#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sa0 n GLU 3 N 0.00 0.68 -2.99 5.56 4.71 -1.24 -4.47 120.64 122.89 1sa0 n GLU 3 Ca 0.00 -0.28 0.04 0.00 -0.01 0.00 0.00 57.16 56.92 1sa0 n GLU 3 Cb 0.00 -0.05 0.00 0.00 -1.01 0.00 0.00 31.44 30.38 1sa0 n GLU 3 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1sa0 s ILE 5 N 2.59 4.85 -0.13 0.00 1.01 -1.07 -4.72 121.20 123.72 1sa0 s ILE 5 Ca 0.24 1.72 -0.07 0.00 0.00 0.00 0.00 60.65 62.55 1sa0 s ILE 5 Cb 0.01 -4.16 -0.04 0.00 0.01 0.00 0.00 42.46 38.28 1sa0 s ILE 5 CO -0.20 0.27 0.11 -0.44 0.00 0.00 0.00 174.94 174.68 1sa0 s SER 6 N 0.51 6.14 -0.07 3.58 0.01 -0.18 -0.76 113.70 122.94 1sa0 s SER 6 Ca 0.43 0.36 0.02 0.00 1.31 0.00 0.00 55.95 58.07 1sa0 s SER 6 Cb -0.20 -1.98 0.01 0.00 0.21 0.00 0.00 66.02 64.06 1sa0 s SER 6 CO 0.23 0.35 -0.13 -0.63 0.41 0.00 0.00 173.24 173.47 1sa0 s ILE 7 N -0.70 1.22 -0.24 1.44 1.01 0.32 -1.41 121.20 122.84 1sa0 s ILE 7 Ca 0.13 -0.53 0.02 0.00 0.00 0.00 0.00 60.65 60.26 1sa0 s ILE 7 Cb -0.12 -1.10 0.06 0.00 0.01 0.00 0.00 42.46 41.31 1sa0 s ILE 7 CO 0.03 0.37 -0.08 -1.00 0.00 0.00 0.00 174.94 174.25 1sa0 s HIS 8 N 0.60 2.73 -0.15 3.97 3.76 0.26 -0.65 115.29 125.82 1sa0 s HIS 8 Ca -0.14 -1.94 -0.02 0.00 -0.15 0.00 0.00 55.06 52.80 1sa0 s HIS 8 Cb -0.16 -1.73 -0.02 0.00 1.11 0.00 0.00 32.58 31.79 1sa0 s HIS 8 CO 0.04 -0.81 -0.07 0.54 -0.85 0.00 0.00 174.74 173.59 1sa0 s VAL 9 N 1.28 3.54 0.28 -0.90 0.11 -0.45 -1.49 120.40 122.77 1sa0 s VAL 9 Ca -0.06 -0.48 0.00 0.00 -2.93 0.00 0.00 61.98 58.50 1sa0 s VAL 9 Cb -0.19 -2.53 0.00 0.00 -1.53 0.00 0.00 36.38 32.13 1sa0 s VAL 9 CO -0.06 0.50 0.00 0.61 -3.33 0.00 0.00 175.10 172.82 1sa0 n GLY 10 N 3.58 -4.21 0.00 6.54 0.00 0.11 -3.70 105.19 107.51 1sa0 n GLY 10 Ca -0.18 -0.75 0.00 0.00 0.00 0.00 0.00 46.02 45.09 1sa0 n GLY 10 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1sa0 n GLN 11 N -0.40 0.00 0.04 1.61 7.27 -1.26 0.18 117.38 124.82 1sa0 n GLN 11 Ca 0.00 0.00 -0.12 0.00 0.07 0.00 0.00 57.00 56.95 1sa0 n GLN 11 Cb 0.00 0.00 -0.05 0.00 2.41 0.00 0.00 30.24 32.60 1sa0 n GLN 11 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1sa0 h ALA 12 N 0.00 -0.50 -0.29 1.69 0.00 -1.97 0.29 119.26 118.48 1sa0 h ALA 12 Ca 0.00 -0.01 0.06 0.00 0.00 0.00 0.00 54.91 54.96 1sa0 h ALA 12 Cb 0.00 0.63 -0.08 0.00 0.00 0.00 0.00 17.79 18.34 1sa0 h ALA 12 CO 0.00 -0.86 -0.38 0.78 0.00 0.00 0.00 179.25 178.79 1sa0 h GLY 13 N -0.48 -0.50 0.32 0.00 0.00 0.18 -0.47 103.07 102.12 1sa0 h GLY 13 Ca 0.07 0.48 -0.01 0.00 0.00 0.00 0.00 47.33 47.88 1sa0 h GLY 13 CO -0.31 -0.21 -0.38 -2.08 0.00 0.00 0.00 176.54 173.56 1sa0 h VAL 14 N -0.36 0.00 -0.56 4.60 2.07 -0.98 -1.92 116.25 119.10 1sa0 h VAL 14 Ca 0.12 0.00 0.09 0.00 0.82 0.00 0.00 66.70 67.74 1sa0 h VAL 14 Cb 0.58 0.00 -0.03 0.00 -1.52 0.00 0.00 31.29 30.32 1sa0 h VAL 14 CO -0.49 0.00 0.38 1.56 0.02 0.00 0.00 177.57 179.04 1sa0 h GLN 15 N -0.71 0.36 -0.04 1.57 4.20 -0.28 0.21 115.11 120.43 1sa0 h GLN 15 Ca -0.04 -0.02 -0.01 0.00 0.06 0.00 0.00 58.65 58.64 1sa0 h GLN 15 Cb 0.63 -0.08 -0.00 0.00 0.30 0.00 0.00 27.48 28.33 1sa0 h GLN 15 CO -0.08 0.24 0.00 0.82 -0.67 0.00 0.00 178.83 179.14 1sa0 h ILE 16 N 0.37 1.24 -0.23 2.54 5.03 -0.83 -2.76 117.51 122.88 1sa0 h ILE 16 Ca 0.26 -0.73 -0.08 0.00 -0.12 0.00 0.00 64.86 64.19 1sa0 h ILE 16 Cb 0.52 1.66 -0.01 0.00 -3.03 0.00 0.00 36.82 35.96 1sa0 h ILE 16 CO -0.07 0.20 -0.19 1.23 -0.68 0.00 0.00 178.15 178.65 1sa0 h GLY 17 N -0.22 0.43 1.11 5.37 0.00 -0.44 -1.15 103.07 108.17 1sa0 h GLY 17 Ca 0.01 -0.31 0.09 0.00 0.00 0.00 0.00 47.33 47.12 1sa0 h GLY 17 CO 0.00 0.29 0.38 -0.57 0.00 0.00 0.00 176.54 176.64 1sa0 h ASN 18 N 0.37 0.35 0.69 0.19 -0.73 -0.50 0.38 115.58 116.33 1sa0 h ASN 18 Ca 0.06 0.01 -0.11 0.00 1.87 0.00 0.00 56.30 58.13 1sa0 h ASN 18 Cb 0.54 -0.07 -0.02 0.00 0.27 0.00 0.00 38.32 39.04 1sa0 h ASN 18 CO 0.04 0.22 -1.39 0.00 -0.37 0.00 0.00 177.43 175.92 1sa0 n ALA 19 N -2.52 2.17 1.03 1.57 0.00 -0.54 -3.45 120.51 118.77 1sa0 n ALA 19 Ca 0.09 -0.48 0.11 0.00 0.00 0.00 0.00 53.44 53.16 1sa0 n ALA 19 Cb 0.35 -0.95 0.12 0.00 0.00 0.00 0.00 19.45 18.97 1sa0 n ALA 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1sa0 h TRP 21 N 0.31 0.00 0.01 0.00 4.06 -0.39 -2.49 115.95 117.45 1sa0 h TRP 21 Ca 0.00 0.00 -0.24 0.00 2.06 0.00 0.00 58.89 60.71 1sa0 h TRP 21 Cb 0.52 0.00 -0.03 0.00 -1.00 0.00 0.00 29.16 28.65 1sa0 h TRP 21 CO 0.00 0.05 -1.22 1.05 -3.56 0.00 0.00 178.44 174.76 1sa0 h GLU 22 N 0.00 0.01 0.01 0.49 4.11 -1.58 -2.26 114.58 115.36 1sa0 h GLU 22 Ca -0.01 -0.02 -0.19 0.00 0.07 0.00 0.00 59.36 59.21 1sa0 h GLU 22 Cb 1.04 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.28 1sa0 h GLU 22 CO 0.01 0.87 -0.89 1.25 0.07 0.00 0.00 179.01 180.32 1sa0 h LEU 23 N 0.00 0.06 0.83 3.06 5.85 -1.55 -2.52 115.31 121.04 1sa0 h LEU 23 Ca -0.10 -0.05 -0.04 0.00 0.84 0.00 0.00 57.88 58.53 1sa0 h LEU 23 Cb 1.85 -0.02 0.01 0.00 0.37 0.00 0.00 40.66 42.87 1sa0 h LEU 23 CO 0.12 0.91 -0.40 1.88 -0.34 0.00 0.00 178.44 180.61 1sa0 h TYR 24 N 0.02 -1.04 -0.69 1.25 0.99 -1.42 -0.04 116.97 116.05 1sa0 h TYR 24 Ca -0.02 -0.02 0.14 0.00 2.00 0.00 0.00 58.73 60.83 1sa0 h TYR 24 Cb 1.55 0.34 -0.13 0.00 1.00 0.00 0.00 36.73 39.50 1sa0 h TYR 24 CO 0.01 -0.64 -0.14 0.00 -0.00 0.00 0.00 178.16 177.39 1sa0 h LEU 26 N 0.02 0.82 -0.55 0.00 4.07 -1.25 0.84 115.31 119.25 1sa0 h LEU 26 Ca 0.34 -0.08 -0.06 0.00 0.08 0.00 0.00 57.88 58.16 1sa0 h LEU 26 Cb 0.53 -0.21 -0.02 0.00 1.08 0.00 0.00 40.66 42.04 1sa0 h LEU 26 CO -0.70 0.69 0.13 -0.08 -1.08 0.00 0.00 178.44 177.40 1sa0 h GLU 27 N 0.91 0.89 -0.48 1.13 4.81 0.13 -3.07 114.58 118.89 1sa0 h GLU 27 Ca 0.22 -0.22 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 1sa0 h GLU 27 Cb 0.09 -0.11 0.00 0.00 0.63 0.00 0.00 28.75 29.35 1sa0 h GLU 27 CO -0.03 0.84 0.00 0.72 -0.73 0.00 0.00 179.01 179.81 1sa0 n HIS 28 N -4.40 0.63 -3.27 0.92 8.25 -0.34 -5.01 115.22 112.00 1sa0 n HIS 28 Ca 0.02 -0.32 -0.10 0.00 -0.26 0.00 0.00 57.72 57.07 1sa0 n HIS 28 Cb 0.24 -0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.35 1sa0 n HIS 28 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1sa0 n GLY 29 N 1.54 -1.21 2.98 -1.41 0.00 0.29 -4.99 105.19 102.39 1sa0 n GLY 29 Ca 0.21 0.61 -0.31 0.00 0.00 0.00 0.00 46.02 46.53 1sa0 n GLY 29 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1sa0 s ILE 30 N -2.90 1.85 0.21 -0.61 1.01 -0.74 -4.38 121.20 115.65 1sa0 s ILE 30 Ca 0.04 -1.68 -0.32 0.00 0.00 0.00 0.00 60.65 58.69 1sa0 s ILE 30 Cb -0.01 -2.17 -0.12 0.00 0.01 0.00 0.00 42.46 40.17 1sa0 s ILE 30 CO 0.80 -0.28 1.73 0.00 0.00 0.00 0.00 174.94 177.18 1sa0 n GLN 31 N 4.50 2.78 0.00 2.79 6.02 -1.24 -4.72 117.38 127.52 1sa0 n GLN 31 Ca -0.07 1.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.92 1sa0 n GLN 31 Cb 0.43 -2.85 0.00 0.00 1.02 0.00 0.00 30.24 28.83 1sa0 n GLN 31 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 177.06 173.75 1sa0 n PRO 32 N 3.98 0.00 -0.03 -1.09 -0.01 -1.26 -1.51 135.00 135.08 1sa0 n PRO 32 Ca 0.16 0.11 -0.01 0.00 -0.01 0.00 0.00 63.50 63.75 1sa0 n PRO 32 Cb 0.35 -0.19 -0.01 0.00 -0.01 0.00 0.00 33.50 33.64 1sa0 n PRO 32 CO 0.00 0.00 0.00 -0.40 -0.01 0.00 0.00 175.50 175.09 1sa0 n ASP 33 N -1.05 -0.08 0.00 2.55 5.75 -1.26 -4.15 116.55 118.31 1sa0 n ASP 33 Ca 0.00 0.41 0.00 0.00 -0.01 0.00 0.00 54.79 55.19 1sa0 n ASP 33 Cb 0.00 -0.15 0.00 0.00 -1.03 0.00 0.00 41.12 39.94 1sa0 n ASP 33 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1sa0 n GLY 34 N -1.02 -1.29 3.86 6.12 0.00 -0.57 -3.51 105.19 108.78 1sa0 n GLY 34 Ca 0.00 0.35 -0.22 0.00 0.00 0.00 0.00 46.02 46.16 1sa0 n GLY 34 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1sa0 s GLN 35 N -0.27 2.47 -0.12 1.61 1.03 -1.26 -2.33 119.66 120.78 1sa0 s GLN 35 Ca 0.00 -1.62 -0.05 0.00 0.04 0.00 0.00 55.36 53.74 1sa0 s GLN 35 Cb 0.00 -2.31 -0.04 0.00 0.03 0.00 0.00 33.01 30.69 1sa0 s GLN 35 CO 0.00 -0.23 0.06 0.00 -2.54 0.00 0.00 175.29 172.58 1sa0 s MET 36 N -4.12 3.41 0.00 9.60 0.23 -1.26 -3.64 119.30 123.51 1sa0 s MET 36 Ca 0.46 -0.31 -0.05 0.00 -1.03 0.00 0.00 55.69 54.77 1sa0 s MET 36 Cb -0.02 -3.03 -0.21 0.00 -1.53 0.00 0.00 34.83 30.04 1sa0 s MET 36 CO 0.27 0.60 3.15 -2.30 -2.03 0.00 0.00 175.02 174.70 1sa0 n PRO 37 N 2.51 1.70 0.00 3.16 -0.02 -1.26 -5.07 135.00 136.01 1sa0 n PRO 37 Ca -0.18 -0.78 0.00 0.00 -2.02 0.00 0.00 63.50 60.51 1sa0 n PRO 37 Cb 0.54 -1.82 0.00 0.00 -0.02 0.00 0.00 33.50 32.19 1sa0 n PRO 37 CO 0.00 0.00 0.00 -3.47 1.98 0.00 0.00 175.50 174.01 1sa0 n ASP 47 N 2.39 0.00 0.00 2.55 4.64 -1.26 -5.26 116.55 119.61 1sa0 n ASP 47 Ca 0.34 0.41 0.00 0.00 -1.38 0.00 0.00 54.79 54.15 1sa0 n ASP 47 Cb 0.79 0.00 0.00 0.00 -1.04 0.00 0.00 41.12 40.87 1sa0 n ASP 47 CO 0.00 0.00 0.00 -1.20 -0.82 0.00 0.00 177.20 175.18 1sa0 n SER 48 N -0.43 0.00 -1.27 1.67 7.64 -1.26 -2.93 113.62 117.04 1sa0 n SER 48 Ca 0.00 0.00 0.11 0.00 1.01 0.00 0.00 58.87 59.99 1sa0 n SER 48 Cb 0.00 0.00 0.30 0.00 -1.01 0.00 0.00 64.21 63.50 1sa0 n SER 48 CO 0.00 0.00 0.00 2.22 -3.01 0.00 0.00 175.04 174.25 1sa0 n PHE 49 N 0.00 0.94 0.32 1.43 1.16 -1.08 -3.89 117.46 116.33 1sa0 n PHE 49 Ca 0.00 -0.46 0.15 0.00 -1.87 0.00 0.00 57.45 55.27 1sa0 n PHE 49 Cb 0.00 -0.02 0.59 0.00 -1.61 0.00 0.00 39.48 38.44 1sa0 n PHE 49 CO 0.00 0.00 0.00 -0.91 -1.87 0.00 0.00 176.76 173.98 1sa0 h ASN 50 N 3.95 0.00 -0.85 5.98 -0.26 -1.76 -2.80 115.58 119.84 1sa0 h ASN 50 Ca 0.00 0.00 0.22 0.00 -0.56 0.00 0.00 56.30 55.96 1sa0 h ASN 50 Cb 0.94 0.00 -0.13 0.00 -1.06 0.00 0.00 38.32 38.07 1sa0 h ASN 50 CO 0.02 0.00 0.25 0.71 -1.06 0.00 0.00 177.43 177.35 1sa0 h THR 51 N 0.00 0.39 0.00 2.81 1.35 -1.78 -3.14 112.91 112.54 1sa0 h THR 51 Ca 0.00 -0.09 0.00 0.00 -0.55 0.00 0.00 66.41 65.77 1sa0 h THR 51 Cb 0.52 0.11 0.00 0.00 -1.73 0.00 0.00 68.15 67.05 1sa0 h THR 51 CO 0.00 0.05 -1.14 0.49 -0.25 0.00 0.00 175.52 174.67 1sa0 n PHE 52 N -5.18 0.00 -4.42 4.73 3.01 -1.14 -2.76 117.46 111.70 1sa0 n PHE 52 Ca 0.20 0.00 -0.25 0.00 1.01 0.00 0.00 57.45 58.41 1sa0 n PHE 52 Cb 0.63 -0.16 -0.11 0.00 -0.01 0.00 0.00 39.48 39.83 1sa0 n PHE 52 CO 0.00 0.00 0.00 -0.06 1.01 0.00 0.00 176.76 177.71 1sa0 s PHE 53 N -2.51 2.21 -0.28 1.38 0.40 -1.07 -1.97 117.98 116.14 1sa0 s PHE 53 Ca -0.01 -0.37 -0.00 0.00 -0.60 0.00 0.00 56.93 55.95 1sa0 s PHE 53 Cb 0.08 -1.04 0.05 0.00 0.51 0.00 0.00 43.02 42.62 1sa0 s PHE 53 CO 0.47 0.55 -0.05 -1.54 0.70 0.00 0.00 175.22 175.35 1sa0 s SER 54 N -2.99 4.64 -0.74 1.36 1.04 -0.77 -4.51 113.70 111.72 1sa0 s SER 54 Ca 0.23 -1.25 -0.25 0.00 0.48 0.00 0.00 55.95 55.17 1sa0 s SER 54 Cb -0.06 -1.65 -0.24 0.00 0.10 0.00 0.00 66.02 64.16 1sa0 s SER 54 CO 0.11 -0.21 1.88 -1.84 0.98 0.00 0.00 173.24 174.15 1sa0 n GLU 55 N 4.57 0.06 -3.18 4.02 0.00 -1.26 -4.42 120.64 120.43 1sa0 n GLU 55 Ca -0.14 -1.38 -0.36 0.00 0.00 0.00 0.00 57.16 55.29 1sa0 n GLU 55 Cb 0.44 -3.33 -0.06 0.00 0.00 0.00 0.00 31.44 28.48 1sa0 n GLU 55 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.13 177.05 1sa0 s THR 56 N 13.53 4.66 0.14 3.84 -1.32 -1.23 -4.89 115.64 130.37 1sa0 s THR 56 Ca 0.71 1.13 0.00 0.00 -1.21 0.00 0.00 61.69 62.31 1sa0 s THR 56 Cb -0.00 -3.81 0.00 0.00 -1.51 0.00 0.00 72.50 67.18 1sa0 s THR 56 CO 0.20 0.19 0.00 0.61 -2.21 0.00 0.00 174.62 173.42 1sa0 n GLY 57 N 0.67 -1.68 2.49 6.08 0.00 -1.26 -3.20 105.19 108.30 1sa0 n GLY 57 Ca -0.03 -1.20 -0.35 0.00 0.00 0.00 0.00 46.02 44.44 1sa0 n GLY 57 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sa0 n ALA 58 N -1.09 6.22 -0.62 4.61 0.00 -1.26 -4.64 120.51 123.74 1sa0 n ALA 58 Ca 0.00 -3.75 0.00 0.00 0.00 0.00 0.00 53.44 49.70 1sa0 n ALA 58 Cb 0.27 -1.66 0.00 0.00 0.00 0.00 0.00 19.45 18.07 1sa0 n ALA 58 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1sa0 n GLY 59 N -0.76 -1.88 3.14 0.00 0.00 -1.26 -5.17 105.19 99.26 1sa0 n GLY 59 Ca 0.57 0.53 -0.36 0.00 0.00 0.00 0.00 46.02 46.77 1sa0 n GLY 59 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1sa0 n LYS 60 N -1.51 -0.03 -0.00 1.61 4.81 -1.19 -4.30 118.16 117.54 1sa0 n LYS 60 Ca 0.00 0.00 0.01 0.00 -0.87 0.00 0.00 58.31 57.45 1sa0 n LYS 60 Cb 0.00 -1.23 -0.02 0.00 0.02 0.00 0.00 35.03 33.80 1sa0 n LYS 60 CO 0.00 0.00 0.00 0.72 1.17 0.00 0.00 177.40 179.29 1sa0 n HIS 61 N -2.59 0.00 -0.19 5.64 8.25 -0.98 -3.52 115.22 121.82 1sa0 n HIS 61 Ca 0.02 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.48 1sa0 n HIS 61 Cb 0.54 -0.06 0.00 0.00 1.12 0.00 0.00 29.99 31.59 1sa0 n HIS 61 CO 0.00 0.00 0.00 1.55 0.64 0.00 0.00 176.34 178.53 1sa0 n VAL 62 N -1.62 0.00 -1.23 1.59 3.14 -1.26 -3.33 118.33 115.63 1sa0 n VAL 62 Ca -0.01 0.00 -0.31 0.00 -2.96 0.00 0.00 64.34 61.07 1sa0 n VAL 62 Cb 0.09 -0.01 0.11 0.00 -1.06 0.00 0.00 33.84 32.98 1sa0 n VAL 62 CO 0.00 0.00 0.00 -2.84 -6.46 0.00 0.00 176.83 167.53 1sa0 s PRO 63 N -0.11 1.85 -0.98 1.45 0.02 -1.26 -1.84 135.00 134.13 1sa0 s PRO 63 Ca 0.00 1.04 -0.01 0.00 0.02 0.00 0.00 61.00 62.05 1sa0 s PRO 63 Cb 0.00 -1.86 0.30 0.00 0.02 0.00 0.00 34.50 32.96 1sa0 s PRO 63 CO 0.00 -1.89 1.40 0.54 -0.33 0.00 0.00 177.00 176.72 1sa0 n ARG 64 N -3.68 4.29 -4.27 5.54 1.74 -0.83 -4.74 116.66 114.71 1sa0 n ARG 64 Ca 0.08 -4.61 -0.15 0.00 -0.77 0.00 0.00 57.85 52.40 1sa0 n ARG 64 Cb 0.54 -2.45 -0.10 0.00 -1.02 0.00 0.00 32.46 29.43 1sa0 n ARG 64 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1sa0 s ALA 65 N -3.05 1.53 -0.01 7.54 0.00 -1.26 -1.01 121.76 125.49 1sa0 s ALA 65 Ca 0.35 -1.62 0.00 0.00 0.00 0.00 0.00 51.96 50.69 1sa0 s ALA 65 Cb 0.10 0.38 0.02 0.00 0.00 0.00 0.00 23.12 23.62 1sa0 s ALA 65 CO 0.04 -0.23 0.02 0.14 0.00 0.00 0.00 175.76 175.72 1sa0 s VAL 66 N -3.48 -0.01 -0.11 0.00 -7.23 -0.50 -4.79 120.40 104.28 1sa0 s VAL 66 Ca 0.23 0.12 0.02 0.00 -1.81 0.00 0.00 61.98 60.54 1sa0 s VAL 66 Cb 0.05 -0.08 -0.01 0.00 0.56 0.00 0.00 36.38 36.90 1sa0 s VAL 66 CO 0.04 0.06 -0.18 -0.36 -0.31 0.00 0.00 175.10 174.36 1sa0 s PHE 67 N 0.67 2.69 -0.03 2.82 0.40 0.62 -0.57 117.98 124.59 1sa0 s PHE 67 Ca -0.06 -0.72 0.01 0.00 -0.60 0.00 0.00 56.93 55.56 1sa0 s PHE 67 Cb -0.08 -1.76 0.02 0.00 0.51 0.00 0.00 43.02 41.71 1sa0 s PHE 67 CO -0.02 -0.23 -0.02 0.14 0.70 0.00 0.00 175.22 175.79 1sa0 s VAL 68 N 0.19 0.29 0.05 -0.44 -7.23 -0.56 -0.33 120.40 112.38 1sa0 s VAL 68 Ca -0.10 -0.02 -0.05 0.00 -1.81 0.00 0.00 61.98 59.99 1sa0 s VAL 68 Cb -0.16 -0.34 -0.01 0.00 0.56 0.00 0.00 36.38 36.42 1sa0 s VAL 68 CO 0.06 0.15 0.09 -0.62 -0.31 0.00 0.00 175.10 174.48 1sa0 s ASP 69 N 0.77 0.22 0.00 4.85 3.68 -1.10 0.08 116.67 125.17 1sa0 s ASP 69 Ca -0.08 -0.65 0.28 0.00 2.13 0.00 0.00 52.55 54.22 1sa0 s ASP 69 Cb -0.12 0.25 1.01 0.00 -1.45 0.00 0.00 42.92 42.61 1sa0 s ASP 69 CO -0.01 -0.58 1.72 0.18 0.13 0.00 0.00 175.17 176.61 1sa0 n LEU 70 N 0.44 1.01 -4.25 -1.34 4.32 -1.26 -1.76 117.00 114.16 1sa0 n LEU 70 Ca -0.17 -0.27 -0.17 0.00 -0.02 0.00 0.00 56.01 55.38 1sa0 n LEU 70 Cb 0.60 -0.09 -0.11 0.00 -1.62 0.00 0.00 43.42 42.20 1sa0 n LEU 70 CO 0.24 0.18 -0.44 -1.83 -1.22 0.00 0.00 177.39 174.32 1sa0 s GLU 71 N -2.31 1.04 0.00 3.23 -1.05 -1.26 -2.42 118.70 115.93 1sa0 s GLU 71 Ca 0.31 -1.29 0.00 0.00 -0.15 0.00 0.00 54.97 53.84 1sa0 s GLU 71 Cb 0.20 -0.85 0.00 0.00 -0.44 0.00 0.00 34.13 33.04 1sa0 s GLU 71 CO 0.44 0.15 0.22 -2.30 0.95 0.00 0.00 175.26 174.72 1sa0 n PRO 72 N 0.36 0.00 0.00 -4.83 -0.02 -1.26 -4.30 135.00 124.95 1sa0 n PRO 72 Ca -0.14 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.34 1sa0 n PRO 72 Cb 0.58 -0.66 0.00 0.00 -0.02 0.00 0.00 33.50 33.40 1sa0 n PRO 72 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 1sa0 n THR 73 N -0.30 0.00 0.21 3.45 -1.04 -1.26 -1.55 114.28 113.79 1sa0 n THR 73 Ca 0.00 0.00 -0.15 0.00 -2.04 0.00 0.00 64.05 61.86 1sa0 n THR 73 Cb 0.00 0.00 -0.08 0.00 -1.82 0.00 0.00 70.33 68.43 1sa0 n THR 73 CO 0.00 0.00 0.00 0.58 -0.64 0.00 0.00 175.07 175.01 1sa0 h VAL 74 N 0.00 0.57 -0.46 12.58 2.07 -2.00 -2.63 116.25 126.38 1sa0 h VAL 74 Ca 0.00 0.00 -0.01 0.00 0.82 0.00 0.00 66.70 67.51 1sa0 h VAL 74 Cb 0.00 0.57 -0.02 0.00 -1.52 0.00 0.00 31.29 30.32 1sa0 h VAL 74 CO 0.00 0.00 0.24 0.40 0.02 0.00 0.00 177.57 178.23 1sa0 h ILE 75 N -0.52 1.15 -0.74 4.57 1.08 -1.57 -2.68 117.51 118.80 1sa0 h ILE 75 Ca -0.04 -0.38 0.01 0.00 -0.39 0.00 0.00 64.86 64.06 1sa0 h ILE 75 Cb 0.43 0.54 -0.04 0.00 -3.07 0.00 0.00 36.82 34.68 1sa0 h ILE 75 CO 0.04 0.16 0.49 0.44 -0.69 0.00 0.00 178.15 178.59 1sa0 h ASP 76 N 0.64 0.85 0.95 1.72 5.19 -1.60 -0.70 116.42 123.46 1sa0 h ASP 76 Ca 0.16 -0.02 -0.00 0.00 -0.62 0.00 0.00 57.03 56.55 1sa0 h ASP 76 Cb 0.03 -0.21 -0.00 0.00 0.18 0.00 0.00 39.33 39.33 1sa0 h ASP 76 CO -0.03 0.61 -0.02 -0.33 -3.12 0.00 0.00 179.24 176.36 1sa0 h GLU 77 N 1.00 