 1ai5 h GLN 419 Cb 1.27 -0.01 -0.09 0.00 0.30 0.00 0.00 27.48 28.96 1ai5 h GLN 419 CO 0.63 0.02 0.62 0.37 -0.67 0.00 0.00 178.83 179.80 1ai5 h GLN 420 N 0.04 0.86 -0.41 1.46 4.15 -1.96 0.67 115.11 119.92 1ai5 h GLN 420 Ca 0.27 -0.05 -0.11 0.00 0.77 0.00 0.00 58.65 59.53 1ai5 h GLN 420 Cb 0.42 -0.19 -0.01 0.00 0.21 0.00 0.00 27.48 27.90 1ai5 h GLN 420 CO -0.53 0.57 -0.20 1.49 -1.93 0.00 0.00 178.83 178.23 1ai5 h GLU 421 N 0.89 0.79 -0.27 1.69 4.81 -1.79 -1.12 114.58 119.59 1ai5 h GLU 421 Ca 0.51 -0.31 -0.17 0.00 -0.13 0.00 0.00 59.36 59.26 1ai5 h GLU 421 Cb 0.64 -0.04 -0.00 0.00 0.63 0.00 0.00 28.75 29.97 1ai5 h GLU 421 CO -0.29 0.93 -0.53 0.28 -0.73 0.00 0.00 179.01 178.67 1ai5 h VAL 422 N 0.69 1.29 -0.56 0.32 2.07 -1.17 -1.96 116.25 116.94 1ai5 h VAL 422 Ca 0.10 -1.73 -0.04 0.00 0.82 0.00 0.00 66.70 65.86 1ai5 h VAL 422 Cb 0.71 1.64 -0.03 0.00 -1.52 0.00 0.00 31.29 32.10 1ai5 h VAL 422 CO 0.05 0.56 0.19 0.58 0.02 0.00 0.00 177.57 178.98 1ai5 h VAL 423 N 0.60 1.21 0.12 2.57 2.07 -0.77 -2.08 116.25 119.96 1ai5 h VAL 423 Ca 0.02 -0.69 -0.28 0.00 0.82 0.00 0.00 66.70 66.57 1ai5 h VAL 423 Cb 1.11 0.58 0.02 0.00 -1.52 0.00 0.00 31.29 31.47 1ai5 h VAL 423 CO 0.11 0.27 -1.22 -0.07 0.02 0.00 0.00 177.57 176.68 1ai5 h LEU 424 N 0.80 0.61 -0.59 2.57 3.38 -1.18 -1.71 115.31 119.19 1ai5 h LEU 424 Ca 0.19 -0.60 -0.01 0.00 0.09 0.00 0.00 57.88 57.55 1ai5 h LEU 424 Cb 0.20 -0.19 -0.03 0.00 0.09 0.00 0.00 40.66 40.73 1ai5 h LEU 424 CO -0.01 1.44 0.34 0.00 0.09 0.00 0.00 178.44 180.29 1ai5 h ALA 425 N 0.49 0.75 -0.17 1.53 0.00 -1.18 -1.25 119.26 119.43 1ai5 h ALA 425 Ca -0.15 -0.09 -0.08 0.00 0.00 0.00 0.00 54.91 54.58 1ai5 h ALA 425 Cb 1.91 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 19.45 1ai5 h ALA 425 CO 0.22 0.26 -0.27 0.00 0.00 0.00 0.00 179.25 179.45 1ai5 h ALA 426 N 1.16 1.23 0.00 0.00 0.00 -1.27 -1.70 119.26 118.68 1ai5 h ALA 426 Ca 0.21 -0.33 -0.08 0.00 0.00 0.00 0.00 54.91 54.72 1ai5 h ALA 426 Cb 0.02 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.70 1ai5 h ALA 426 CO -0.04 0.51 -0.37 -0.07 0.00 0.00 0.00 179.25 179.29 1ai5 h LEU 427 N 0.28 0.00 -0.19 0.00 3.38 -0.78 -0.77 115.31 117.23 1ai5 h LEU 427 Ca 0.04 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.81 1ai5 h LEU 427 Cb 0.63 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.36 1ai5 h LEU 427 CO 0.05 0.37 -0.94 -0.08 0.09 0.00 0.00 178.44 177.92 1ai5 h GLU 428 N 0.00 0.14 -0.63 1.13 4.81 -0.72 -1.42 114.58 117.90 1ai5 h GLU 428 Ca -0.00 -0.18 -0.08 0.00 -0.13 0.00 0.00 59.36 58.97 1ai5 h GLU 428 Cb 0.79 0.06 -0.02 0.00 0.63 0.00 0.00 28.75 30.20 1ai5 h GLU 428 CO 0.05 0.98 0.09 -0.44 -0.73 0.00 0.00 179.01 178.95 1ai5 h ASP 429 N 0.07 1.01 -0.02 1.04 3.32 -0.85 -2.25 116.42 118.73 1ai5 h ASP 429 Ca -0.05 -0.27 -0.00 0.00 0.02 0.00 0.00 57.03 56.73 1ai5 h ASP 429 Cb 1.61 -0.27 -0.00 0.00 0.22 0.00 0.00 39.33 40.89 1ai5 h ASP 429 CO 0.14 1.02 0.00 0.74 -1.72 0.00 0.00 179.24 179.42 1ai5 h THR 430 N 0.95 1.23 -0.92 0.35 2.02 -0.95 -1.80 112.91 113.79 1ai5 h THR 430 Ca 0.19 -0.67 0.03 0.00 0.77 0.00 0.00 66.41 66.72 1ai5 h THR 430 Cb 0.45 1.64 -0.05 0.00 -1.74 0.00 0.00 68.15 68.45 1ai5 h THR 430 CO 0.01 0.18 0.61 -0.25 0.37 0.00 0.00 175.52 176.44 1ai5 h TRP 431 N -0.24 1.13 -0.13 3.16 2.91 -1.22 -1.15 115.95 120.42 1ai5 h TRP 431 Ca 0.01 0.03 -0.01 0.00 1.13 0.00 0.00 58.89 60.05 1ai5 h TRP 431 Cb 0.29 -0.38 -0.01 0.00 -0.51 0.00 0.00 29.16 28.55 1ai5 h TRP 431 CO 0.02 0.67 0.05 1.49 -1.03 0.00 0.00 178.44 179.64 1ai5 h GLU 432 N 1.18 0.20 0.32 2.65 4.22 -1.27 -1.92 114.58 119.96 1ai5 h GLU 432 Ca 0.36 -0.04 -0.02 0.00 0.08 0.00 0.00 59.36 59.75 1ai5 h GLU 432 Cb -0.02 -0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.20 1ai5 h GLU 432 CO -0.10 0.30 -0.15 1.15 -2.18 0.00 0.00 179.01 178.02 1ai5 h THR 433 N 0.05 0.71 -0.32 0.32 2.02 -1.03 -2.89 112.91 111.77 1ai5 h THR 433 Ca 0.04 -0.25 -0.12 0.00 0.77 0.00 0.00 66.41 66.86 1ai5 h THR 433 Cb 0.18 0.84 -0.01 0.00 -1.74 0.00 0.00 68.15 67.42 1ai5 h THR 433 CO -0.00 0.05 -0.27 -0.07 0.37 0.00 0.00 175.52 175.60 1ai5 h LEU 434 N -0.56 0.78 -1.26 2.58 3.38 -1.27 -3.03 115.31 115.93 1ai5 h LEU 434 Ca -0.04 -0.45 -0.07 0.00 0.09 0.00 0.00 57.88 57.40 1ai5 h LEU 434 Cb 0.41 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 1ai5 h LEU 434 CO 0.07 1.07 -0.26 0.77 0.09 0.00 0.00 178.44 180.19 1ai5 h SER 435 N 0.50 0.17 -0.64 -0.43 4.64 -1.45 -0.94 113.55 115.40 1ai5 h SER 435 Ca 0.06 -0.05 -0.08 0.00 -0.47 0.00 0.00 61.79 61.25 1ai5 h SER 435 Cb 0.83 -0.05 -0.03 0.00 -0.31 0.00 0.00 62.40 62.85 1ai5 h SER 435 CO 0.07 0.44 0.11 0.50 -0.87 0.00 0.00 176.83 177.08 1ai5 h LYS 436 N 0.16 1.07 0.11 4.77 3.11 -1.39 0.38 116.57 124.77 1ai5 h LYS 436 Ca 0.02 -0.28 -0.31 0.00 -2.81 0.00 0.00 60.65 57.28 1ai5 h LYS 436 Cb 0.55 -0.13 -0.01 0.00 -1.00 0.00 0.00 32.23 31.64 1ai5 h LYS 436 CO 0.04 0.98 -1.62 -0.09 -2.81 0.00 0.00 179.45 175.95 1ai5 h ARG 437 N 1.01 0.22 0.00 1.90 2.43 -1.28 -3.39 114.38 115.26 1ai5 h ARG 437 Ca 0.20 -0.38 0.00 0.00 -0.81 0.00 0.00 59.98 58.99 1ai5 h ARG 437 Cb 0.42 0.14 0.00 0.00 -0.42 0.00 0.00 29.97 30.11 1ai5 h ARG 437 CO 0.01 1.06 -1.04 0.66 -1.51 0.00 0.00 179.97 179.14 1ai5 n TYR 438 N -3.41 0.00 -0.08 2.20 4.01 -0.42 -5.12 117.16 114.34 1ai5 n TYR 438 Ca -0.19 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.55 1ai5 n TYR 438 Cb 1.04 -0.12 0.00 0.00 -0.31 0.00 0.00 39.34 39.95 1ai5 n TYR 438 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1ai5 n GLY 439 N 1.45 -3.69 0.07 2.72 0.00 0.13 -4.68 105.19 101.19 1ai5 n GLY 439 Ca 0.01 -2.05 0.12 0.00 0.00 0.00 0.00 46.02 44.09 1ai5 n GLY 439 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1ai5 h ASN 440 N 0.00 0.00 -2.68 1.61 2.35 -1.95 -3.38 115.58 111.53 1ai5 h ASN 440 Ca 0.00 -0.20 -0.70 0.00 -0.55 0.00 0.00 56.30 54.85 1ai5 h ASN 440 Cb 0.00 0.00 -0.19 0.00 0.05 0.00 0.00 38.32 38.18 1ai5 h ASN 440 CO 0.00 0.10 0.64 0.21 -1.65 0.00 0.00 177.43 176.73 1ai5 s ASN 441 N -4.40 6.57 0.48 5.81 2.47 -1.26 -4.88 114.94 119.73 1ai5 s ASN 441 Ca 0.04 -1.99 0.28 0.00 0.42 0.00 0.00 52.86 51.61 1ai5 s ASN 441 Cb 0.13 -2.36 1.35 0.00 -1.45 0.00 0.00 41.25 38.91 1ai5 s ASN 441 CO 0.75 -1.03 1.81 0.58 -3.72 0.00 0.00 177.10 175.49 1ai5 h VAL 442 N 5.70 0.49 0.00 -5.21 2.07 -1.94 0.16 116.25 117.52 1ai5 h VAL 442 Ca 0.07 -0.06 -0.00 0.00 0.82 0.00 0.00 66.70 67.53 1ai5 h VAL 442 Cb 1.04 0.30 -0.00 0.00 -1.52 0.00 0.00 31.29 31.11 1ai5 h VAL 442 CO 1.06 0.03 -0.00 0.28 0.02 0.00 0.00 177.57 178.96 1ai5 h SER 443 N 0.17 0.00 -0.35 0.57 0.02 -1.99 -2.16 113.55 109.80 1ai5 h SER 443 Ca 0.55 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.50 1ai5 h SER 443 Cb 1.83 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.37 1ai5 h SER 443 CO -0.13 0.00 0.00 -0.46 -1.14 0.00 0.00 176.83 175.10 1ai5 n ASN 444 N -3.09 3.85 -4.68 3.07 2.04 0.56 -4.96 115.26 112.04 1ai5 n ASN 444 Ca -0.01 -2.68 -0.42 0.00 -0.44 0.00 0.00 54.58 51.03 1ai5 n ASN 444 Cb 0.21 -0.47 -0.03 0.00 -2.53 0.00 0.00 39.78 36.95 1ai5 n ASN 444 CO 0.00 0.00 0.00 0.26 -0.44 0.00 0.00 177.26 177.08 1ai5 s TRP 445 N -2.23 2.53 -0.51 -2.53 0.52 -0.82 -4.97 118.94 110.95 1ai5 s TRP 445 Ca 0.39 0.52 -0.01 0.00 0.02 0.00 0.00 56.10 57.02 1ai5 s TRP 445 Cb 0.29 -3.82 0.13 0.00 -1.15 0.00 0.00 33.47 28.92 1ai5 s TRP 445 CO 0.13 -3.23 0.29 0.15 0.02 0.00 0.00 176.95 174.31 1ai5 s LYS 446 N 2.79 2.17 0.20 4.98 1.02 -1.26 -4.72 119.74 124.92 1ai5 s LYS 446 Ca 0.69 -2.24 -0.05 0.00 0.02 0.00 0.00 55.97 54.39 1ai5 s LYS 446 Cb -0.35 -3.57 -0.06 0.00 -0.52 0.00 0.00 37.83 33.34 1ai5 s LYS 446 CO 0.29 -1.11 0.45 0.95 -0.92 0.00 0.00 175.35 175.01 1ai5 s THR 447 N 0.40 5.09 0.03 2.17 -4.23 -1.26 -4.91 115.64 112.93 1ai5 s THR 447 Ca 0.13 0.08 -0.30 0.00 -1.18 0.00 0.00 61.69 60.42 1ai5 s THR 447 Cb -0.22 -3.65 -0.05 0.00 1.34 0.00 0.00 72.50 69.92 1ai5 s THR 447 CO -0.04 -0.08 1.18 -2.16 -0.54 0.00 0.00 174.62 172.99 1ai5 s PRO 448 N -2.94 4.42 0.64 3.99 0.04 -1.26 -0.16 135.00 139.73 1ai5 s PRO 448 Ca 0.43 1.71 -0.12 0.00 0.04 0.00 0.00 61.00 63.06 1ai5 s PRO 448 Cb -0.12 -3.41 -0.02 0.00 0.04 0.00 0.00 34.50 30.99 1ai5 s PRO 448 CO 0.25 -0.28 1.04 0.00 0.04 0.00 0.00 177.00 178.05 1ai5 s ALA 449 N 1.35 2.84 0.17 8.56 0.00 -0.66 -4.64 121.76 129.37 1ai5 s ALA 449 Ca 0.57 0.10 -0.26 0.00 0.00 0.00 0.00 51.96 52.38 1ai5 s ALA 449 Cb -0.27 -3.16 -0.08 0.00 0.00 0.00 0.00 23.12 19.61 1ai5 s ALA 449 CO 0.27 -0.91 0.79 -1.64 0.00 0.00 0.00 175.76 174.27 1ai5 s MET 450 N -4.81 4.59 0.47 0.00 -1.94 -1.26 -4.93 119.30 111.42 1ai5 s MET 450 Ca 0.58 1.18 0.06 0.00 -1.71 0.00 0.00 55.69 55.80 1ai5 s MET 450 Cb -0.13 -3.26 0.06 0.00 2.01 0.00 0.00 34.83 33.50 1ai5 s MET 450 CO 0.49 0.57 0.46 0.00 -0.01 0.00 0.00 175.02 176.53 1ai5 n ALA 451 N 1.59 0.82 -3.72 3.03 0.00 -1.26 -1.92 120.51 119.06 1ai5 n ALA 451 Ca -0.05 -1.80 -0.21 0.00 0.00 0.00 0.00 53.44 51.37 1ai5 n ALA 451 Cb 0.49 0.65 -0.17 0.00 0.00 0.00 0.00 19.45 20.42 1ai5 n ALA 451 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1ai5 s LEU 452 N 0.00 0.82 -0.17 0.00 2.96 -0.25 -4.12 118.68 117.93 1ai5 s LEU 452 Ca 0.35 -0.07 -0.02 0.00 -0.22 0.00 0.00 54.13 54.16 1ai5 s LEU 452 Cb -0.03 -0.39 -0.02 0.00 0.50 0.00 0.00 46.19 46.26 1ai5 s LEU 452 CO 0.22 -0.15 -0.08 -0.89 -1.32 0.00 0.00 176.35 174.13 1ai5 s THR 453 N 1.59 3.36 -0.57 3.68 2.01 -1.19 0.77 115.64 125.29 1ai5 s THR 453 Ca -0.01 -0.53 -0.24 0.00 0.31 0.00 0.00 61.69 61.22 1ai5 s THR 453 