0.00 0.06 3.56 3.07 -1.12 -2.91 114.58 118.24 1sa0 h GLU 77 Ca 0.27 0.00 -0.17 0.00 -0.50 0.00 0.00 59.36 58.96 1sa0 h GLU 77 Cb -0.11 0.00 0.02 0.00 -0.84 0.00 0.00 28.75 27.81 1sa0 h GLU 77 CO -0.06 0.02 -0.70 0.28 -1.40 0.00 0.00 179.01 177.15 1sa0 h VAL 78 N 0.00 1.46 0.00 3.13 2.07 -1.13 -2.36 116.25 119.42 1sa0 h VAL 78 Ca -0.00 -2.27 0.00 0.00 0.82 0.00 0.00 66.70 65.25 1sa0 h VAL 78 Cb 0.50 2.84 0.00 0.00 -1.52 0.00 0.00 31.29 33.11 1sa0 h VAL 78 CO 0.00 0.65 0.00 0.54 0.02 0.00 0.00 177.57 178.78 1sa0 n ARG 79 N -4.17 0.77 -0.00 1.57 1.74 -0.90 -3.91 116.66 111.76 1sa0 n ARG 79 Ca -0.12 0.00 -0.01 0.00 -0.77 0.00 0.00 57.85 56.95 1sa0 n ARG 79 Cb 0.74 -1.02 -0.00 0.00 -1.02 0.00 0.00 32.46 31.15 1sa0 n ARG 79 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 1sa0 n THR 80 N -0.47 0.47 -1.49 0.55 -1.04 -1.11 -4.87 114.28 106.32 1sa0 n THR 80 Ca 0.00 0.25 -0.34 0.00 -2.04 0.00 0.00 64.05 61.92 1sa0 n THR 80 Cb 0.01 -1.47 0.08 0.00 -1.82 0.00 0.00 70.33 67.13 1sa0 n THR 80 CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 1sa0 s GLY 81 N -3.49 2.30 0.42 3.41 0.00 -0.90 -4.73 107.32 104.33 1sa0 s GLY 81 Ca -0.05 0.81 -0.23 0.00 0.00 0.00 0.00 44.72 45.25 1sa0 s GLY 81 CO 0.07 1.20 0.75 -1.30 0.00 0.00 0.00 173.10 173.82 1sa0 n THR 82 N -2.68 2.13 0.00 0.90 -2.24 -1.26 -1.88 114.28 109.25 1sa0 n THR 82 Ca 0.13 -0.50 0.00 0.00 -2.27 0.00 0.00 64.05 61.41 1sa0 n THR 82 Cb 0.51 -0.80 0.00 0.00 -2.10 0.00 0.00 70.33 67.94 1sa0 n THR 82 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1sa0 n TYR 83 N -0.73 0.00 -0.11 4.78 0.53 -1.26 -4.96 117.16 115.40 1sa0 n TYR 83 Ca 0.11 0.00 -0.07 0.00 -1.02 0.00 0.00 57.90 56.92 1sa0 n TYR 83 Cb 0.39 0.00 0.01 0.00 -1.03 0.00 0.00 39.34 38.72 1sa0 n TYR 83 CO 0.00 0.00 0.00 -0.09 -1.02 0.00 0.00 176.86 175.75 1sa0 h ARG 84 N 2.81 0.36 -0.02 -0.72 2.43 -1.49 -2.32 114.38 115.43 1sa0 h ARG 84 Ca 0.00 -0.02 -0.16 0.00 -0.81 0.00 0.00 59.98 58.98 1sa0 h ARG 84 Cb 0.00 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.45 1sa0 h ARG 84 CO 0.00 0.24 -0.74 1.96 -1.51 0.00 0.00 179.97 179.92 1sa0 h GLN 85 N 0.37 0.12 -1.01 0.20 4.20 -1.87 -3.34 115.11 113.78 1sa0 h GLN 85 Ca 0.16 -0.11 0.23 0.00 0.06 0.00 0.00 58.65 59.00 1sa0 h GLN 85 Cb 0.08 0.03 -0.10 0.00 0.30 0.00 0.00 27.48 27.78 1sa0 h GLN 85 CO -0.12 0.80 0.63 1.25 -0.67 0.00 0.00 178.83 180.72 1sa0 h LEU 86 N 0.08 0.59-10.58 1.46 5.85 -1.45 -3.44 115.31 107.81 1sa0 h LEU 86 Ca -0.02 0.09 -0.48 0.00 0.84 0.00 0.00 57.88 58.31 1sa0 h LEU 86 Cb 1.31 -0.01 0.02 0.00 0.37 0.00 0.00 40.66 42.35 1sa0 h LEU 86 CO 0.11 0.16 -0.14 -0.36 -0.34 0.00 0.00 178.44 177.86 1sa0 s PHE 87 N -5.65 1.66 0.20 1.25 2.99 -1.23 -4.22 117.98 112.98 1sa0 s PHE 87 Ca -0.10 -0.68 -0.02 0.00 0.00 0.00 0.00 56.93 56.13 1sa0 s PHE 87 Cb 0.25 -2.21 -0.05 0.00 0.00 0.00 0.00 43.02 41.01 1sa0 s PHE 87 CO 0.80 -0.98 0.41 -1.01 -0.00 0.00 0.00 175.22 174.44 1sa0 s HIS 88 N -2.62 3.48 0.41 0.36 3.76 -1.26 -4.98 115.29 114.43 1sa0 s HIS 88 Ca 0.59 0.43 0.14 0.00 -0.15 0.00 0.00 55.06 56.07 1sa0 s HIS 88 Cb -0.06 -1.92 0.88 0.00 1.11 0.00 0.00 32.58 32.58 1sa0 s HIS 88 CO 0.37 0.36 1.91 -1.00 -0.85 0.00 0.00 174.74 175.53 1sa0 h PRO 89 N 2.15 0.00 0.00 8.40 0.13 -1.95 -3.01 132.00 137.72 1sa0 h PRO 89 Ca -0.47 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1sa0 h PRO 89 Cb 1.18 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.31 1sa0 h PRO 89 CO 0.69 0.27 -0.01 1.05 -0.23 0.00 0.00 178.00 179.77 1sa0 h GLU 90 N 0.00 0.00 0.00 0.86 4.11 -2.01 -3.01 114.58 114.53 1sa0 h GLU 90 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1sa0 h GLU 90 Cb 0.49 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.74 1sa0 h GLU 90 CO 0.04 0.01 0.00 0.00 0.07 0.00 0.00 179.01 179.13 1sa0 n GLN 91 N -3.10 0.56 -3.55 1.06 10.64 -1.14 -4.37 117.38 117.48 1sa0 n GLN 91 Ca 0.03 0.02 -0.41 0.00 -1.83 0.00 0.00 57.00 54.81 1sa0 n GLN 91 Cb 0.49 -1.50 -0.07 0.00 -0.86 0.00 0.00 30.24 28.29 1sa0 n GLN 91 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 1sa0 s LEU 92 N -2.38 5.83 -0.10 2.61 1.43 -1.14 -0.27 118.68 124.66 1sa0 s LEU 92 Ca 0.31 -2.47 -0.11 0.00 -1.03 0.00 0.00 54.13 50.84 1sa0 s LEU 92 Cb 0.19 -2.01 -0.05 0.00 0.03 0.00 0.00 46.19 44.35 1sa0 s LEU 92 CO 0.39 -0.54 0.25 -0.63 0.23 0.00 0.00 176.35 176.04 1sa0 s ILE 93 N 0.52 5.31 0.08 -0.59 1.01 0.55 -4.99 121.20 123.09 1sa0 s ILE 93 Ca 0.13 0.47 0.02 0.00 0.00 0.00 0.00 60.65 61.27 1sa0 s ILE 93 Cb -0.20 -3.55 -0.04 0.00 0.01 0.00 0.00 42.46 38.69 1sa0 s ILE 93 CO -0.04 0.54 -0.08 0.28 0.00 0.00 0.00 174.94 175.65 1sa0 s THR 94 N -0.62 0.71 -0.07 2.92 -1.32 -1.26 -2.71 115.64 113.30 1sa0 s THR 94 Ca 0.17 -1.61 0.10 0.00 -1.21 0.00 0.00 61.69 59.14 1sa0 s THR 94 Cb -0.14 -1.29 0.16 0.00 -1.51 0.00 0.00 72.50 69.72 1sa0 s THR 94 CO 0.06 -0.65 1.07 0.61 -2.21 0.00 0.00 174.62 173.50 1sa0 n GLY 95 N 0.54 2.89 5.00 6.08 0.00 -0.73 -4.95 105.19 114.03 1sa0 n GLY 95 Ca -0.16 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.24 1sa0 n GLY 95 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1sa0 n LYS 96 N -0.80 0.00 -3.83 1.61 4.81 -1.08 -4.64 118.16 114.23 1sa0 n LYS 96 Ca 0.09 0.00 -0.36 0.00 -0.87 0.00 0.00 58.31 57.17 1sa0 n LYS 96 Cb 0.65 0.00 -0.08 0.00 0.02 0.00 0.00 35.03 35.63 1sa0 n LYS 96 CO 0.00 0.00 0.00 -2.00 1.17 0.00 0.00 177.40 176.57 1sa0 s GLU 97 N 0.00 3.90 0.72 1.64 2.56 -1.02 -4.71 118.70 121.79 1sa0 s GLU 97 Ca 0.00 -0.21 -0.12 0.00 0.00 0.00 0.00 54.97 54.63 1sa0 s GLU 97 Cb 0.00 -3.30 0.03 0.00 2.00 0.00 0.00 34.13 32.85 1sa0 s GLU 97 CO 0.00 0.45 1.09 0.34 -0.56 0.00 0.00 175.26 176.58 1sa0 s ASP 98 N -0.10 4.89 0.33 -1.70 -1.08 -1.24 -4.28 116.67 113.49 1sa0 s ASP 98 Ca 0.10 1.84 0.26 0.00 -0.52 0.00 0.00 52.55 54.23 1sa0 s ASP 98 Cb -0.11 -2.53 1.04 0.00 -1.46 0.00 0.00 42.92 39.86 1sa0 s ASP 98 CO 0.00 -1.78 1.78 0.00 0.52 0.00 0.00 175.17 175.70 1sa0 h ALA 99 N -0.65 1.00 0.00 3.66 0.00 -1.95 -3.47 119.26 117.85 1sa0 h ALA 99 Ca -0.45 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1sa0 h ALA 99 Cb 1.23 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1sa0 h ALA 99 CO 0.53 0.00 0.00 0.00 0.00 0.00 0.00 179.25 179.78 1sa0 n ALA 100 N -1.87 0.00 -0.10 0.00 0.00 -1.26 -3.27 120.51 114.02 1sa0 n ALA 100 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.46 1sa0 n ALA 100 Cb 0.28 -0.13 0.00 0.00 0.00 0.00 0.00 19.45 19.60 1sa0 n ALA 100 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1sa0 n ASN 101 N 0.00 -0.30 -3.65 0.00 3.02 -1.26 -4.96 115.26 108.10 1sa0 n ASN 101 Ca 0.00 0.00 -0.25 0.00 -0.03 0.00 0.00 54.58 54.30 1sa0 n ASN 101 Cb 0.00 -0.05 -0.17 0.00 -0.61 0.00 0.00 39.78 38.95 1sa0 n ASN 101 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1sa0 s ASN 102 N -2.05 2.07 0.06 6.41 4.22 -1.20 -4.49 114.94 119.97 1sa0 s ASN 102 Ca 0.00 -0.43 -0.03 0.00 -2.14 0.00 0.00 52.86 50.25 1sa0 s ASN 102 Cb 0.00 -0.28 0.08 0.00 1.28 0.00 0.00 41.25 42.34 1sa0 s ASN 102 CO 0.00 -0.31 0.39 0.00 -2.04 0.00 0.00 177.10 175.14 1sa0 n TYR 103 N 5.24 0.04 -0.35 1.54 9.36 -1.26 0.23 117.16 131.97 1sa0 n TYR 103 Ca -0.06 0.31 0.34 0.00 3.32 0.00 0.00 57.90 61.81 1sa0 n TYR 103 Cb 0.49 -0.62 0.71 0.00 -0.63 0.00 0.00 39.34 39.30 1sa0 n TYR 103 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1sa0 h ALA 104 N 0.42 3.01 0.00 2.98 0.00 -1.92 0.36 119.26 124.11 1sa0 h ALA 104 Ca 0.10 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 1sa0 h ALA 104 Cb 0.17 0.09 -0.00 0.00 0.00 0.00 0.00 17.79 18.04 1sa0 h ALA 104 CO -0.25 -1.39 -0.17 -0.09 0.00 0.00 0.00 179.25 177.35 1sa0 h ARG 105 N 0.06 0.00 -0.96 0.00 2.43 0.26 -2.90 114.38 113.28 1sa0 h ARG 105 Ca 0.60 0.00 0.06 0.00 -0.81 0.00 0.00 59.98 59.83 1sa0 h ARG 105 Cb 2.25 0.00 -0.06 0.00 -0.42 0.00 0.00 29.97 31.74 1sa0 h ARG 105 CO -0.07 0.65 0.62 0.78 -1.51 0.00 0.00 179.97 180.44 1sa0 h GLY 106 N -1.00 1.45 2.00 2.80 0.00 -1.02 -0.76 103.07 106.54 1sa0 h GLY 106 Ca -0.04 -0.46 -0.19 0.00 0.00 0.00 0.00 47.33 46.65 1sa0 h GLY 106 CO -0.02 0.35 -0.89 0.84 0.00 0.00 0.00 176.54 176.81 1sa0 h HIS 107 N 1.15 0.00 0.00 5.60 -0.00 -0.50 -3.16 115.15 118.24 1sa0 h HIS 107 Ca 0.41 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.78 1sa0 h HIS 107 Cb 0.12 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 