Cb -0.13 -2.47 0.05 0.00 0.01 0.00 0.00 72.50 69.96 1ai5 s THR 453 CO -0.03 0.48 0.94 -0.36 -0.69 0.00 0.00 174.62 174.96 1ai5 s PHE 454 N 0.75 2.77 0.44 4.92 0.40 0.36 -4.56 117.98 123.06 1ai5 s PHE 454 Ca -0.03 -0.15 -0.20 0.00 -0.60 0.00 0.00 56.93 55.95 1ai5 s PHE 454 Cb -0.15 -4.10 -0.10 0.00 0.51 0.00 0.00 43.02 39.18 1ai5 s PHE 454 CO 0.02 -1.41 0.95 1.03 0.70 0.00 0.00 175.22 176.50 1ai5 s ARG 455 N 3.94 4.18 0.29 0.44 0.52 -0.93 -1.70 118.95 125.70 1ai5 s ARG 455 Ca 0.28 1.08 0.21 0.00 -0.52 0.00 0.00 55.73 56.77 1ai5 s ARG 455 Cb -0.14 -2.18 0.13 0.00 0.52 0.00 0.00 34.95 33.28 1ai5 s ARG 455 CO 0.17 -0.06 1.31 0.00 0.02 0.00 0.00 175.30 176.74 1ai5 h ALA 456 N 1.76 0.75 -2.59 2.13 0.00 -1.89 0.14 119.26 119.55 1ai5 h ALA 456 Ca -0.49 -0.18 -0.56 0.00 0.00 0.00 0.00 54.91 53.69 1ai5 h ALA 456 Cb 1.18 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.95 1ai5 h ALA 456 CO 0.61 0.22 -0.10 -0.80 0.00 0.00 0.00 179.25 179.19 1ai5 s ASN 457 N -5.94 6.80 0.96 0.00 0.01 -1.26 -0.97 114.94 114.54 1ai5 s ASN 457 Ca 0.03 1.05 -0.12 0.00 -0.71 0.00 0.00 52.86 53.11 1ai5 s ASN 457 Cb 0.07 -2.28 0.17 0.00 0.41 0.00 0.00 41.25 39.63 1ai5 s ASN 457 CO 0.74 0.09 1.02 -0.46 -1.51 0.00 0.00 177.10 176.98 1ai5 n ASN 458 N 0.73 0.20 0.29 -1.22 2.04 0.33 -4.82 115.26 112.80 1ai5 n ASN 458 Ca -0.05 -1.44 0.16 0.00 -0.44 0.00 0.00 54.58 52.81 1ai5 n ASN 458 Cb 0.52 -0.77 0.85 0.00 -2.53 0.00 0.00 39.78 37.85 1ai5 n ASN 458 CO 0.00 0.00 0.00 2.19 -0.44 0.00 0.00 177.26 179.01 1ai5 h PHE 459 N -1.48 0.00 0.00 -2.53 -5.15 -1.95 1.24 116.94 107.06 1ai5 h PHE 459 Ca -0.33 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.44 1ai5 h PHE 459 Cb 0.94 0.00 0.00 0.00 0.22 0.00 0.00 35.95 37.11 1ai5 h PHE 459 CO 0.00 0.06 0.00 1.19 -2.00 0.00 0.00 178.31 177.56 1ai5 n PHE 460 N -3.41 0.67 -0.03 6.09 3.01 -1.26 -4.89 117.46 117.64 1ai5 n PHE 460 Ca -0.02 0.23 0.00 0.00 1.01 0.00 0.00 57.45 58.67 1ai5 n PHE 460 Cb 0.20 -0.87 0.00 0.00 -0.01 0.00 0.00 39.48 38.80 1ai5 n PHE 460 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1ai5 n GLY 461 N 0.67 0.72 3.81 1.37 0.00 0.43 -5.07 105.19 107.11 1ai5 n GLY 461 Ca 0.04 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.69 1ai5 n GLY 461 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ai5 s VAL 462 N -2.03 5.32 0.27 1.61 1.01 -1.25 -4.77 120.40 120.56 1ai5 s VAL 462 Ca 0.00 0.46 -0.31 0.00 0.00 0.00 0.00 61.98 62.14 1ai5 s VAL 462 Cb 0.00 -3.56 -0.12 0.00 0.00 0.00 0.00 36.38 32.71 1ai5 s VAL 462 CO 0.00 0.52 1.60 -2.65 0.00 0.00 0.00 175.10 174.57 1ai5 n PRO 463 N 2.61 2.62 -0.17 2.72 -0.02 -1.26 0.12 135.00 141.62 1ai5 n PRO 463 Ca -0.16 0.94 0.03 0.00 -2.02 0.00 0.00 63.50 62.29 1ai5 n PRO 463 Cb 0.53 -2.72 0.04 0.00 -0.02 0.00 0.00 33.50 31.34 1ai5 n PRO 463 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ai5 n GLN 464 N 2.48 0.97 -3.62 -0.52 10.64 -0.14 -4.78 117.38 122.42 1ai5 n GLN 464 Ca 0.10 -1.48 -0.02 0.00 -1.83 0.00 0.00 57.00 53.77 1ai5 n GLN 464 Cb 0.36 -0.90 -0.01 0.00 -0.86 0.00 0.00 30.24 28.82 1ai5 n GLN 464 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1ai5 s ALA 465 N -1.07 -2.05 0.62 2.61 0.00 -1.12 -4.58 121.76 116.17 1ai5 s ALA 465 Ca 0.10 0.93 -0.12 0.00 0.00 0.00 0.00 51.96 52.87 1ai5 s ALA 465 Cb 0.09 0.26 -0.03 0.00 0.00 0.00 0.00 23.12 23.43 1ai5 s ALA 465 CO 0.01 -0.86 1.03 0.00 0.00 0.00 0.00 175.76 175.94 1ai5 s ALA 466 N -2.63 2.99 0.42 0.00 0.00 -1.26 -4.80 121.76 116.48 1ai5 s ALA 466 Ca 0.11 -0.00 0.11 0.00 0.00 0.00 0.00 51.96 52.18 1ai5 s ALA 466 Cb 0.01 -3.11 0.95 0.00 0.00 0.00 0.00 23.12 20.98 1ai5 s ALA 466 CO -0.04 -0.76 1.99 0.00 0.00 0.00 0.00 175.76 176.95 1ai5 h ALA 467 N -0.25 1.91 0.00 0.00 0.00 -2.01 0.10 119.26 119.01 1ai5 h ALA 467 Ca -0.44 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1ai5 h ALA 467 Cb 1.20 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.87 1ai5 h ALA 467 CO 0.61 -0.01 0.00 0.39 0.00 0.00 0.00 179.25 180.23 1ai5 n GLU 468 N -4.47 0.10 0.00 0.00 4.71 -1.26 -2.34 120.64 117.37 1ai5 n GLU 468 Ca 0.08 0.20 0.15 0.00 -0.01 0.00 0.00 57.16 57.59 1ai5 n GLU 468 Cb 0.29 -1.50 0.74 0.00 -1.01 0.00 0.00 31.44 29.96 1ai5 n GLU 468 CO 0.00 0.00 0.00 0.39 0.09 0.00 0.00 177.13 177.61 1ai5 n GLU 469 N -1.39 0.76 -1.84 3.49 1.02 0.36 -4.88 120.64 118.15 1ai5 n GLU 469 Ca 0.05 -0.15 -0.41 0.00 -0.02 0.00 0.00 57.16 56.63 1ai5 n GLU 469 Cb 0.14 -1.50 -0.01 0.00 -0.02 0.00 0.00 31.44 30.05 1ai5 n GLU 469 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1ai5 s THR 470 N -2.34 2.20 -0.01 2.62 2.01 -0.99 -4.87 115.64 114.26 1ai5 s THR 470 Ca 0.35 0.18 0.06 0.00 0.31 0.00 0.00 61.69 62.58 1ai5 s THR 470 Cb 0.21 -3.11 -0.03 0.00 0.01 0.00 0.00 72.50 69.58 1ai5 