27.53 1sa0 h HIS 107 CO -0.01 0.89 0.00 0.66 -0.00 0.00 0.00 177.93 179.47 1sa0 n TYR 108 N -3.38 0.00 0.00 5.26 4.02 -1.08 -4.61 117.16 117.38 1sa0 n TYR 108 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.89 1sa0 n TYR 108 Cb 0.88 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 40.20 1sa0 n TYR 108 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 176.86 178.26 1sa0 n THR 109 N -0.41 0.00 0.28 -0.72 -1.04 -1.05 -2.83 114.28 108.52 1sa0 n THR 109 Ca 0.00 1.27 0.13 0.00 -2.04 0.00 0.00 64.05 63.42 1sa0 n THR 109 Cb 0.00 -1.85 0.32 0.00 -1.82 0.00 0.00 70.33 66.98 1sa0 n THR 109 CO 0.00 0.00 0.00 -0.29 -0.64 0.00 0.00 175.07 174.14 1sa0 h ILE 110 N 0.00 0.00 0.10 12.58 6.09 -1.43 -3.38 117.51 131.47 1sa0 h ILE 110 Ca 0.00 -0.81 -0.00 0.00 -1.37 0.00 0.00 64.86 62.67 1sa0 h ILE 110 Cb 0.00 1.80 0.00 0.00 0.47 0.00 0.00 36.82 39.09 1sa0 h ILE 110 CO 0.00 0.00 -0.05 1.23 -3.07 0.00 0.00 178.15 176.26 1sa0 h GLY 111 N 3.57 -0.14 -0.12 8.18 0.00 -1.52 -3.32 103.07 109.72 1sa0 h GLY 111 Ca 0.00 0.05 0.03 0.00 0.00 0.00 0.00 47.33 47.42 1sa0 h GLY 111 CO 0.00 -0.05 0.00 1.17 0.00 0.00 0.00 176.54 177.66 1sa0 n LYS 112 N -2.76 -0.01 0.15 4.80 4.81 -1.13 0.12 118.16 124.13 1sa0 n LYS 112 Ca -0.02 0.18 0.03 0.00 -0.87 0.00 0.00 58.31 57.63 1sa0 n LYS 112 Cb 0.05 -0.28 0.42 0.00 0.02 0.00 0.00 35.03 35.24 1sa0 n LYS 112 CO 0.00 0.00 0.00 0.93 1.17 0.00 0.00 177.40 179.50 1sa0 h GLU 113 N 0.00 0.17 0.00 1.64 4.39 -1.76 -3.22 114.58 115.79 1sa0 h GLU 113 Ca 0.07 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.74 1sa0 h GLU 113 Cb 0.15 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 28.78 1sa0 h GLU 113 CO -0.11 0.32 -0.87 1.51 -1.16 0.00 0.00 179.01 178.69 1sa0 n ILE 114 N -4.29 0.00 -0.27 3.13 0.13 0.31 -4.67 119.36 113.70 1sa0 n ILE 114 Ca -0.01 -0.23 -0.02 0.00 -1.10 0.00 0.00 62.75 61.39 1sa0 n ILE 114 Cb 0.26 0.78 0.10 0.00 -0.84 0.00 0.00 39.64 39.94 1sa0 n ILE 114 CO 0.00 0.00 0.00 -0.29 2.80 0.00 0.00 176.55 179.06 1sa0 h ILE 115 N 0.00 1.06 -0.04 9.51 -0.00 -1.39 -2.17 117.51 124.49 1sa0 h ILE 115 Ca 0.00 -0.30 -0.07 0.00 -0.00 0.00 0.00 64.86 64.49 1sa0 h ILE 115 Cb 0.38 0.11 -0.01 0.00 -0.00 0.00 0.00 36.82 37.30 1sa0 h ILE 115 CO 0.00 0.16 -0.31 0.44 -0.00 0.00 0.00 178.15 178.44 1sa0 h ASP 116 N 0.88 0.06 0.74 2.19 3.32 -1.83 -0.09 116.42 121.69 1sa0 h ASP 116 Ca 0.32 -0.02 -0.21 0.00 0.02 0.00 0.00 57.03 57.13 1sa0 h ASP 116 Cb 0.09 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 39.61 1sa0 h ASP 116 CO -0.14 0.37 -0.98 0.25 -1.72 0.00 0.00 179.24 177.02 1sa0 h LEU 117 N 0.06 0.19 0.22 1.55 5.85 -1.72 -3.01 115.31 118.46 1sa0 h LEU 117 Ca 0.01 -0.18 -0.01 0.00 0.84 0.00 0.00 57.88 58.54 1sa0 h LEU 117 Cb 0.58 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.55 1sa0 h LEU 117 CO 0.04 1.06 -0.11 0.58 -0.34 0.00 0.00 178.44 179.68 1sa0 h VAL 118 N 0.06 0.20 -1.00 1.05 2.07 -1.15 -3.02 116.25 114.45 1sa0 h VAL 118 Ca -0.05 -0.88 0.36 0.00 0.82 0.00 0.00 66.70 66.95 1sa0 h VAL 118 Cb 1.67 0.34 -0.16 0.00 -1.52 0.00 0.00 31.29 31.63 1sa0 h VAL 118 CO 0.14 0.06 0.56 0.25 0.02 0.00 0.00 177.57 178.60 1sa0 h LEU 119 N -1.05 0.45 -0.17 2.57 5.85 -1.14 0.36 115.31 122.18 1sa0 h LEU 119 Ca -0.03 0.22 -0.23 0.00 0.84 0.00 0.00 57.88 58.68 1sa0 h LEU 119 Cb 0.32 0.18 0.01 0.00 0.37 0.00 0.00 40.66 41.54 1sa0 h LEU 119 CO 0.05 -0.24 -0.84 -0.78 -0.34 0.00 0.00 178.44 176.29 1sa0 h ASP 120 N 0.21 0.83 0.20 1.25 1.82 -1.63 -3.04 116.42 116.06 1sa0 h ASP 120 Ca 0.78 -0.58 -0.17 0.00 -0.39 0.00 0.00 57.03 56.67 1sa0 h ASP 120 Cb 1.88 -0.25 -0.01 0.00 0.68 0.00 0.00 39.33 41.64 1sa0 h ASP 120 CO -0.66 1.37 -0.65 0.03 -1.61 0.00 0.00 179.24 177.72 1sa0 h ARG 121 N 0.45 0.42 0.00 0.28 3.08 -0.18 -1.68 114.38 116.75 1sa0 h ARG 121 Ca -0.07 -0.31 -0.05 0.00 0.07 0.00 0.00 59.98 59.63 1sa0 h ARG 121 Cb 1.46 0.05 -0.01 0.00 0.08 0.00 0.00 29.97 31.56 1sa0 h ARG 121 CO 0.16 0.93 -0.22 -0.84 -1.07 0.00 0.00 179.97 178.93 1sa0 h ILE 122 N 0.31 0.62 0.00 2.04 3.07 -1.33 -0.25 117.51 121.97 1sa0 h ILE 122 Ca -0.01 -1.00 -0.01 0.00 1.55 0.00 0.00 64.86 65.38 1sa0 h ILE 122 Cb 1.20 1.66 -0.00 0.00 -0.27 0.00 0.00 36.82 39.40 1sa0 h ILE 122 CO 0.11 0.21 -0.05 -0.09 -1.05 0.00 0.00 178.15 177.28 1sa0 h ARG 123 N 0.00 0.00 0.00 0.16 9.65 -1.36 -2.11 114.38 120.72 1sa0 h ARG 123 Ca -0.00 0.00 -0.09 0.00 -1.10 0.00 0.00 59.98 58.79 1sa0 h ARG 123 Cb 0.64 0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 29.21 1sa0 h ARG 123 CO 0.03 0.05 -0.41 -0.22 2.80 0.00 0.00 179.97 182.22 1sa0 h LYS 124 N 0.00 0.00 0.19 0.20 3.64 -0.12 -2.85 116.57 117.63 1sa0 h LYS 124 Ca -0.00 0.00 -0.34 0.00 -1.27 0.00 0.00 60.65 59.04 1sa0 h LYS 124 Cb 1.00 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 32.83 1sa0 h LYS 124 CO 0.01 0.41 -1.64 -0.07 -2.27 0.00 0.00 179.45 175.89 1sa0 h LEU 125 N 0.00 0.62 -0.16 5.20 3.38 -1.25 -3.31 115.31 119.79 1sa0 h LEU 125 Ca -0.00 -0.84 0.00 0.00 0.09 0.00 0.00 57.88 57.13 1sa0 h LEU 125 Cb 1.14 -0.20 0.00 0.00 0.09 0.00 0.00 40.66 41.69 1sa0 h LEU 125 CO 0.05 1.70 0.00 0.00 0.09 0.00 0.00 178.44 180.28 1sa0 n ALA 126 N -2.79 1.75 0.17 1.53 0.00 -0.81 -3.07 120.51 117.30 1sa0 n ALA 126 Ca -0.21 -0.02 0.06 0.00 0.00 0.00 0.00 53.44 53.26 1sa0 n ALA 126 Cb 1.08 -1.30 0.18 0.00 0.00 0.00 0.00 19.45 19.41 1sa0 n ALA 126 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1sa0 h ASP 127 N 0.00 0.00 -2.42 0.00 3.45 -1.59 -3.24 116.42 112.62 1sa0 h ASP 127 Ca 0.00 0.00 -0.74 0.00 0.43 0.00 0.00 57.03 56.72 1sa0 h ASP 127 Cb 0.32 0.00 -0.32 0.00 -0.56 0.00 0.00 39.33 38.76 1sa0 h ASP 127 CO 0.00 0.37 0.43 0.00 -1.57 0.00 0.00 179.24 178.46 1sa0 n GLN 128 N -3.28 4.40 -3.27 3.56 10.64 -1.17 -4.85 117.38 123.40 1sa0 n GLN 128 Ca 0.02 -4.69 -0.06 0.00 -1.83 0.00 0.00 57.00 50.44 1sa0 n GLN 128 Cb 0.62 -2.41 -0.04 0.00 -0.86 0.00 0.00 30.24 27.55 1sa0 n GLN 128 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 1sa0 s THR 130 N 2.33 3.44 0.00 0.00 -4.23 -1.26 -3.64 115.64 112.29 1sa0 s THR 130 Ca 0.12 -0.22 0.00 0.00 -1.18 0.00 0.00 61.69 60.41 1sa0 s THR 130 Cb -0.11 -4.04 0.00 0.00 1.34 0.00 0.00 72.50 69.69 1sa0 s THR 130 CO -0.22 -0.99 0.00 0.61 -0.54 0.00 0.00 174.62 173.48 1sa0 n GLY 131 N 6.52 -0.40 3.66 3.99 0.00 -1.26 -4.79 105.19 112.91 1sa0 n GLY 131 Ca 0.34 -0.19 -0.30 0.00 0.00 0.00 0.00 46.02 45.86 1sa0 n GLY 131 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1sa0 s LEU 132 N -1.45 2.49 -0.14 0.99 2.96 -1.24 -3.65 118.68 118.65 1sa0 s LEU 132 Ca 0.00 1.96 -0.01 0.00 -0.22 0.00 0.00 54.13 55.87 1sa0 s LEU 132 Cb 0.00 -4.31 -0.08 0.00 0.50 0.00 0.00 46.19 42.29 1sa0 s LEU 132 CO 0.00 -3.09 -0.13 1.67 -1.32 0.00 0.00 176.35 173.47 1sa0 n GLN 133 N -4.22 0.33 -3.93 1.98 7.27 -1.23 -4.77 117.38 112.80 1sa0 n GLN 133 Ca 0.10 0.09 0.00 0.00 0.07 0.00 0.00 57.00 57.26 1sa0 n GLN 133 Cb 0.53 -1.21 0.00 0.00 2.41 0.00 0.00 30.24 31.97 1sa0 n GLN 133 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1sa0 n GLY 134 N 2.68 -2.16 3.35 1.69 0.00 -1.26 -3.23 105.19 106.26 1sa0 n GLY 134 Ca -0.25 -1.26 -0.31 0.00 0.00 0.00 0.00 46.02 44.20 1sa0 n GLY 134 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1sa0 s PHE 135 N -2.46 2.40 -0.29 1.61 0.40 -0.50 -2.61 117.98 116.52 1sa0 s PHE 135 Ca 0.00 -0.38 -0.09 0.00 -0.60 0.00 0.00 56.93 55.86 1sa0 s PHE 135 Cb 0.00 -1.50 -0.01 0.00 0.51 0.00 0.00 43.02 42.02 1sa0 s PHE 135 CO 0.00 0.05 0.13 -1.12 0.70 0.00 0.00 175.22 174.98 1sa0 s SER 136 N -0.80 5.47 -0.17 1.36 0.01 0.06 -1.26 113.70 118.38 1sa0 s SER 136 Ca 0.11 -0.42 -0.01 0.00 1.31 0.00 0.00 55.95 56.93 1sa0 s SER 136 Cb -0.10 -1.99 -0.01 0.00 0.21 0.00 0.00 66.02 64.13 1sa0 s SER 136 CO 0.00 -0.15 -0.10 -0.69 0.41 0.00 0.00 173.24 172.71 1sa0 s VAL 137 N 1.62 3.11 -0.17 3.43 1.01 0.05 -0.52 120.40 128.92 1sa0 s VAL 137 Ca 0.05 -0.62 -0.03 0.00 0.00 0.00 0.00 61.98 61.38 1sa0 s VAL 137 Cb -0.17 -2.34 -0.02 0.00 0.00 0.00 0.00 36.38 33.85 1sa0 s VAL 137 CO 0.06 0.49 -0.05 -0.36 0.00 0.00 0.00 175.10 175.24 1sa0 s PHE 138 N 0.80 2.96 0.06 5.22 0.40 0.18 -0.66 117.98 126.94 1sa0 s PHE 138 Ca -0.04 -0.56 -0.24 0.00 -0.60 0.00 0.00 56.93 55.48 1sa0 s PHE 138 Cb -0.15 -1.99 0.06 0.00 0.51 0.00 0.00 43.02 41.45 1sa0 s PHE 138 CO 0.01 -0.24 0.57 -3.38 0.70 0.00 0.00 175.22 172.88 1sa0 s HIS 139 N 0.77 -0.50 0.55 0.36 -3.43 -1.14 -1.34 115.29 110.56 1sa0 s HIS 139 Ca -0.02 0.57 -0.17 0.00 -0.80 0.00 0.00 55.06 54.64 1sa0 s HIS 139 Cb -0.15 0.41 -0.06 0.00 -1.43 0.00 0.00 32.58 31.36 1sa0 s HIS 139 CO 0.02 -0.69 1.04 -1.12 -2.00 0.00 0.00 174.74 171.98 1sa0 s SER 140 N -2.02 6.10 -0.09 7.38 0.01 -1.26 -2.12 113.70 121.70 1sa0 s SER 140 Ca -0.05 1.79 -0.02 0.00 1.31 0.00 0.00 55.95 58.98 1sa0 s SER 140 Cb -0.01 -2.53 -0.01 0.00 0.21 0.00 0.00 66.02 63.68 1sa0 s SER 140 CO -0.02 -0.95 0.10 -0.26 0.41 0.00 0.00 173.24 172.51 1sa0 h PHE 141 N 0.80 -0.08 -2.21 2.43 0.05 -1.63 -3.31 116.94 112.99 1sa0 h PHE 141 Ca -0.47 -0.00 -0.45 0.00 3.82 0.00 0.00 57.97 60.86 1sa0 h PHE 141 Cb 1.21 0.02 0.06 0.00 2.00 0.00 0.00 35.95 39.24 1sa0 h PHE 141 CO 0.59 -0.05 0.00 0.20 -0.18 0.00 0.00 178.31 178.88 1sa0 s GLY 142 N -3.41 1.80 0.00 -1.45 0.00 -1.26 -3.56 107.32 99.43 1sa0 s GLY 142 Ca -0.01 -1.54 0.00 0.00 0.00 0.00 0.00 44.72 43.16 1sa0 s GLY 142 CO 0.04 -1.15 0.00 0.61 0.00 0.00 0.00 173.10 172.59 1sa0 n GLY 143 N -2.49 3.02 0.00 0.20 0.00 -1.26 -4.66 105.19 100.00 1sa0 n GLY 143 Ca 0.11 -1.57 0.00 0.00 0.00 0.00 0.00 46.02 44.56 1sa0 n GLY 143 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sa0 n GLY 144 N 0.65 -2.91 0.20 -0.02 0.00 -1.26 -2.58 105.19 99.27 1sa0 n GLY 144 Ca 0.00 0.42 0.12 0.00 0.00 0.00 0.00 46.02 46.55 1sa0 n GLY 144 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1sa0 h THR 145 N 0.00 0.01 -0.99 2.61 1.35 -1.93 -2.76 112.91 111.19 1sa0 h THR 145 Ca 0.00 -1.02 0.06 0.00 -0.55 0.00 0.00 66.41 64.90 1sa0 h THR 145 Cb 0.00 1.93 -0.07 0.00 -1.73 0.00 0.00 68.15 68.29 1sa0 h THR 145 CO 0.00 0.01 0.64 1.23 -0.25 0.00 0.00 175.52 177.15 1sa0 h GLY 146 N 3.99 1.50 0.00 5.82 0.00 -1.81 -1.70 103.07 110.87 1sa0 h GLY 146 Ca -0.00 -0.47 -0.19 0.00 0.00 0.00 0.00 47.33 46.67 1sa0 h GLY 146 CO 0.00 0.35 -1.05 1.48 0.00 0.00 0.00 176.54 177.31 1sa0 h SER 147 N 1.17 0.00 0.00 0.19 4.64 -1.54 -3.36 113.55 114.65 1sa0 h SER 147 Ca 0.42 -0.54 0.00 0.00 -0.47 0.00 0.00 61.79 61.21 1sa0 h SER 147 Cb 0.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.24 1sa0 h SER 147 CO -0.16 1.38 0.00 0.61 -0.87 0.00 0.00 176.83 177.79 1sa0 n GLY 148 N 1.47 -2.37 0.28 -0.77 0.00 -1.04 -2.75 105.19 100.00 1sa0 n GLY 148 Ca -0.28 0.00 0.02 0.00 0.00 0.00 0.00 46.02 45.76 1sa0 n GLY 148 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1sa0 h PHE 149 N 0.00 0.67 -0.14 1.61 3.04 -1.29 -2.46 116.94 118.37 1sa0 h PHE 149 Ca 0.00 0.03 0.03 0.00 3.98 0.00 0.00 57.97 62.01 1sa0 h PHE 149 Cb 0.00 -0.19 -0.07 0.00 2.56 0.00 0.00 35.95 38.25 1sa0 h PHE 149 CO 0.13 0.24 -0.54 1.15 -2.02 0.00 0.00 178.31 177.27 1sa0 h THR 150 N 0.63 0.01 -0.74 4.41 2.02 -1.66 0.18 112.91 117.76 1sa0 h THR 150 Ca 0.36 0.00 0.16 0.00 0.77 0.00 0.00 66.41 67.71 1sa0 h THR 150 Cb 0.39 0.01 -0.13 0.00 -1.74 0.00 0.00 68.15 66.68 1sa0 h THR 150 CO -0.27 0.00 -0.04 -1.28 0.37 0.00 0.00 175.52 174.29 1sa0 h SER 151 N -0.57 -0.43 -0.50 4.18 0.87 -1.26 0.04 113.55 115.87 1sa0 h SER 151 Ca 0.04 0.20 -0.11 0.00 -1.23 0.00 0.00 61.79 60.69 1sa0 h SER 151 Cb 0.68 0.37 -0.02 0.00 -0.44 0.00 0.00 62.40 62.99 1sa0 h SER 151 CO -0.44 -0.20 -0.09 0.25 -0.53 0.00 0.00 176.83 175.82 1sa0 h LEU 152 N 0.07 0.97 0.61 2.23 5.85 -0.97 -2.69 115.31 121.38 1sa0 h LEU 152 Ca 0.39 -0.30 -0.03 0.00 0.84 0.00 0.00 57.88 58.78 1sa0 h LEU 152 Cb 0.67 -0.26 0.00 0.00 0.37 0.00 0.00 40.66 41.44 1sa0 h LEU 152 CO -0.68 1.07 -0.33 0.25 -0.34 0.00 0.00 178.44 178.41 1sa0 h LEU 153 N 0.87 -0.81 -0.96 2.25 6.46 0.77 -2.75 115.31 121.14 1sa0 h LEU 153 Ca 0.14 0.04 0.15 0.00 -0.12 0.00 0.00 57.88 58.09 1sa0 h LEU 153 Cb 0.63 0.23 -0.09 0.00 -0.73 0.00 0.00 40.66 40.70 1sa0 h LEU 153 CO 0.04 -0.54 0.58 0.24 -0.62 0.00 0.00 178.44 178.14 1sa0 h MET 154 N -0.87 0.81 -0.02 1.25 2.86 -1.06 0.34 114.93 118.25 1sa0 h MET 154 Ca -0.08 -0.05 0.02 0.00 -2.06 0.00 0.00 59.70 57.53 1sa0 h MET 154 Cb 0.69 -0.18 -0.02 0.00 0.06 0.00 0.00 31.60 32.15 1sa0 h MET 154 CO 0.11 0.54 -0.09 0.93 1.06 0.00 0.00 176.91 179.45 1sa0 h GLU 155 N 0.84 -0.14 0.00 1.72 5.08 -1.34 -1.63 114.58 119.10 1sa0 h GLU 155 Ca 0.51 0.01 -0.11 0.00 -1.00 0.00 0.00 59.36 58.77 1sa0 h GLU 155 Cb 0.64 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.91 1sa0 h GLU 155 CO -0.32 -0.10 -0.51 0.00 -1.00 0.00 0.00 179.01 177.09 1sa0 h ARG 156 N -0.15 0.00 -0.25 2.33 3.08 -1.02 -2.87 114.38 115.50 1sa0 h ARG 156 Ca 0.04 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 60.01 1sa0 h ARG 156 Cb 0.20 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.24 1sa0 h ARG 156 CO -0.11 0.51 -0.18 -0.07 -1.07 0.00 0.00 179.97 179.05 1sa0 h LEU 157 N 0.00 0.44 -1.35 3.04 3.38 0.00 -0.83 115.31 120.00 1sa0 h LEU 157 Ca -0.01 -0.13 -0.04 0.00 0.09 0.00 0.00 57.88 57.80 1sa0 h LEU 157 Cb 1.17 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.80 1sa0 h LEU 157 CO 0.07 0.64 -0.17 0.28 0.09 0.00 0.00 178.44 179.35 1sa0 h SER 158 N 0.41 0.00 0.04 -0.43 0.02 -1.08 0.02 113.55 112.53 1sa0 h SER 158 Ca 0.07 0.00 -0.07 0.00 -0.84 0.00 0.00 61.79 60.95 1sa0 h SER 158 Cb 0.56 0.00 0.01 0.00 0.14 0.00 0.00 62.40 63.10 1sa0 h SER 158 CO 0.04 0.17 -0.32 0.58 -1.14 0.00 0.00 176.83 176.16 1sa0 h VAL 159 N 0.00 1.63 0.00 2.27 2.07 -1.08 -3.36 116.25 117.78 1sa0 h VAL 159 Ca -0.00 -2.27 0.00 0.00 0.82 0.00 0.00 66.70 65.25 1sa0 h VAL 159 Cb 0.62 3.13 0.00 0.00 -1.52 0.00 0.00 31.29 33.52 1sa0 h VAL 159 CO 0.02 0.61 -0.13 0.44 0.02 0.00 0.00 177.57 178.54 1sa0 h ASP 160 N -0.65 0.00 -2.56 0.57 3.32 -1.27 -3.39 116.42 112.43 1sa0 h ASP 160 Ca -0.05 -0.01 -0.60 0.00 0.02 0.00 0.00 57.03 56.39 1sa0 h ASP 160 Cb 1.18 0.00 -0.39 0.00 0.22 0.00 0.00 39.33 40.34 1sa0 h ASP 160 CO 0.06 0.00 -0.84 -1.22 -1.72 0.00 0.00 179.24 175.52 1sa0 n TYR 161 N -2.89 0.59 0.00 4.55 4.02 -0.01 -5.05 117.16 118.37 1sa0 n TYR 161 Ca 0.04 -3.67 0.00 0.00 -0.01 0.00 0.00 57.90 54.26 1sa0 n TYR 161 Cb 0.51 -0.09 0.00 0.00 -0.02 0.00 0.00 39.34 39.75 1sa0 n TYR 161 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1sa0 n GLY 162 N 2.39 -3.34 0.00 2.72 0.00 -1.26 -4.01 105.19 101.70 1sa0 n GLY 162 Ca 0.26 0.65 0.00 0.00 0.00 0.00 0.00 46.02 46.93 1sa0 n GLY 162 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1sa0 n LYS 163 N -2.16 0.00 0.00 1.61 5.02 -1.26 -4.93 118.16 116.44 1sa0 n LYS 163 Ca 0.00 0.49 0.00 0.00 -2.02 0.00 0.00 58.31 56.78 1sa0 n LYS 163 Cb 0.00 -1.20 0.00 0.00 -0.02 0.00 0.00 35.03 33.81 1sa0 n LYS 163 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 1sa0 n LYS 164 N -1.98 0.00 -2.22 1.97 4.76 -1.26 -4.84 118.16 114.59 1sa0 n LYS 164 Ca 0.00 0.00 -0.33 0.00 -2.87 0.00 0.00 58.31 55.11 1sa0 n LYS 164 Cb 0.00 0.00 -0.01 0.00 -1.84 0.00 0.00 35.03 33.18 1sa0 n LYS 164 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 1sa0 s SER 165 N 0.00 6.09 -0.17 4.39 1.04 -1.20 -4.88 113.70 118.97 1sa0 s SER 165 Ca 0.00 1.78 0.01 0.00 0.48 0.00 0.00 55.95 58.21 1sa0 s SER 165 Cb 0.00 -2.53 0.02 0.00 0.10 0.00 0.00 66.02 63.61 1sa0 s SER 165 CO 0.00 -0.96 -0.15 -0.54 0.98 0.00 0.00 173.24 172.57 1sa0 s LYS 166 N -3.92 2.45 -0.32 4.02 1.02 -1.26 -1.42 119.74 120.32 1sa0 s LYS 166 Ca 0.63 -0.68 -0.05 0.00 0.02 0.00 0.00 55.97 55.88 1sa0 s LYS 166 Cb -0.15 -2.29 0.03 0.00 -0.52 0.00 0.00 37.83 34.91 1sa0 s LYS 166 CO 0.32 -0.26 0.07 -0.51 -0.92 0.00 0.00 175.35 174.05 1sa0 s LEU 167 N 1.41 4.06 0.07 3.17 1.02 -0.39 -0.40 118.68 127.63 1sa0 s LEU 167 Ca 0.04 -1.07 -0.04 0.00 0.02 0.00 0.00 54.13 53.08 1sa0 s LEU 167 Cb -0.13 -1.82 -0.05 0.00 0.02 0.00 0.00 46.19 44.20 1sa0 s LEU 167 CO -0.11 -0.27 0.29 -1.83 0.02 0.00 0.00 176.35 174.45 1sa0 s GLU 168 N 1.38 3.55 -0.49 1.70 -1.05 -1.06 -0.77 118.70 121.97 1sa0 s GLU 168 Ca -0.01 -0.19 0.04 0.00 -0.15 0.00 0.00 54.97 54.66 1sa0 s GLU 168 Cb -0.19 -2.99 0.13 0.00 -0.44 0.00 0.00 34.13 30.64 1sa0 s GLU 168 CO 0.01 0.57 0.23 -0.06 0.95 0.00 0.00 175.26 176.96 1sa0 s PHE 169 N -1.49 3.24 0.16 4.83 0.40 0.16 -0.52 117.98 124.76 1sa0 s PHE 169 Ca 0.34 -3.13 -0.14 0.00 -0.60 0.00 0.00 56.93 53.41 1sa0 s PHE 169 Cb -0.13 -2.81 -0.07 0.00 0.51 0.00 0.00 43.02 40.52 1sa0 s PHE 169 CO 0.23 -0.77 0.56 -1.12 0.70 0.00 0.00 175.22 174.81 1sa0 s SER 170 N -0.09 6.80 -0.45 1.36 