s THR 470 CO 0.43 0.03 -0.19 -0.13 -0.69 0.00 0.00 174.62 174.07 1ai5 s ARG 471 N -0.94 2.22 -0.13 4.92 1.81 -0.69 -4.97 118.95 121.17 1ai5 s ARG 471 Ca 0.59 -0.87 -0.02 0.00 -1.72 0.00 0.00 55.73 53.71 1ai5 s ARG 471 Cb -0.46 -2.21 -0.02 0.00 -0.45 0.00 0.00 34.95 31.81 1ai5 s ARG 471 CO 0.51 0.57 -0.07 -1.01 -0.68 0.00 0.00 175.30 174.63 1ai5 s HIS 472 N -0.77 2.95 -0.05 -0.53 3.76 -1.26 -0.49 115.29 118.90 1ai5 s HIS 472 Ca 0.12 -0.30 0.05 0.00 -0.15 0.00 0.00 55.06 54.78 1ai5 s HIS 472 Cb -0.10 -1.87 -0.01 0.00 1.11 0.00 0.00 32.58 31.71 1ai5 s HIS 472 CO 0.02 0.02 -0.20 -1.14 -0.85 0.00 0.00 174.74 172.58 1ai5 s GLN 473 N 0.06 2.12 0.13 1.40 0.74 0.23 -5.00 119.66 119.34 1ai5 s GLN 473 Ca -0.02 -0.73 -0.13 0.00 0.05 0.00 0.00 55.36 54.53 1ai5 s GLN 473 Cb -0.14 -1.81 -0.02 0.00 1.10 0.00 0.00 33.01 32.14 1ai5 s GLN 473 CO 0.03 0.29 1.53 0.00 -0.55 0.00 0.00 175.29 176.59 1ai5 h ALA 474 N 6.20 0.58 -2.77 1.58 0.00 -1.91 -0.64 119.26 122.29 1ai5 h ALA 474 Ca -0.32 -0.35 -0.64 0.00 0.00 0.00 0.00 54.91 53.61 1ai5 h ALA 474 Cb 1.18 -0.15 -0.16 0.00 0.00 0.00 0.00 17.79 18.66 1ai5 h ALA 474 CO 0.47 0.50 -0.36 -2.00 0.00 0.00 0.00 179.25 177.87 1ai5 s GLU 475 N -4.72 3.91 0.10 0.00 2.12 -1.26 -4.12 118.70 114.73 1ai5 s GLU 475 Ca -0.12 -0.18 -0.31 0.00 0.36 0.00 0.00 54.97 54.72 1ai5 s GLU 475 Cb 0.11 -3.68 -0.08 0.00 0.26 0.00 0.00 34.13 30.74 1ai5 s GLU 475 CO 0.83 -0.28 1.44 -0.47 -0.54 0.00 0.00 175.26 176.24 1ai5 s TYR 476 N 1.94 3.07 -0.10 5.30 5.04 -0.81 -4.54 117.35 127.25 1ai5 s TYR 476 Ca 0.11 0.83 0.02 0.00 -2.44 0.00 0.00 57.07 55.59 1ai5 s TYR 476 Cb -0.16 -3.74 0.01 0.00 0.35 0.00 0.00 41.96 38.43 1ai5 s TYR 476 CO 0.11 -2.67 -0.17 -0.65 -1.34 0.00 0.00 175.55 170.83 1ai5 s GLN 477 N 1.49 2.34 -1.28 4.97 -0.21 -1.26 -4.92 119.66 120.79 1ai5 s GLN 477 Ca 0.66 -0.61 -0.15 0.00 0.02 0.00 0.00 55.36 55.28 1ai5 s GLN 477 Cb -0.37 -1.93 0.11 0.00 1.00 0.00 0.00 33.01 31.83 1ai5 s GLN 477 CO 0.30 -0.01 1.70 -1.71 -2.12 0.00 0.00 175.29 173.45 1ai5 n ASN 478 N 4.03 4.94 -3.78 5.90 5.15 -0.23 -4.89 115.26 126.37 1ai5 n ASN 478 Ca -0.20 -2.95 -0.13 0.00 -0.60 0.00 0.00 54.58 50.71 1ai5 n ASN 478 Cb 0.52 -1.65 -0.07 0.00 -0.53 0.00 0.00 39.78 38.05 1ai5 n ASN 478 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1ai5 s ARG 479 N 2.81 1.57 0.63 1.20 1.70 -1.26 -3.85 118.95 121.75 1ai5 s ARG 479 Ca 0.48 -1.59 -0.18 0.00 -0.47 0.00 0.00 55.73 53.97 1ai5 s ARG 479 Cb 0.03 0.39 -0.01 0.00 -0.57 0.00 0.00 34.95 34.78 1ai5 s ARG 479 CO 0.03 -0.61 1.23 0.20 -1.08 0.00 0.00 175.30 175.06 1ai5 s GLY 480 N -3.16 2.68 0.26 3.88 0.00 -1.26 -4.81 107.32 104.91 1ai5 s GLY 480 Ca 0.32 1.02 -0.01 0.00 0.00 0.00 0.00 44.72 46.05 1ai5 s GLY 480 CO 0.15 1.43 1.80 -0.84 0.00 0.00 0.00 173.10 175.64 1ai5 h THR 481 N 0.55 0.85 -3.47 0.90 2.02 -0.65 -3.40 112.91 109.72 1ai5 h THR 481 Ca -0.50 -0.27 -0.40 0.00 0.77 0.00 0.00 66.41 66.00 1ai5 h THR 481 Cb 1.31 -0.02 -0.17 0.00 -1.74 0.00 0.00 68.15 67.53 1ai5 h THR 481 CO 0.54 0.15 -0.75 -1.83 0.37 0.00 0.00 175.52 173.99 1ai5 s GLU 482 N -5.99 1.06 -0.01 6.66 4.04 -1.26 -4.76 118.70 118.44 1ai5 s GLU 482 Ca -0.12 -1.31 0.08 0.00 0.04 0.00 0.00 54.97 53.65 1ai5 s GLU 482 Cb 0.21 -0.87 -0.02 0.00 0.02 0.00 0.00 34.13 33.47 1ai5 s GLU 482 CO 0.79 0.16 -0.24 -0.80 -1.84 0.00 0.00 175.26 173.32 1ai5 s ASN 483 N -2.68 2.84 0.00 0.83 -0.87 -1.26 -3.79 114.94 110.02 1ai5 s ASN 483 Ca 0.12 -0.45 -0.02 0.00 -1.57 0.00 0.00 52.86 50.94 1ai5 s ASN 483 Cb -0.03 -0.31 -0.01 0.00 -0.02 0.00 0.00 41.25 40.88 1ai5 s ASN 483 CO 0.03 0.29 0.02 1.51 -2.57 0.00 0.00 177.10 176.39 1ai5 s ASP 484 N -0.61 0.09 -0.04 -1.22 -4.77 -1.06 -2.90 116.67 106.16 1ai5 s ASP 484 Ca 0.09 -0.22 0.02 0.00 -3.30 0.00 0.00 52.55 49.14 1ai5 s ASP 484 Cb -0.09 0.11 0.02 0.00 -1.09 0.00 0.00 42.92 41.86 1ai5 s ASP 484 CO -0.01 -0.20 -0.07 -0.32 0.70 0.00 0.00 175.17 175.28 1ai5 s MET 485 N -0.86 0.97 -0.15 2.11 1.75 -0.08 -2.04 119.30 121.00 1ai5 s MET 485 Ca -0.09 -0.19 0.01 0.00 -1.25 0.00 0.00 55.69 54.16 1ai5 s MET 485 Cb -0.06 -0.91 0.00 0.00 2.84 0.00 0.00 34.83 36.70 1ai5 s MET 485 CO -0.00 -0.02 -0.17 0.42 -0.65 0.00 0.00 175.02 174.60 1ai5 s ILE 486 N 0.68 2.51 -0.24 10.11 1.09 -0.63 -0.57 121.20 134.16 1ai5 s ILE 486 Ca -0.10 -0.83 -0.01 0.00 -1.10 0.00 0.00 60.65 58.61 1ai5 s ILE 486 Cb -0.13 -2.05 0.03 0.00 -1.06 0.00 0.00 42.46 39.25 1ai5 s ILE 486 CO 0.01 0.52 -0.08 -0.69 -0.10 0.00 0.00 174.94 174.60 1ai5 s VAL 487 N 0.78 2.71 -0.08 2.92 1.01 0.60 -1.79 120.40 126.56 1ai5 s VAL 487 Ca -0.06 -1.07 -0.11 0.00 0.00 0.00 0.00 61.98 60.73 1ai5 s VAL 487 Cb -0.15 -2.37 -0.05 0.00 0.00 0.00 0.00 36.38 33.81 1ai5 s VAL 487 CO 0.00 0.22 0.27 -0.36 0.00 0.00 0.00 175.10 175.23 