0.01 -0.71 -2.90 113.70 117.72 1sa0 s SER 170 Ca 0.16 1.07 -0.05 0.00 1.31 0.00 0.00 55.95 58.43 1sa0 s SER 170 Cb -0.25 -2.28 0.12 0.00 0.21 0.00 0.00 66.02 63.82 1sa0 s SER 170 CO -0.01 0.07 0.28 -0.63 0.41 0.00 0.00 173.24 173.36 1sa0 s ILE 171 N -1.52 3.70 -0.00 1.44 1.09 -0.90 -0.71 121.20 124.29 1sa0 s ILE 171 Ca 0.39 -2.02 -0.30 0.00 -1.10 0.00 0.00 60.65 57.62 1sa0 s ILE 171 Cb -0.14 -3.48 -0.05 0.00 -1.06 0.00 0.00 42.46 37.72 1sa0 s ILE 171 CO 0.19 -0.74 1.38 -0.47 -0.10 0.00 0.00 174.94 175.20 1sa0 s TYR 172 N 1.13 2.91 0.38 3.97 6.14 -0.31 -1.66 117.35 129.90 1sa0 s TYR 172 Ca 0.08 0.87 -0.22 0.00 0.64 0.00 0.00 57.07 58.45 1sa0 s TYR 172 Cb -0.24 -3.63 -0.10 0.00 0.42 0.00 0.00 41.96 38.41 1sa0 s TYR 172 CO -0.03 -2.30 0.91 -1.25 0.64 0.00 0.00 175.55 173.52 1sa0 s PRO 173 N 2.32 4.31 -0.03 4.97 0.04 -1.26 -1.55 135.00 143.79 1sa0 s PRO 173 Ca 0.63 1.11 -0.01 0.00 0.04 0.00 0.00 61.00 62.77 1sa0 s PRO 173 Cb -0.31 -2.42 0.03 0.00 0.04 0.00 0.00 34.50 31.84 1sa0 s PRO 173 CO 0.26 0.10 0.04 0.00 0.04 0.00 0.00 177.00 177.45 1sa0 s ALA 174 N -1.96 0.17 0.00 8.56 0.00 -1.26 -4.81 121.76 122.46 1sa0 s ALA 174 Ca 0.57 0.24 0.00 0.00 0.00 0.00 0.00 51.96 52.76 1sa0 s ALA 174 Cb -0.12 -0.45 0.00 0.00 0.00 0.00 0.00 23.12 22.55 1sa0 s ALA 174 CO 0.17 -0.31 0.00 -2.30 0.00 0.00 0.00 175.76 173.32 1sa0 n PRO 175 N 4.77 0.00 0.17 0.00 -0.01 -1.26 -2.13 135.00 136.55 1sa0 n PRO 175 Ca -0.15 0.00 -0.13 0.00 -0.01 0.00 0.00 63.50 63.22 1sa0 n PRO 175 Cb 0.50 0.00 -0.07 0.00 -0.01 0.00 0.00 33.50 33.92 1sa0 n PRO 175 CO 0.00 0.00 0.00 -0.56 -0.01 0.00 0.00 175.50 174.93 1sa0 h GLN 176 N 0.00 -0.46 -4.45 -0.52 -0.00 -1.98 -3.33 115.11 104.36 1sa0 h GLN 176 Ca 0.00 0.03 -0.66 0.00 -0.00 0.00 0.00 58.65 58.02 1sa0 h GLN 176 Cb 0.00 0.10 -0.02 0.00 -0.00 0.00 0.00 27.48 27.57 1sa0 h GLN 176 CO 0.00 -0.13 2.64 0.28 -0.00 0.00 0.00 178.83 181.61 1sa0 n VAL 177 N -5.14 2.89 0.00 1.86 0.31 -0.90 -4.78 118.33 112.56 1sa0 n VAL 177 Ca -0.09 -2.61 0.00 0.00 -0.01 0.00 0.00 64.34 61.62 1sa0 n VAL 177 Cb 0.28 -2.46 0.00 0.00 -0.91 0.00 0.00 33.84 30.75 1sa0 n VAL 177 CO 0.00 0.00 0.00 -0.24 -1.32 0.00 0.00 176.83 175.27 1sa0 n SER 178 N 7.33 0.00 0.00 4.52 2.88 -1.25 -4.67 113.62 122.42 1sa0 n SER 178 Ca 0.50 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 58.04 1sa0 n SER 178 Cb 0.41 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.87 1sa0 n SER 178 CO 0.00 0.00 0.00 0.35 -1.23 0.00 0.00 175.04 174.16 1sa0 n THR 179 N 0.05 0.00 -3.86 2.46 -2.24 -1.26 -4.96 114.28 104.47 1sa0 n THR 179 Ca 0.00 0.00 -0.12 0.00 -2.27 0.00 0.00 64.05 61.66 1sa0 n THR 179 Cb 0.00 -0.28 -0.12 0.00 -2.10 0.00 0.00 70.33 67.83 1sa0 n THR 179 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1sa0 s ALA 180 N -2.43 -0.18 0.28 6.98 0.00 -1.26 -5.04 121.76 120.12 1sa0 s ALA 180 Ca 0.00 0.08 -0.04 0.00 0.00 0.00 0.00 51.96 52.00 1sa0 s ALA 180 Cb 0.00 -0.07 0.56 0.00 0.00 0.00 0.00 23.12 23.62 1sa0 s ALA 180 CO 0.00 -0.08 1.58 0.28 0.00 0.00 0.00 175.76 177.55 1sa0 h VAL 181 N 4.88 0.09 0.00 0.00 2.07 -2.01 0.27 116.25 121.54 1sa0 h VAL 181 Ca -0.26 -0.01 0.00 0.00 0.82 0.00 0.00 66.70 67.25 1sa0 h VAL 181 Cb 1.20 0.06 0.00 0.00 -1.52 0.00 0.00 31.29 31.04 1sa0 h VAL 181 CO 0.44 0.00 0.00 0.55 0.02 0.00 0.00 177.57 178.59 1sa0 n VAL 182 N -5.51 0.73 -0.24 2.57 3.14 -1.26 -4.35 118.33 113.40 1sa0 n VAL 182 Ca 0.18 0.06 -0.05 0.00 -2.96 0.00 0.00 64.34 61.58 1sa0 n VAL 182 Cb 0.59 -0.94 -0.04 0.00 -1.06 0.00 0.00 33.84 32.40 1sa0 n VAL 182 CO 0.00 0.00 0.00 1.21 -6.46 0.00 0.00 176.83 171.58 1sa0 n GLU 183 N -2.14 -0.22 -0.19 1.45 4.07 0.95 -0.25 120.64 124.32 1sa0 n GLU 183 Ca 0.04 0.88 0.17 0.00 -0.06 0.00 0.00 57.16 58.18 1sa0 n GLU 183 Cb 0.29 -1.30 0.51 0.00 -0.06 0.00 0.00 31.44 30.88 1sa0 n GLU 183 CO 0.00 0.00 0.00 -1.35 -0.06 0.00 0.00 177.13 175.72 1sa0 h PRO 184 N 0.00 0.39 0.65 5.31 0.11 -1.80 -0.44 132.00 136.22 1sa0 h PRO 184 Ca 0.12 -0.02 -0.03 0.00 0.11 0.00 0.00 66.00 66.18 1sa0 h PRO 184 Cb 0.27 -0.09 0.01 0.00 0.11 0.00 0.00 31.00 31.30 1sa0 h PRO 184 CO -0.55 0.26 -0.31 1.88 -0.21 0.00 0.00 178.00 179.06 1sa0 h TYR 185 N 0.40 -0.81 -0.77 0.65 0.99 -0.94 -2.78 116.97 113.71 1sa0 h TYR 185 Ca 0.40 -0.02 0.15 0.00 2.00 0.00 0.00 58.73 61.26 1sa0 h TYR 185 Cb 0.96 0.27 -0.10 0.00 1.00 0.00 0.00 36.73 38.86 1sa0 h TYR 185 CO -0.00 -0.47 0.31 -0.91 -0.00 0.00 0.00 178.16 177.09 1sa0 h ASN 186 N -0.99 0.29 0.41 3.88 2.35 -1.01 -0.56 115.58 119.95 1sa0 h ASN 186 Ca -0.09 0.11 -0.02 0.00 -0.55 0.00 0.00 56.30 55.75 1sa0 h ASN 186 Cb 0.70 0.09 0.00 0.00 0.05 0.00 0.00 38.32 39.17 1sa0 h ASN 186 CO 0.15 0.10 -0.20 0.28 -1.65 0.00 0.00 177.43 176.10 1sa0 h SER 187 N 0.44 -0.47 -0.40 5.81 0.02 -1.22 -1.31 113.55 116.43 1sa0 h SER 187 Ca 0.43 -0.00 0.06 0.00 -0.84 0.00 0.00 61.79 61.44 1sa0 h SER 187 Cb 0.67 0.12 -0.05 0.00 0.14 0.00 0.00 62.40 63.28 1sa0 h SER 187 CO -0.42 -0.31 0.11 0.40 -1.14 0.00 0.00 176.83 175.46 1sa0 h ILE 188 N -0.59 0.83 0.28 3.27 1.08 -1.13 -1.10 117.51 120.15 1sa0 h ILE 188 Ca -0.06 -0.08 0.01 0.00 -0.39 0.00 0.00 64.86 64.33 1sa0 h ILE 188 Cb 0.44 0.56 -0.03 0.00 -3.07 0.00 0.00 36.82 34.72 1sa0 h ILE 188 CO 0.09 0.04 -0.40 -0.07 -0.69 0.00 0.00 178.15 177.13 1sa0 h LEU 189 N 0.25 -1.13 0.27 1.44 3.38 -0.92 -2.07 115.31 116.52 1sa0 h LEU 189 Ca 0.19 0.11 -0.01 0.00 0.09 0.00 0.00 57.88 58.26 1sa0 h LEU 189 Cb 0.21 0.40 0.00 0.00 0.09 0.00 0.00 40.66 41.36 1sa0 h LEU 189 CO -0.23 -0.52 -0.13 0.00 0.09 0.00 0.00 178.44 177.66 1sa0 h THR 190 N -0.74 0.78 0.00 0.22 1.03 -1.05 -2.72 112.91 110.44 1sa0 h THR 190 Ca -0.01 -0.41 0.00 0.00 -0.01 0.00 0.00 66.41 65.98 1sa0 h THR 190 Cb 0.70 1.01 0.00 0.00 -1.07 0.00 0.00 68.15 68.79 1sa0 h THR 190 CO -0.14 0.09 0.32 0.00 -0.01 0.00 0.00 175.52 175.77 1sa0 h THR 191 N -0.57 0.00 0.01 0.00 1.03 -1.18 0.83 112.91 113.02 1sa0 h THR 191 Ca -0.04 0.00 -0.00 0.00 -0.01 0.00 0.00 66.41 66.36 1sa0 h THR 191 Cb 0.42 0.51 0.00 0.00 -1.07 0.00 0.00 68.15 68.00 1sa0 h THR 191 CO 0.06 0.00 -0.01 -0.74 -0.01 0.00 0.00 175.52 174.82 1sa0 h HIS 192 N 0.00 -0.01 -0.55 0.00 6.17 -1.04 -3.13 115.15 116.59 1sa0 h HIS 192 Ca 0.00 -0.00 0.10 0.00 0.71 0.00 0.00 60.37 61.18 1sa0 h HIS 192 Cb 0.63 0.00 -0.08 0.00 2.52 0.00 0.00 27.41 30.49 1sa0 h HIS 192 CO 0.00 -0.01 0.10 1.15 0.71 0.00 0.00 177.93 179.88 1sa0 h THR 193 N -0.11 0.66 0.00 6.26 2.02 -1.39 -2.30 112.91 118.05 1sa0 h THR 193 Ca -0.00 -0.08 -0.00 0.00 0.77 0.00 0.00 66.41 67.09 1sa0 h THR 193 Cb 0.01 0.41 -0.00 0.00 -1.74 0.00 0.00 68.15 66.83 1sa0 h THR 193 CO 0.00 0.04 -0.02 0.00 0.37 0.00 0.00 175.52 175.91 1sa0 h THR 194 N 0.23 0.13 -0.27 3.16 1.03 -1.04 -3.29 112.91 112.85 1sa0 h THR 194 Ca 0.28 -0.26 -0.06 0.00 -0.01 0.00 0.00 66.41 66.37 1sa0 h THR 194 Cb 0.41 1.22 -0.01 0.00 -1.07 0.00 0.00 68.15 68.70 1sa0 h THR 194 CO -0.38 0.02 -0.06 0.25 -0.01 0.00 0.00 175.52 175.34 1sa0 h LEU 195 N 0.00 0.52 0.00 0.00 6.46 -1.35 -2.94 115.31 118.01 1sa0 h LEU 195 Ca -0.00 -0.36 0.00 0.00 -0.12 0.00 0.00 57.88 57.40 1sa0 h LEU 195 Cb 0.22 -0.14 0.00 0.00 -0.73 0.00 0.00 40.66 40.01 1sa0 h LEU 195 CO 0.00 0.76 0.00 -1.84 -0.62 0.00 0.00 178.44 176.74 1sa0 n GLU 196 N -4.53 0.79 0.00 1.25 0.28 -1.24 -3.33 120.64 113.86 1sa0 n GLU 196 Ca -0.03 0.00 0.00 0.00 -0.16 0.00 0.00 57.16 56.97 1sa0 n GLU 196 Cb 0.30 -1.16 0.00 0.00 1.43 0.00 0.00 31.44 32.01 1sa0 n GLU 196 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 177.13 177.69 1sa0 n HIS 197 N -0.66 0.00 -3.73 -1.84 8.25 -1.12 -5.04 115.22 111.07 1sa0 n HIS 197 Ca 0.06 0.00 -0.23 0.00 -0.26 0.00 0.00 57.72 57.29 1sa0 n HIS 197 Cb 0.03 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.12 1sa0 n HIS 197 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1sa0 s SER 198 N -1.23 6.33 -0.23 0.41 0.15 -1.13 -4.73 113.70 113.25 1sa0 s SER 198 Ca 0.00 0.26 0.05 0.00 0.70 0.00 0.00 55.95 56.96 1sa0 s SER 198 Cb 0.00 -1.95 -0.19 0.00 -1.71 0.00 0.00 66.02 62.17 1sa0 s SER 198 CO 0.00 -0.13 -0.10 0.47 1.20 0.00 0.00 173.24 174.68 1sa0 n ASP 199 N -1.33 1.59 -3.64 5.45 9.92 0.47 -4.76 116.55 124.25 1sa0 n ASP 199 Ca -0.07 -0.07 -0.10 0.00 -0.53 0.00 0.00 54.79 54.02 1sa0 n ASP 199 Cb 0.56 -0.17 -0.07 0.00 -0.64 0.00 0.00 41.12 40.80 1sa0 n ASP 199 