1ai5 s PHE 488 N 1.30 3.63 -1.06 5.22 0.08 -0.32 -1.10 117.98 125.73 1ai5 s PHE 488 Ca -0.00 0.73 -0.19 0.00 0.12 0.00 0.00 56.93 57.59 1ai5 s PHE 488 Cb -0.17 -2.14 0.01 0.00 -0.57 0.00 0.00 43.02 40.16 1ai5 s PHE 488 CO -0.06 0.63 0.72 0.43 -0.10 0.00 0.00 175.22 176.84 1ai5 n SER 489 N 2.13 -5.10 -4.75 1.36 7.64 -0.22 -0.66 113.62 114.03 1ai5 n SER 489 Ca -0.16 -1.02 -0.42 0.00 1.01 0.00 0.00 58.87 58.29 1ai5 n SER 489 Cb 0.53 -2.67 -0.02 0.00 -1.01 0.00 0.00 64.21 61.04 1ai5 n SER 489 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1ai5 s PRO 490 N -5.96 4.15 0.53 1.43 0.04 -1.26 -3.70 135.00 130.24 1ai5 s PRO 490 Ca 0.35 2.52 0.32 0.00 0.04 0.00 0.00 61.00 64.22 1ai5 s PRO 490 Cb -0.15 -3.05 1.26 0.00 0.04 0.00 0.00 34.50 32.60 1ai5 s PRO 490 CO 0.89 -0.60 1.95 1.79 0.04 0.00 0.00 177.00 181.07 1ai5 h THR 491 N 3.48 0.08 -0.34 1.26 1.35 -1.65 -3.29 112.91 113.80 1ai5 h THR 491 Ca -0.46 -0.61 0.00 0.00 -0.55 0.00 0.00 66.41 64.79 1ai5 h THR 491 Cb 1.22 1.57 0.00 0.00 -1.73 0.00 0.00 68.15 69.20 1ai5 h THR 491 CO 0.81 0.03 0.00 0.35 -0.25 0.00 0.00 175.52 176.46 1ai5 n THR 492 N -3.13 0.51 -3.99 6.82 -2.24 -1.26 -4.91 114.28 106.07 1ai5 n THR 492 Ca 0.01 -0.47 -0.09 0.00 -2.27 0.00 0.00 64.05 61.23 1ai5 n THR 492 Cb 0.33 0.19 -0.05 0.00 -2.10 0.00 0.00 70.33 68.70 1ai5 n THR 492 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1ai5 s SER 493 N -0.96 -0.09 0.09 3.42 0.15 -1.24 -5.03 113.70 110.03 1ai5 s SER 493 Ca 0.23 -0.92 0.23 0.00 0.70 0.00 0.00 55.95 56.19 1ai5 s SER 493 Cb 0.12 0.58 -0.07 0.00 -1.71 0.00 0.00 66.02 64.94 1ai5 s SER 493 CO 0.15 -1.13 0.89 -0.90 1.20 0.00 0.00 173.24 173.46 1ai5 n ASP 494 N -0.37 0.55 -4.75 5.45 5.68 -1.26 -4.83 116.55 117.01 1ai5 n ASP 494 Ca -0.02 0.04 -0.41 0.00 -0.50 0.00 0.00 54.79 53.90 1ai5 n ASP 494 Cb 0.62 0.97 -0.03 0.00 -1.14 0.00 0.00 41.12 41.55 1ai5 n ASP 494 CO 0.00 0.00 0.00 -0.13 -1.33 0.00 0.00 177.20 175.74 1ai5 s ARG 495 N -3.34 4.38 0.46 0.11 1.81 -1.26 -4.94 118.95 116.17 1ai5 s ARG 495 Ca -0.01 2.12 0.25 0.00 -1.72 0.00 0.00 55.73 56.37 1ai5 s ARG 495 Cb 0.12 -3.14 1.08 0.00 -0.45 0.00 0.00 34.95 32.56 1ai5 s ARG 495 CO 0.83 -0.22 1.90 -1.00 -0.68 0.00 0.00 175.30 176.12 1ai5 h PRO 496 N 4.60 0.00 -4.69 3.54 0.13 -1.93 -3.39 132.00 130.27 1ai5 h PRO 496 Ca -0.46 0.00 -0.28 0.00 -0.87 0.00 0.00 66.00 64.39 1ai5 h PRO 496 Cb 1.22 0.00 -0.20 0.00 0.13 0.00 0.00 31.00 32.15 1ai5 h PRO 496 CO 0.73 0.20 -0.73 0.08 -0.23 0.00 0.00 178.00 178.05 1ai5 s VAL 497 N -3.81 0.66 0.01 1.56 1.01 -1.26 -1.06 120.40 117.50 1ai5 s VAL 497 Ca -0.01 -1.33 0.01 0.00 0.00 0.00 0.00 61.98 60.66 1ai5 s VAL 497 Cb 0.11 -0.94 -0.01 0.00 0.00 0.00 0.00 36.38 35.54 1ai5 s VAL 497 CO 0.62 -0.49 -0.05 -0.76 0.00 0.00 0.00 175.10 174.42 1ai5 s LEU 498 N -1.98 2.07 0.03 3.92 1.43 -0.26 -4.99 118.68 118.90 1ai5 s LEU 498 Ca -0.03 -0.20 -0.07 0.00 -1.03 0.00 0.00 54.13 52.80 1ai5 s LEU 498 Cb -0.06 -0.19 -0.01 0.00 0.03 0.00 0.00 46.19 45.96 1ai5 s LEU 498 CO -0.01 -0.02 0.12 0.00 0.23 0.00 0.00 176.35 176.68 1ai5 s ALA 499 N -0.43 -0.18 0.11 4.21 0.00 -1.26 -0.29 121.76 123.92 1ai5 s ALA 499 Ca -0.02 -0.41 -0.03 0.00 0.00 0.00 0.00 51.96 51.50 1ai5 s ALA 499 Cb -0.04 0.23 -0.03 0.00 0.00 0.00 0.00 23.12 23.28 1ai5 s ALA 499 CO -0.00 -0.31 0.10 -1.58 0.00 0.00 0.00 175.76 173.97 1ai5 s TRP 500 N -2.35 0.61 0.11 0.00 0.51 0.27 -1.91 118.94 116.18 1ai5 s TRP 500 Ca -0.07 -1.03 -0.04 0.00 -2.12 0.00 0.00 56.10 52.84 1ai5 s TRP 500 Cb -0.02 -0.33 0.02 0.00 -0.81 0.00 0.00 33.47 32.32 1ai5 s TRP 500 CO -0.03 -0.53 0.22 -0.40 -0.51 0.00 0.00 176.95 175.70 1ai5 n ASP 501 N -0.07 -0.64 -3.46 2.95 5.75 -0.60 -0.90 116.55 119.58 1ai5 n ASP 501 Ca -0.09 -1.48 0.01 0.00 -0.01 0.00 0.00 54.79 53.22 1ai5 n ASP 501 Cb 0.63 1.07 -0.03 0.00 -1.03 0.00 0.00 41.12 41.76 1ai5 n ASP 501 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1ai5 s VAL 502 N -2.71 -0.87 -0.51 2.12 0.11 -1.14 -1.03 120.40 116.36 1ai5 s VAL 502 Ca 0.05 0.00 0.03 0.00 -2.93 0.00 0.00 61.98 59.14 1ai5 s VAL 502 Cb -0.01 -1.00 0.14 0.00 -1.53 0.00 0.00 36.38 33.97 1ai5 s VAL 502 CO 0.04 0.00 0.28 -0.69 -3.33 0.00 0.00 175.10 171.40 1ai5 s VAL 503 N 2.81 2.16 0.07 2.04 1.01 -1.26 -4.01 120.40 123.23 1ai5 s VAL 503 Ca 0.01 -3.16 -0.03 0.00 0.00 0.00 0.00 61.98 58.80 1ai5 s VAL 503 Cb -0.11 -2.49 -0.05 0.00 0.00 0.00 0.00 36.38 33.72 1ai5 s VAL 503 CO -0.19 -0.87 0.28 0.00 0.00 0.00 0.00 175.10 174.32 1ai5 s ALA 504 N -0.21 3.90 0.33 5.51 0.00 -1.26 -2.93 121.76 127.10 1ai5 s ALA 504 Ca 0.19 -0.68 0.09 0.00 0.00 0.00 0.00 51.96 51.56 1ai5 s ALA 504 Cb -0.22 -1.99 0.59 0.00 0.00 0.00 0.00 23.12 21.51 1ai5 s ALA 504 CO -0.02 0.73 1.78 -1.35 0.00 0.00 0.00 175.76 176.89 1ai5 h PRO 505 N 3.22 0.15 -2.07 0.00 0.11 -1.86 -3.39 132.00 128.17 1ai5 h PRO 505 Ca -0.47 -0.06 0.32 0.00 0.11 0.00 0.00 66.00 65.90 1ai5 h PRO 505 Cb 1.17 -0.01 -0.07 0.00 0.11 0.00 0.00 31.00 32.20 1ai5 h PRO 505 CO 0.72 0.49 0.85 0.20 -0.21 0.00 0.00 178.00 180.06 1ai5 s GLY 506 N -4.23 -0.14 0.22 -0.55 0.00 -1.15 -0.85 107.32 100.62 1ai5 s GLY 506 Ca -0.04 0.09 -0.09 0.00 0.00 0.00 0.00 44.72 44.69 1ai5 s GLY 506 CO 0.75 4.34 1.84 -1.61 0.00 0.00 0.00 173.10 178.42 1ai5 h GLN 507 N 2.00 1.13 -6.01 2.90 5.75 -1.68 -3.42 115.11 115.77 1ai5 h GLN 507 Ca -0.24 -0.13 -0.61 0.00 -0.15 0.00 0.00 58.65 57.52 1ai5 h GLN 507 Cb 1.19 -0.22 -0.05 0.00 1.07 0.00 0.00 27.48 29.46 1ai5 h GLN 507 CO 0.31 0.83 -0.53 0.45 -2.65 0.00 0.00 178.83 177.24 1ai5 s SER 508 N -6.12 6.09 0.00 -0.69 0.15 -0.96 -4.90 113.70 107.28 1ai5 s SER 508 Ca -0.13 0.16 0.04 0.00 0.70 0.00 0.00 55.95 56.73 1ai5 s SER 508 Cb 0.16 -1.80 0.10 0.00 -1.71 0.00 0.00 66.02 62.76 1ai5 s SER 508 CO 0.81 0.15 0.96 0.61 1.20 0.00 0.00 173.24 176.97 1ai5 n GLY 509 N 0.21 1.64 3.73 9.45 0.00 -1.26 -3.99 105.19 114.96 1ai5 n GLY 509 Ca -0.06 -0.15 -0.41 0.00 0.00 0.00 0.00 46.02 45.40 1ai5 n GLY 509 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1ai5 s PHE 510 N -0.80 3.59 -0.13 1.61 5.36 -1.26 -4.97 117.98 121.38 1ai5 s PHE 510 Ca 0.08 1.57 -0.00 0.00 -0.96 0.00 0.00 56.93 57.61 1ai5 s PHE 510 Cb 0.05 -3.27 0.03 0.00 -0.34 0.00 0.00 43.02 39.48 1ai5 s PHE 510 CO 0.06 -0.63 -0.07 0.42 -1.46 0.00 0.00 175.22 173.55 1ai5 s ILE 511 N 0.08 1.03 1.02 3.12 1.01 -1.26 -0.98 121.20 125.22 1ai5 s ILE 511 Ca 0.51 -0.37 -0.12 0.00 0.00 0.00 0.00 60.65 60.67 1ai5 s ILE 511 Cb -0.28 -1.10 0.20 0.00 0.01 0.00 0.00 42.46 41.29 1ai5 s ILE 511 CO 0.33 0.30 1.08 0.00 0.00 0.00 0.00 174.94 176.64 1ai5 s ALA 512 N 1.70 0.67 0.40 9.38 0.00 0.57 -4.88 121.76 129.60 1ai5 s ALA 512 Ca 0.04 -0.12 0.08 0.00 0.00 0.00 0.00 51.96 51.96 1ai5 s ALA 512 Cb -0.13 -3.21 0.84 0.00 0.00 0.00 0.00 23.12 20.61 1ai5 s ALA 512 CO -0.08 -3.05 2.01 -1.35 0.00 0.00 0.00 175.76 173.29 1ai5 h PRO 513 N -2.05 0.42 0.00 0.00 0.11 -2.01 -0.43 132.00 128.04 1ai5 h PRO 513 Ca -0.55 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.51 1ai5 h PRO 513 Cb 1.31 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1ai5 h PRO 513 CO 0.53 0.36 0.00 -0.40 -0.21 0.00 0.00 178.00 178.28 1ai5 n ASP 514 N -4.41 0.00 0.00 -2.05 5.68 -1.26 -4.86 116.55 109.65 1ai5 n ASP 514 Ca 0.01 -0.78 0.00 0.00 -0.50 0.00 0.00 54.79 53.53 1ai5 n ASP 514 Cb 0.14 -0.01 0.00 0.00 -1.14 0.00 0.00 41.12 40.11 1ai5 n ASP 514 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1ai5 n GLY 515 N 0.61 0.68 3.69 6.12 0.00 -0.17 -5.03 105.19 111.08 1ai5 n GLY 515 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 1ai5 n GLY 515 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ai5 s THR 516 N -2.49 4.06 0.03 2.61 2.01 -1.26 -4.79 115.64 115.81 1ai5 s THR 516 Ca 0.00 1.41 -0.22 0.00 0.31 0.00 0.00 61.69 63.19 1ai5 s THR 516 Cb 0.00 -3.91 -0.06 0.00 0.01 0.00 0.00 72.50 68.55 1ai5 s THR 516 CO 0.00 0.00 0.64 -0.69 -0.69 0.00 0.00 174.62 173.88 1ai5 s VAL 517 N 2.22 4.80 0.85 3.82 1.01 -1.26 -0.31 120.40 131.51 1ai5 s VAL 517 Ca 0.59 1.35 -0.14 0.00 0.00 0.00 0.00 61.98 63.78 1ai5 s VAL 517 Cb -0.27 -3.98 0.02 0.00 0.00 0.00 0.00 36.38 32.15 1ai5 s VAL 517 CO 0.24 0.44 0.59 -0.67 0.00 0.00 0.00 175.10 175.70 1ai5 n ASP 518 N 2.45 -1.24 0.26 3.32 2.03 -0.15 -4.88 116.55 118.34 1ai5 n ASP 518 Ca -0.07 0.46 0.13 0.00 0.52 0.00 0.00 54.79 55.84 1ai5 n ASP 518 Cb 0.51 -1.26 0.71 0.00 -0.72 0.00 0.00 41.12 40.35 1ai5 n ASP 518 CO 0.00 0.00 0.00 0.50 -1.92 0.00 0.00 177.20 175.78 1ai5 h LYS 519 N -1.04 0.00 -0.41 -0.67 3.64 -1.96 -2.58 116.57 113.56 1ai5 h LYS 519 Ca -0.45 0.00 -0.23 0.00 -1.27 0.00 0.00 60.65 58.71 1ai5 h LYS 519 Cb 1.31 0.00 -0.14 0.00 -0.41 0.00 0.00 32.23 32.99 1ai5 h LYS 519 CO 0.39 0.12 -0.10 0.72 -2.27 0.00 0.00 179.45 178.31 1ai5 n HIS 520 N -3.48 1.29 0.08 1.91 8.25 -1.26 -4.66 115.22 117.34 1ai5 n HIS 520 Ca -0.01 -1.71 -0.05 0.00 -0.26 0.00 0.00 57.72 55.68 1ai5 n HIS 520 Cb 0.27 -0.52 -0.07 0.00 1.12 0.00 0.00 29.99 30.78 1ai5 n HIS 520 CO 0.00 0.00 0.00 -0.92 0.64 0.00 0.00 176.34 176.06 1ai5 h TYR 521 N 1.11 0.00 0.00 4.41 3.20 -1.59 -2.49 116.97 121.61 1ai5 h TYR 521 Ca 0.25 0.00 -0.07 0.00 3.14 0.00 0.00 58.73 62.06 1ai5 h TYR 521 Cb 1.63 0.00 -0.11 0.00 1.54 0.00 0.00 36.73 39.79 1ai5 h TYR 521 CO 1.06 0.90 -0.44 -0.85 -1.64 0.00 0.00 178.16 177.19 1ai5 n GLU 522 N -3.37 0.00 -0.00 1.82 0.28 -1.26 -3.51 120.64 114.60 1ai5 n GLU 522 Ca 0.00 -0.95 0.07 0.00 -0.16 0.00 0.00 57.16 56.12 1ai5 n GLU 522 Cb 0.88 -0.05 0.40 0.00 1.43 0.00 0.00 31.44 34.10 1ai5 n GLU 522 CO 0.00 0.00 0.00 -0.40 -0.16 0.00 0.00 177.13 176.57 1ai5 n ASP 523 N 0.11 0.02 -0.13 -1.84 5.75 -1.22 -3.43 116.55 115.81 1ai5 n ASP 523 Ca -0.04 -1.58 0.02 0.00 -0.01 0.00 0.00 54.79 53.17 1ai5 n ASP 523 Cb 0.75 -0.00 0.01 0.00 -1.03 0.00 0.00 41.12 40.84 1ai5 n ASP 523 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1ai5 n GLN 524 N -0.70 1.20 -0.12 0.11 6.02 -0.03 -4.82 117.38 119.04 1ai5 n GLN 524 Ca 0.10 -0.56 -0.07 0.00 -0.01 0.00 0.00 57.00 56.45 1ai5 n GLN 524 Cb 0.05 -0.98 0.09 0.00 1.02 0.00 0.00 30.24 30.42 1ai5 n GLN 524 CO 0.00 0.00 0.00 1.25 -1.01 0.00 0.00 177.06 177.30 1ai5 h LEU 525 N 0.64 0.85 -0.18 1.08 5.85 -1.51 -2.46 115.31 119.59 1ai5 h LEU 525 Ca 0.00 -0.27 -0.22 0.00 0.84 0.00 0.00 57.88 58.23 1ai5 h LEU 525 Cb 0.16 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 40.95 1ai5 h LEU 525 CO 0.00 0.99 -0.95 0.11 -0.34 0.00 0.00 178.44 178.25 1ai5 h LYS 526 N 0.77 0.26 -0.83 1.25 1.79 -1.88 -2.95 116.57 114.98 1ai5 h LYS 526 Ca 0.12 -0.30 0.05 0.00 -2.18 0.00 0.00 60.65 58.34 1ai5 h LYS 526 Cb 0.64 0.09 -0.06 0.00 -1.58 0.00 0.00 32.23 31.32 1ai5 h LYS 526 CO 0.04 1.03 0.52 1.98 -1.08 0.00 0.00 179.45 181.94 1ai5 h MET 527 N 0.13 0.94 0.21 3.15 4.05 -1.85 -2.32 114.93 119.24 1ai5 h MET 527 Ca -0.06 -0.06 -0.01 0.00 -0.28 0.00 0.00 59.70 59.29 1ai5 h MET 527 Cb 1.60 -0.21 0.00 0.00 -0.80 0.00 0.00 31.60 32.19 1ai5 h MET 527 CO 0.15 0.62 -0.10 -0.92 0.23 0.00 0.00 176.91 176.89 1ai5 h TYR 528 N 0.96 -0.26 -0.97 1.39 3.20 -1.34 0.14 116.97 120.09 1ai5 h TYR 528 Ca 0.35 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.24 1ai5 h TYR 528 Cb 0.12 0.09 -0.05 0.00 1.54 0.00 0.00 36.73 38.42 1ai5 h TYR 528 CO -0.03 -0.03 0.64 1.49 -1.64 0.00 0.00 178.16 178.58 1ai5 h GLU 529 N -0.45 1.23 -0.58 1.82 4.81 -1.35 -2.43 114.58 117.62 1ai5 h GLU 529 Ca -0.03 -0.07 0.00 0.00 -0.13 0.00 0.00 59.36 59.13 1ai5 h GLU 529 Cb 0.35 -0.28 0.00 0.00 0.63 0.00 0.00 28.75 29.45 1ai5 h GLU 529 CO 0.05 0.81 0.00 0.09 -0.73 0.00 0.00 179.01 179.23 1ai5 n ASN 530 N -4.44 2.42 -1.24 1.04 3.02 -0.89 -4.90 115.26 110.26 1ai5 n ASN 530 Ca 0.12 -2.21 -0.13 0.00 -0.03 0.00 0.00 54.58 52.33 1ai5 n ASN 530 Cb 0.06 -0.41 -0.03 0.00 -0.61 0.00 0.00 39.78 38.79 1ai5 n ASN 530 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1ai5 n PHE 531 N 0.35 -0.30 -2.32 3.10 3.72 -0.92 -5.01 117.46 116.08 1ai5 n PHE 531 Ca 0.11 0.00 -0.24 0.00 -0.05 0.00 0.00 57.45 57.28 1ai5 n PHE 531 Cb 0.48 -2.62 0.14 0.00 -0.94 0.00 0.00 39.48 36.54 1ai5 n PHE 531 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1ai5 n GLY 532 N -1.20 -0.13 3.47 1.37 0.00 0.46 -5.03 105.19 104.13 1ai5 n GLY 532 Ca -0.14 -1.91 -0.13 0.00 0.00 0.00 0.00 46.02 43.84 1ai5 n GLY 532 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 1ai5 s ARG 533 N -5.22 1.08 0.23 1.61 1.70 -1.26 -4.68 118.95 112.41 1ai5 s ARG 533 Ca 0.65 -0.21 0.08 0.00 -0.47 0.00 0.00 55.73 55.79 1ai5 s ARG 533 Cb -0.03 0.50 -0.04 0.00 -0.57 0.00 0.00 34.95 34.81 1ai5 s ARG 533 CO 0.44 -0.44 0.02 -1.59 -1.08 0.00 0.00 175.30 172.65 1ai5 s LYS 534 N -2.78 2.40 0.38 3.89 -2.85 -0.20 -4.92 119.74 115.66 1ai5 s LYS 534 Ca -0.01 -1.25 -0.25 0.00 -1.00 0.00 0.00 55.97 53.45 1ai5 s LYS 534 Cb -0.01 -2.28 -0.09 0.00 -2.06 0.00 0.00 37.83 33.39 1ai5 s LYS 534 CO -0.05 0.40 1.04 -1.12 0.10 0.00 0.00 175.35 175.72 1ai5 s SER 535 N -3.40 6.85 -0.16 0.03 0.01 -1.26 -1.55 113.70 114.21 1ai5 s SER 535 Ca 0.30 2.03 -0.07 0.00 1.31 0.00 0.00 55.95 59.52 1ai5 s SER 535 Cb -0.08 -2.59 -0.04 0.00 0.21 0.00 0.00 66.02 63.52 1ai5 s SER 535 CO 0.20 -0.43 0.08 -0.76 0.41 0.00 0.00 173.24 172.74 1ai5 s LEU 536 N -2.50 3.94 0.05 2.44 1.43 -0.80 -4.83 118.68 118.42 1ai5 s LEU 536 Ca 0.56 0.18 0.02 0.00 -1.03 0.00 0.00 54.13 53.85 1ai5 s LEU 536 Cb -0.22 -1.98 -0.04 0.00 0.03 0.00 0.00 46.19 43.97 1ai5 s LEU 536 CO 0.28 0.24 0.09 0.26 0.23 0.00 0.00 176.35 177.45 1ai5 s TRP 537 N -0.01 3.24 0.06 0.29 0.23 -1.26 -4.47 118.94 117.02 1ai5 s TRP 537 Ca 0.07 0.13 0.00 0.00 -2.03 0.00 0.00 56.10 54.27 1ai5 s TRP 537 Cb -0.12 -1.67 0.00 0.00 0.03 0.00 0.00 33.47 31.71 1ai5 s TRP 537 CO 0.01 0.53 0.00 -0.11 0.96 0.00 0.00 176.95 178.34 1ai5 n LEU 538 N 0.67 0.40 -4.77 2.99 7.94 -1.26 -4.81 117.00 118.16 1ai5 n LEU 538 Ca -0.10 0.09 -0.34 0.00 -1.11 0.00 0.00 56.01 54.55 1ai5 n LEU 538 Cb 0.52 -0.09 0.04 0.00 0.53 0.00 0.00 43.42 44.41 1ai5 n LEU 538 CO 0.43 -0.38 0.76 0.42 -1.11 0.00 0.00 177.39 177.51 1ai5 s THR 539 N -2.00 3.10 0.16 1.96 -4.23 -1.26 -4.88 115.64 108.49 1ai5 s THR 539 Ca 0.00 0.56 -0.16 0.00 -1.18 0.00 0.00 61.69 60.91 1ai5 s THR 539 Cb 0.00 -3.11 0.07 0.00 1.34 0.00 0.00 72.50 70.79 1ai5 s THR 539 CO 0.00 -0.26 1.70 0.11 -0.54 0.00 0.00 174.62 175.62 1ai5 h LYS 540 N 0.34 0.09 0.03 3.99 1.57 -1.99 -0.81 116.57 119.79 1ai5 h LYS 540 Ca -0.48 -0.01 0.03 0.00 -1.87 0.00 0.00 60.65 58.33 1ai5 h LYS 540 Cb 1.26 -0.02 -0.05 0.00 0.08 0.00 0.00 32.23 33.50 1ai5 h LYS 540 CO 0.54 0.06 -0.32 0.37 -0.57 0.00 0.00 179.45 179.53 1ai5 h GLN 541 N 0.09 -0.47 -0.95 3.15 4.15 -1.99 0.82 115.11 119.91 1ai5 h GLN 541 Ca 0.19 0.03 0.01 0.00 0.77 0.00 0.00 58.65 59.65 1ai5 h GLN 541 Cb 0.27 0.11 -0.05 0.00 0.21 0.00 0.00 27.48 28.02 1ai5 h GLN 541 CO -0.32 -0.32 0.62 -0.44 -1.93 0.00 0.00 178.83 176.44 1ai5 h ASP 542 N -0.49 1.10 -0.07 -0.69 3.32 -1.84 0.80 116.42 118.54 1ai5 h ASP 542 Ca 0.05 -0.04 -0.00 0.00 0.02 0.00 0.00 57.03 57.06 1ai5 h ASP 542 Cb 0.56 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 39.83 1ai5 h ASP 542 CO -0.25 0.81 0.03 0.58 -1.72 0.00 0.00 179.24 178.69 1ai5 h VAL 543 N 1.29 1.14 -0.81 -1.35 2.07 -0.51 -2.58 116.25 115.51 1ai5 h VAL 543 Ca 0.35 -0.43 0.01 0.00 0.82 0.00 0.00 66.70 67.44 1ai5 h VAL 543 Cb -0.13 1.30 -0.04 0.00 -1.52 0.00 0.00 31.29 30.90 1ai5 h VAL 543 CO -0.07 0.12 0.53 -0.33 0.02 0.00 0.00 177.57 177.84 1ai5 h GLU 544 N -0.04 1.07 0.00 1.57 4.39 -0.55 -1.63 114.58 119.39 1ai5 h GLU 544 Ca 0.02 -0.07 -0.02 0.00 0.34 0.00 0.00 59.36 59.63 1ai5 h GLU 544 Cb 0.17 -0.24 -0.00 0.00 -0.10 0.00 0.00 28.75 28.58 1ai5 h GLU 544 CO -0.00 0.71 -0.11 0.00 -1.16 0.00 0.00 179.01 178.46 1ai5 h ALA 545 N 1.29 1.37 -0.14 3.43 0.00 -0.76 -2.88 119.26 121.58 1ai5 h ALA 545 Ca 0.30 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.11 1ai5 h ALA 545 Cb -0.12 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.65 1ai5 h ALA 545 CO -0.06 0.13 0.00 0.72 0.00 0.00 0.00 179.25 180.04 1ai5 n HIS 546 N -3.76 0.44 -2.23 0.00 8.25 -0.69 -5.04 115.22 112.19 1ai5 n HIS 546 Ca -0.02 -0.86 -0.41 0.00 -0.26 0.00 0.00 57.72 56.17 1ai5 n HIS 546 Cb 0.21 -0.20 -0.03 0.00 1.12 0.00 0.00 29.99 31.09 1ai5 n HIS 546 CO 0.00 0.00 0.00 0.21 0.64 0.00 0.00 176.34 177.19 1ai5 s LYS 547 N -2.54 4.44 -0.02 -0.41 2.20 -0.75 -4.94 119.74 117.73 1ai5 s LYS 547 Ca 0.33 2.08 0.09 0.00 -0.36 0.00 0.00 55.97 58.11 1ai5 s LYS 547 Cb 0.27 -3.11 -0.14 0.00 -1.51 0.00 0.00 37.83 33.34 1ai5 s LYS 547 CO 0.06 -0.07 0.19 -0.85 -0.36 0.00 0.00 175.35 174.32 1ai5 n GLU 548 N 1.04 0.39 -3.66 4.03 0.28 -1.26 -5.07 120.64 116.38 1ai5 n GLU 548 Ca 0.00 -0.08 -0.06 0.00 -0.16 0.00 0.00 57.16 56.86 1ai5 n GLU 548 Cb 0.43 -1.21 -0.02 0.00 1.43 0.00 0.00 31.44 32.07 1ai5 n GLU 548 CO 0.00 0.00 0.00 -1.54 -0.16 0.00 0.00 177.13 175.43 1ai5 s SER 549 N -3.07 -0.27 -0.06 -1.84 1.04 -1.26 -5.18 113.70 103.06 1ai5 s SER 549 Ca -0.03 -0.27 -0.08 0.00 0.48 0.00 0.00 55.95 56.04 1ai5 s SER 549 Cb 0.05 0.49 0.02 0.00 0.10 0.00 0.00 66.02 66.68 1ai5 s SER 549 CO 0.37 -0.87 0.22 -1.58 0.98 0.00 0.00 173.24 172.35 1ai5 s GLN 550 N -3.34 0.35 -0.03 4.02 0.74 -1.26 -5.16 119.66 114.98 1ai5 s GLN 550 Ca 0.09 0.14 -0.01 0.00 0.05 0.00 0.00 55.36 55.63 1ai5 s GLN 550 Cb -0.02 0.16 0.02 0.00 1.10 0.00 0.00 33.01 34.28 1ai5 s GLN 550 CO -0.02 -0.06 0.06 -2.00 -0.55 0.00 0.00 175.29 172.72 1ai5 s GLU 551 N -0.30 0.01 -0.04 1.67 2.12 -1.26 -5.15 118.70 115.75 1ai5 s GLU 551 Ca -0.04 0.19 0.06 0.00 0.36 0.00 0.00 54.97 55.54 1ai5 s GLU 551 Cb -0.03 -0.16 -0.02 0.00 0.26 0.00 0.00 34.13 34.19 1ai5 s GLU 551 CO 0.01 -0.12 -0.24 0.08 -0.54 0.00 0.00 175.26 174.45 1ai5 s VAL 552 N 0.80 2.19 0.18 3.70 1.01 -1.26 -5.14 120.40 121.89 1ai5 s VAL 552 Ca -0.06 -1.03 0.10 0.00 0.00 0.00 0.00 61.98 60.98 1ai5 s VAL 552 Cb -0.09 -1.79 -0.04 0.00 0.00 0.00 0.00 36.38 34.46 1ai5 s VAL 552 CO -0.03 0.58 -0.18 -0.76 0.00 0.00 0.00 175.10 174.71 1ai5 s LEU 553 N -0.39 2.67 -0.25 3.92 1.43 -1.26 -5.11 118.68 119.69 1ai5 s LEU 553 Ca 0.03 -0.73 -0.00 0.00 -1.03 0.00 0.00 54.13 52.40 1ai5 s LEU 553 Cb -0.12 -1.39 0.07 0.00 0.03 0.00 0.00 46.19 44.78 1ai5 s LEU 553 CO 0.01 0.12 0.02 -1.00 0.23 0.00 0.00 176.35 175.73 1ai5 s HIS 554 N -1.65 1.93 0.03 0.29 3.76 -1.26 -5.12 115.29 113.27 1ai5 s HIS 554 Ca 0.22 -1.58 0.02 0.00 -0.15 0.00 0.00 55.06 53.57 1ai5 s HIS 554 Cb -0.08 -1.54 -0.02 0.00 1.11 0.00 0.00 32.58 32.04 1ai5 s HIS 554 CO 0.12 -0.76 -0.06 0.08 -0.85 0.00 0.00 174.74 173.26 1ai5 s VAL 555 N 1.55 0.42 -0.07 -0.90 1.01 -1.26 -5.14 120.40 116.01 1ai5 s VAL 555 Ca 0.00 -0.80 0.02 0.00 0.00 0.00 0.00 61.98 61.20 1ai5 s VAL 555 Cb -0.18 -0.47 0.01 0.00 0.00 0.00 0.00 36.38 35.74 1ai5 s VAL 555 CO -0.11 -0.26 -0.12 -1.58 0.00 0.00 0.00 175.10 173.02 1ai5 s GLN 556 N -1.14 1.71 0.00 2.72 -0.44 -1.26 -5.36 119.66 115.89 1ai5 s GLN 556 Ca -0.07 -0.41 0.07 0.00 -2.50 0.00 0.00 55.36 52.45 1ai5 s GLN 556 Cb -0.08 -1.45 0.39 0.00 -1.64 0.00 0.00 33.01 30.24 1ai5 s GLN 556 CO 0.00 -0.01 0.86 -2.13 0.50 0.00 0.00 175.29 174.51