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1sa0 s ALA 201 N 0.76 1.14 -0.37 0.00 0.00 -1.20 -2.56 121.76 119.53 1sa0 s ALA 201 Ca -0.03 -0.77 -0.06 0.00 0.00 0.00 0.00 51.96 51.10 1sa0 s ALA 201 Cb -0.05 -0.19 0.06 0.00 0.00 0.00 0.00 23.12 22.94 1sa0 s ALA 201 CO -0.07 0.22 0.15 -0.06 0.00 0.00 0.00 175.76 176.00 1sa0 s PHE 202 N -0.76 3.33 0.29 0.00 0.40 0.32 -3.44 117.98 118.12 1sa0 s PHE 202 Ca 0.02 -1.66 -0.24 0.00 -0.60 0.00 0.00 56.93 54.45 1sa0 s PHE 202 Cb -0.07 -2.59 -0.09 0.00 0.51 0.00 0.00 43.02 40.77 1sa0 s PHE 202 CO 0.01 -0.81 0.88 -1.64 0.70 0.00 0.00 175.22 174.36 1sa0 s MET 203 N 1.35 4.48 -0.22 0.44 -1.94 -1.26 -1.75 119.30 120.41 1sa0 s MET 203 Ca 0.01 1.19 -0.03 0.00 -1.71 0.00 0.00 55.69 55.15 1sa0 s MET 203 Cb -0.21 -2.82 0.07 0.00 2.01 0.00 0.00 34.83 33.87 1sa0 s MET 203 CO 0.01 0.32 0.05 0.08 -0.01 0.00 0.00 175.02 175.47 1sa0 s VAL 204 N -1.59 0.56 -0.17 -6.03 1.01 0.11 -4.74 120.40 109.54 1sa0 s VAL 204 Ca 0.48 -0.72 -0.29 0.00 0.00 0.00 0.00 61.98 61.45 1sa0 s VAL 204 Cb -0.18 -1.14 -0.01 0.00 0.00 0.00 0.00 36.38 35.05 1sa0 s VAL 204 CO 0.23 -0.31 1.17 -0.62 0.00 0.00 0.00 175.10 175.57 1sa0 s ASP 205 N 1.83 7.02 0.54 3.32 -1.08 0.98 -1.16 116.67 128.10 1sa0 s ASP 205 Ca 0.01 1.60 0.30 0.00 -0.52 0.00 0.00 52.55 53.94 1sa0 s ASP 205 Cb -0.17 -2.54 1.51 0.00 -1.46 0.00 0.00 42.92 40.26 1sa0 s ASP 205 CO -0.12 -0.70 2.07 0.78 0.52 0.00 0.00 175.17 177.71 1sa0 h ASN 206 N 7.84 0.00 0.51 -0.34 -0.26 -1.58 -0.74 115.58 121.01 1sa0 h ASN 206 Ca -0.25 0.00 -0.18 0.00 -0.56 0.00 0.00 56.30 55.31 1sa0 h ASN 206 Cb 1.10 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 38.35 1sa0 h ASN 206 CO 0.96 0.10 -0.80 -0.08 -1.06 0.00 0.00 177.43 176.54 1sa0 h GLU 207 N 0.00 0.22 -0.43 0.81 4.81 -1.88 -1.67 114.58 116.43 1sa0 h GLU 207 Ca -0.00 -0.21 -0.14 0.00 -0.13 0.00 0.00 59.36 58.88 1sa0 h GLU 207 Cb 0.37 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.79 1sa0 h GLU 207 CO 0.01 0.91 -0.27 0.00 -0.73 0.00 0.00 179.01 178.94 1sa0 h ALA 208 N 1.02 0.71 0.02 2.92 0.00 -1.43 0.64 119.26 123.14 1sa0 h ALA 208 Ca -0.03 -0.41 -0.23 0.00 0.00 0.00 0.00 54.91 54.24 1sa0 h ALA 208 Cb 1.40 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 19.04 1sa0 h ALA 208 CO 0.12 0.67 -0.98 0.82 0.00 0.00 0.00 179.25 179.88 1sa0 h ILE 209 N 0.79 1.44 -0.46 0.00 1.08 -1.47 -0.34 117.51 118.55 1sa0 h ILE 209 Ca 0.09 -2.60 -0.04 0.00 -0.39 0.00 0.00 64.86 61.92 1sa0 h ILE 209 Cb 0.83 2.53 -0.02 0.00 -3.07 0.00 0.00 36.82 37.09 1sa0 h ILE 209 CO 0.07 0.77 0.13 0.22 -0.69 0.00 0.00 178.15 178.65 1sa0 h TYR 210 N 0.17 0.76 -0.81 1.37 5.03 -1.22 -2.28 116.97 120.00 1sa0 h TYR 210 Ca -0.08 -0.08 -0.01 0.00 2.58 0.00 0.00 58.73 61.14 1sa0 h TYR 210 Cb 1.63 -0.22 -0.04 0.00 1.55 0.00 0.00 36.73 39.66 1sa0 h TYR 210 CO 0.05 0.69 0.47 -0.44 -1.32 0.00 0.00 178.16 177.61 1sa0 h ASP 211 N 0.61 0.98 0.03 -2.11 3.32 -0.62 -2.38 116.42 116.25 1sa0 h ASP 211 Ca 0.15 -0.07 -0.10 0.00 0.02 0.00 0.00 57.03 57.03 1sa0 h ASP 211 Cb 0.30 -0.25 -0.01 0.00 0.22 0.00 0.00 39.33 39.59 1sa0 h ASP 211 CO -0.00 0.77 -0.29 0.40 -1.72 0.00 0.00 179.24 178.40 1sa0 h ILE 212 N 1.11 1.27 0.00 0.35 2.04 -0.85 -2.23 117.51 119.20 1sa0 h ILE 212 Ca 0.29 -1.30 0.00 0.00 1.00 0.00 0.00 64.86 64.85 1sa0 h ILE 212 Cb -0.02 1.43 0.00 0.00 -0.74 0.00 0.00 36.82 37.49 1sa0 h ILE 212 CO -0.05 0.40 0.00 0.00 0.00 0.00 0.00 178.15 178.50 1sa0 n ARG 214 N -2.38 0.48 0.14 0.00 1.74 -0.96 -1.95 116.66 113.74 1sa0 n ARG 214 Ca 0.02 0.46 0.06 0.00 -0.77 0.00 0.00 57.85 57.63 1sa0 n ARG 214 Cb 0.27 -1.64 0.55 0.00 -1.02 0.00 0.00 32.46 30.61 1sa0 n ARG 214 CO 0.00 0.00 0.00 -0.09 -1.52 0.00 0.00 177.63 176.02 1sa0 h ARG 215 N -1.00 0.23 0.00 5.56 2.43 -1.44 -2.94 114.38 117.22 1sa0 h ARG 215 Ca -0.07 -0.01 -0.05 0.00 -0.81 0.00 0.00 59.98 59.04 1sa0 h ARG 215 Cb 0.74 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.23 1sa0 h ARG 215 CO -0.04 0.16 -0.95 0.09 -1.51 0.00 0.00 179.97 177.71 1sa0 n ASN 216 N -4.51 1.67 0.24 -3.80 3.02 -0.51 -4.63 115.26 106.74 1sa0 n ASN 216 Ca -0.00 0.27 0.14 0.00 -0.03 0.00 0.00 54.58 54.96 1sa0 n ASN 216 Cb 0.08 -0.63 0.39 0.00 -0.61 0.00 0.00 39.78 39.02 1sa0 n ASN 216 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 1sa0 h LEU 217 N -0.73 0.00 -1.78 3.41 4.07 -1.62 -3.39 115.31 115.27 1sa0 h LEU 217 Ca -0.08 0.00 -0.24 0.00 0.08 0.00 0.00 57.88 57.64 1sa0 h LEU 217 Cb 0.84 0.00 0.13 0.00 1.08 0.00 0.00 40.66 42.71 1sa0 h LEU 217 CO -0.05 0.02 -0.57 -0.67 -1.08 0.00 0.00 178.44 176.09 1sa0 n ASP 218 N -3.11 -2.17 -4.42 -0.43 2.03 -0.83 -4.88 116.55 102.74 1sa0 n ASP 218 Ca 0.02 -0.46 -0.36 0.00 0.52 0.00 0.00 54.79 54.51 1sa0 n ASP 218 Cb 0.44 -3.90 -0.13 0.00 -0.72 0.00 0.00 41.12 36.81 1sa0 n ASP 218 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1sa0 s ILE 219 N -3.27 4.15 0.18 5.18 1.01 -0.82 -5.00 121.20 122.63 1sa0 s ILE 219 Ca 0.01 -0.25 -0.12 0.00 0.00 0.00 0.00 60.65 60.29 1sa0 s ILE 219 Cb -0.00 -2.94 0.09 0.00 0.01 0.00 0.00 42.46 39.61 1sa0 s ILE 219 CO 0.54 0.34 1.79 -0.33 0.00 0.00 0.00 174.94 177.28 1sa0 h GLU 220 N 8.22 0.84 -3.01 2.79 5.08 -1.95 -3.35 114.58 123.20 1sa0 h GLU 220 Ca -0.39 -0.10 -0.62 0.00 -1.00 0.00 0.00 59.36 57.26 1sa0 h GLU 220 Cb 1.17 -0.16 -0.41 0.00 0.50 0.00 0.00 28.75 29.85 1sa0 h GLU 220 CO 0.58 0.63 -0.66 1.03 -1.00 0.00 0.00 179.01 179.59 1sa0 s ARG 221 N -5.86 2.00 0.06 2.33 0.52 -1.26 -5.09 118.95 111.66 1sa0 s ARG 221 Ca -0.13 -2.88 -0.30 0.00 -0.52 0.00 0.00 55.73 51.90 1sa0 s ARG 221 Cb 0.13 -2.96 -0.09 0.00 0.52 0.00 0.00 34.95 32.54 1sa0 s ARG 221 CO 0.77 -1.26 1.94 -0.35 0.02 0.00 0.00 175.30 176.43 1sa0 n PRO 222 N 2.48 2.87 -1.83 3.54 -0.04 -1.26 -5.00 135.00 135.76 1sa0 n PRO 222 Ca 0.18 1.05 -0.29 0.00 -0.04 0.00 0.00 63.50 64.39 1sa0 n PRO 222 Cb 0.36 -2.99 0.11 0.00 -0.04 0.00 0.00 33.50 30.94 1sa0 n PRO 222 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 1sa0 s THR 223 N 4.02 2.00 0.02 0.52 2.01 -1.26 -4.92 115.64 118.03 1sa0 s THR 223 Ca 0.87 0.00 -0.24 0.00 0.31 0.00 0.00 61.69 62.63 1sa0 s THR 223 Cb -0.44 -2.95 -0.17 0.00 0.01 0.00 0.00 72.50 68.94 1sa0 s THR 223 CO 0.41 0.00 1.42 1.88 -0.69 0.00 0.00 174.62 177.64 1sa0 h TYR 224 N -1.20 0.09 -0.05 4.92 0.99 -1.98 -1.67 116.97 118.06 1sa0 h TYR 224 Ca -0.47 -0.02 0.02 0.00 2.00 0.00 0.00 58.73 60.26 1sa0 h TYR 224 Cb 1.32 -0.02 -0.00 0.00 1.00 0.00 0.00 36.73 39.03 1sa0 h TYR 224 CO 0.16 0.40 0.17 0.00 -0.00 0.00 0.00 178.16 178.90 1sa0 h THR 225 N -0.24 0.14 0.13 -2.88 1.03 -1.98 0.80 112.91 109.91 1sa0 h THR 225 Ca 0.01 0.00 -0.31 0.00 -0.01 0.00 0.00 66.41 66.11 1sa0 h THR 225 Cb 0.37 0.84 -0.00 0.00 -1.07 0.00 0.00 68.15 68.29 1sa0 h THR 225 CO 0.00 0.00 -1.50 0.78 -0.01 0.00 0.00 175.52 174.80 1sa0 h ASN 226 N 0.00 0.44 0.01 0.00 -0.26 -1.83 -3.23 115.58 110.71 1sa0 h ASN 226 Ca 0.03 -0.58 -0.00 0.00 -0.56 0.00 0.00 56.30 55.19 1sa0 h ASN 226 Cb 0.37 -0.14 0.00 0.00 -1.06 0.00 0.00 38.32 37.49 1sa0 h ASN 226 CO -0.00 1.47 -0.01 -0.07 -1.06 0.00 0.00 177.43 177.77 1sa0 h LEU 227 N 0.08 -0.02 -0.97 1.61 4.07 0.32 -3.31 115.31 117.09 1sa0 h LEU 227 Ca -0.23 -0.78 0.14 0.00 0.08 0.00 0.00 57.88 57.09 1sa0 h LEU 227 Cb 2.02 0.00 -0.09 0.00 1.08 0.00 0.00 40.66 43.68 1sa0 h LEU 227 CO 0.18 0.81 0.59 0.78 -1.08 0.00 0.00 178.44 179.72 1sa0 h ASN 228 N -0.89 0.82 -0.86 -0.43 2.35 0.27 -1.40 115.58 115.44 1sa0 h ASN 228 Ca -0.00 0.07 0.10 0.00 -0.55 0.00 0.00 56.30 55.91 1sa0 h ASN 228 Cb 0.79 -0.09 -0.08 0.00 0.05 0.00 0.00 38.32 38.99 1sa0 h ASN 228 CO 0.00 0.40 0.50 0.03 -1.65 0.00 0.00 177.43 176.71 1sa0 h ARG 229 N 0.88 0.81 -0.01 0.81 3.08 -1.64 0.38 114.38 118.69 1sa0 h ARG 229 Ca 0.50 -0.05 -0.00 0.00 0.07 0.00 0.00 59.98 60.50 1sa0 h ARG 229 Cb 0.60 -0.18 -0.00 0.00 0.08 0.00 0.00 29.97 30.46 1sa0 h ARG 229 CO -0.30 0.54 -0.00 1.25 -1.07 0.00 0.00 179.97 180.38 1sa0 h LEU 230 N 0.84 0.02 -1.05 3.04 5.85 -1.39 -2.71 115.31 119.90 1sa0 h LEU 230 Ca 0.42 -0.43 0.09 0.00 0.84 0.00 0.00 57.88 58.80 1sa0 h LEU 230 Cb 0.38 -0.01 -0.07 0.00 0.37 0.00 0.00 40.66 41.34 1sa0 h LEU 230 CO -0.25 0.44 0.63 0.40 -0.34 0.00 0.00 178.44 179.32 1sa0 h ILE 231 N -0.40 1.02 -0.38 4.05 2.04 -0.94 -1.72 117.51 121.17 1sa0 h ILE 231 Ca 0.00 -0.37 0.06 0.00 1.00 0.00 0.00 64.86 65.55 1sa0 h ILE 231 Cb 0.43 -0.14 -0.08 0.00 -0.74 0.00 0.00 36.82 36.29 1sa0 h ILE 231 CO 0.00 0.20 -0.49 1.23 0.00 0.00 0.00 178.15 179.08 1sa0 h GLY 232 N 1.07 -0.78 0.44 5.37 0.00 -0.03 -0.85 103.07 108.29 1sa0 h GLY 232 Ca 0.44 0.63 0.08 0.00 0.00 0.00 0.00 47.33 48.48 1sa0 h GLY 232 CO -0.20 -0.16 0.14 -1.61 0.00 0.00 0.00 176.54 174.71 1sa0 h GLN 233 N -0.38 0.28 -0.30 4.80 5.75 -1.01 0.31 115.11 124.57 1sa0 h GLN 233 Ca 0.10 -0.02 0.03 0.00 -0.15 0.00 0.00 58.65 58.62 1sa0 h GLN 233 Cb 0.60 -0.06 -0.03 0.00 1.07 0.00 0.00 27.48 29.05 1sa0 h GLN 233 CO -0.57 0.19 0.09 0.82 -2.65 0.00 0.00 178.83 176.70 1sa0 h ILE 234 N 0.29 0.90 -0.21 2.39 5.03 -0.95 -1.30 117.51 123.66 1sa0 h ILE 234 Ca 0.24 -0.07 0.02 0.00 -0.12 0.00 0.00 64.86 64.93 1sa0 h ILE 234 Cb 0.30 0.67 -0.02 0.00 -3.03 0.00 0.00 36.82 34.74 1sa0 h ILE 234 CO -0.28 0.04 0.09 0.58 -0.68 0.00 0.00 178.15 177.89 1sa0 h VAL 235 N 0.21 0.97 -0.40 1.67 2.07 -0.46 -0.83 116.25 119.49 1sa0 h VAL 235 Ca 0.13 -0.07 0.08 0.00 0.82 0.00 0.00 66.70 67.67 1sa0 h VAL 235 Cb 0.11 0.76 -0.08 0.00 -1.52 0.00 0.00 31.29 30.57 1sa0 h VAL 235 CO -0.15 0.04 -0.11 -1.28 0.02 0.00 0.00 177.57 176.09 1sa0 h SER 236 N 0.20 -0.41 -0.07 0.57 0.87 -0.62 0.36 113.55 114.45 1sa0 h SER 236 Ca 0.09 0.12 -0.03 0.00 -1.23 0.00 0.00 61.79 60.74 1sa0 h SER 236 Cb 0.04 0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 62.25 1sa0 h SER 236 CO -0.07 -0.14 -0.03 0.28 -0.53 0.00 0.00 176.83 176.33 1sa0 h SER 237 N -0.02 0.24 0.58 6.23 0.02 -0.72 0.19 113.55 120.08 1sa0 h SER 237 Ca 0.19 -0.03 -0.03 0.00 -0.84 0.00 0.00 61.79 61.08 1sa0 h SER 237 Cb 0.31 -0.06 0.01 0.00 0.14 0.00 0.00 62.40 62.79 1sa0 h SER 237 CO -0.42 0.32 -0.28 0.40 -1.14 0.00 0.00 176.83 175.71 1sa0 h ILE 238 N 0.26 0.03 0.19 3.27 2.04 0.40 -3.37 117.51 120.33 1sa0 h ILE 238 Ca 0.06 -0.43 -0.01 0.00 1.00 0.00 0.00 64.86 65.48 1sa0 h ILE 238 Cb 0.23 0.05 0.00 0.00 -0.74 0.00 0.00 36.82 36.36 1sa0 h ILE 238 CO 0.01 0.01 -0.09 0.71 0.00 0.00 0.00 178.15 178.78 1sa0 h THR 239 N -1.20 0.00 0.00 -0.27 1.35 -0.89 -3.37 112.91 108.53 1sa0 h THR 239 Ca -0.08 -0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.78 1sa0 h THR 239 Cb 0.61 0.00 0.00 0.00 -1.73 0.00 0.00 68.15 67.03 1sa0 h THR 239 CO 0.13 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.40 1sa0 n ALA 240 N -2.13 0.00 -0.13 6.62 0.00 0.67 -0.52 120.51 125.02 1sa0 n ALA 240 Ca -0.03 0.00 0.03 0.00 0.00 0.00 0.00 53.44 53.44 1sa0 n ALA 240 Cb 0.10 0.00 0.07 0.00 0.00 0.00 0.00 19.45 19.62 1sa0 n ALA 240 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1sa0 n SER 241 N 0.00 -0.11 -1.54 0.00 3.41 -1.26 0.18 113.62 114.30 1sa0 n SER 241 Ca 0.00 0.64 0.07 0.00 -0.26 0.00 0.00 58.87 59.32 1sa0 n SER 241 Cb 0.00 -0.20 0.32 0.00 -0.26 0.00 0.00 64.21 64.07 1sa0 n SER 241 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1sa0 n LEU 242 N -4.55 4.55 -0.02 1.04 -0.00 0.32 -2.31 117.00 116.04 1sa0 n LEU 242 Ca 0.07 -2.31 -0.01 0.00 -0.00 0.00 0.00 56.01 53.76 1sa0 n LEU 242 Cb 0.21 -0.60 -0.03 0.00 -0.00 0.00 0.00 43.42 43.00 1sa0 n LEU 242 CO -0.04 0.63 -0.61 0.54 -0.00 0.00 0.00 177.39 177.91 1sa0 n ARG 243 N 0.71 2.81 -0.03 1.47 1.74 0.47 -4.70 116.66 119.13 1sa0 n ARG 243 Ca 0.23 -0.01 0.03 0.00 -0.77 0.00 0.00 57.85 57.33 1sa0 n ARG 243 Cb 0.92 -1.09 -0.13 0.00 -1.02 0.00 0.00 32.46 31.13 1sa0 n ARG 243 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 1sa0 n PHE 244 N -2.05 0.00 -2.10 -1.55 3.01 -0.94 -2.63 117.46 111.20 1sa0 n PHE 244 Ca -0.05 0.00 -0.01 0.00 1.01 0.00 0.00 57.45 58.40 1sa0 n PHE 244 Cb 0.53 -0.52 -0.01 0.00 -0.01 0.00 0.00 39.48 39.47 1sa0 n PHE 244 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 1sa0 n ASP 245 N -2.25 -5.57 0.00 4.37 2.03 -0.98 -4.89 116.55 109.26 1sa0 n ASP 245 Ca -0.11 1.28 0.00 0.00 0.52 0.00 0.00 54.79 56.49 1sa0 n ASP 245 Cb 0.63 -4.18 0.00 0.00 -0.72 0.00 0.00 41.12 36.85 1sa0 n ASP 245 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1sa0 n GLY 246 N 1.35 -1.57 0.50 0.27 0.00 -1.23 -5.07 105.19 99.43 1sa0 n GLY 246 Ca -0.10 0.96 0.00 0.00 0.00 0.00 0.00 46.02 46.88 1sa0 n GLY 246 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sa0 n ALA 247 N 0.00 -1.92 -2.75 4.61 0.00 -1.26 -4.83 120.51 114.36 1sa0 n ALA 247 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 53.44 53.42 1sa0 n ALA 247 Cb 0.00 -0.50 -0.01 0.00 0.00 0.00 0.00 19.45 18.94 1sa0 n ALA 247 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 177.50 177.39 1sa0 n LEU 248 N -2.05 -4.63 -2.98 0.00 -0.00 -1.26 -4.48 117.00 101.60 1sa0 n LEU 248 Ca 0.00 1.51 -0.13 0.00 -0.00 0.00 0.00 56.01 57.39 1sa0 n LEU 248 Cb 0.46 -2.17 0.07 0.00 -0.00 0.00 0.00 43.42 41.78 1sa0 n LEU 248 CO 0.00 -3.03 0.07 0.59 -0.00 0.00 0.00 177.39 175.02 1sa0 n ASN 249 N 2.19 -3.53 -1.46 1.96 5.03 -1.26 -4.77 115.26 113.41 1sa0 n ASN 249 Ca -0.13 -0.54 0.03 0.00 0.87 0.00 0.00 54.58 54.81 1sa0 n ASN 249 Cb 0.19 -4.36 0.30 0.00 -1.02 0.00 0.00 39.78 34.90 1sa0 n ASN 249 CO 0.00 0.00 0.00 0.55 -1.83 0.00 0.00 177.26 175.98 1sa0 n VAL 250 N -3.33 2.61 -3.63 2.41 3.14 -1.26 -2.98 118.33 115.29 1sa0 n VAL 250 Ca -0.17 -1.79 -0.03 0.00 -2.96 0.00 0.00 64.34 59.39 1sa0 n VAL 250 Cb 0.62 -0.30 -0.06 0.00 -1.06 0.00 0.00 33.84 33.04 1sa0 n VAL 250 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 1sa0 s ASP 251 N -1.48 -0.62 0.35 6.55 -1.08 -1.26 -4.88 116.67 114.24 1sa0 s ASP 251 Ca 0.49 0.97 0.04 0.00 -0.52 0.00 0.00 52.55 53.53 1sa0 s ASP 251 Cb 0.39 1.29 0.67 0.00 -1.46 0.00 0.00 42.92 43.81 1sa0 s ASP 251 CO 0.11 -0.15 1.96 -0.07 0.52 0.00 0.00 175.17 177.54 1sa0 h LEU 252 N 6.37 0.73 0.48 -1.34 3.38 -1.91 -2.02 115.31 121.01 1sa0 h LEU 252 Ca -0.28 -0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.68 1sa0 h LEU 252 Cb 1.20 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.77 1sa0 h LEU 252 CO 0.18 0.49 -0.38 0.74 0.09 0.00 0.00 178.44 179.56 1sa0 h THR 253 N 0.84 0.23 0.00 0.22 2.02 -1.96 -2.36 112.91 111.90 1sa0 h THR 253 Ca 0.31 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.49 1sa0 h THR 253 Cb 0.17 0.23 0.00 0.00 -1.74 0.00 0.00 68.15 66.81 1sa0 h THR 253 CO -0.10 0.00 0.28 1.21 0.37 0.00 0.00 175.52 177.28 1sa0 n GLU 254 N -5.49 0.04 -0.05 6.66 2.13 -0.77 -1.63 120.64 121.52 1sa0 n GLU 254 Ca -0.11 0.39 -0.14 0.00 0.66 0.00 0.00 57.16 57.96 1sa0 n GLU 254 Cb 0.39 -1.90 -0.12 0.00 0.27 0.00 0.00 31.44 30.09 1sa0 n GLU 254 CO 0.00 0.00 0.00 0.74 -0.41 0.00 0.00 177.13 177.46 1sa0 h PHE 255 N 0.00 0.01 -0.25 4.31 0.04 -1.27 -2.91 116.94 116.86 1sa0 h PHE 255 Ca 0.00 -0.00 -0.19 0.00 2.80 0.00 0.00 57.97 60.57 1sa0 h PHE 255 Cb 0.56 -0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.72 1sa0 h PHE 255 CO 0.00 0.82 -0.60 0.37 -0.60 0.00 0.00 178.31 178.30 1sa0 h GLN 256 N -0.81 0.86 -0.02 1.51 4.15 -1.38 -2.80 115.11 116.61 1sa0 h GLN 256 Ca -0.00 -0.58 0.01 0.00 0.77 0.00 0.00 58.65 58.84 1sa0 h GLN 256 Cb 0.83 0.08 -0.00 0.00 0.21 0.00 0.00 27.48 28.60 1sa0 h GLN 256 CO 0.00 1.21 0.02 1.15 -1.93 0.00 0.00 178.83 179.28 1sa0 h THR 257 N 0.63 0.61 0.00 2.39 2.02 -1.54 0.57 112.91 117.59 1sa0 h THR 257 Ca -0.00 0.00 -0.15 0.00 0.77 0.00 0.00 66.41 67.02 1sa0 h THR 257 Cb 1.22 0.98 -0.03 0.00 -1.74 0.00 0.00 68.15 68.58 1sa0 h THR 257 CO 0.13 0.00 -1.86 0.59 0.37 0.00 0.00 175.52 174.75 1sa0 n ASN 258 N -3.98 0.31 -0.05 4.18 5.03 -1.10 -4.72 115.26 114.94 1sa0 n ASN 258 Ca -0.03 0.13 -0.07 0.00 0.87 0.00 0.00 54.58 55.49 1sa0 n ASN 258 Cb 0.11 1.06 -0.05 0.00 -1.02 0.00 0.00 39.78 39.87 1sa0 n ASN 258 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 1sa0 n LEU 259 N -2.61 2.58 -4.55 3.41 4.77 -0.94 -4.85 117.00 114.81 1sa0 n LEU 259 Ca -0.14 -0.05 -0.40 0.00 -0.03 0.00 0.00 56.01 55.40 1sa0 n LEU 259 Cb 0.81 -0.30 -0.10 0.00 -2.33 0.00 0.00 43.42 41.50 1sa0 n LEU 259 CO 0.44 0.62 -0.11 0.68 -1.33 0.00 0.00 177.39 177.68 1sa0 s VAL 260 N -2.22 5.28 -0.26 4.08 -7.23 0.15 -4.75 120.40 115.45 1sa0 s VAL 260 Ca -0.13 -0.08 0.23 0.00 -1.81 0.00 0.00 61.98 60.19 1sa0 s VAL 260 Cb 0.04 -3.68 -0.03 0.00 0.56 0.00 0.00 36.38 33.26 1sa0 s VAL 260 CO 0.27 0.05 1.01 -0.81 -0.31 0.00 0.00 175.10 175.30 1sa0 n PRO 261 N 5.13 0.58 -4.63 4.82 -0.04 -1.26 -4.65 135.00 134.94 1sa0 n PRO 261 Ca -0.12 0.09 -0.23 0.00 -0.04 0.00 0.00 63.50 63.19 1sa0 n PRO 261 Cb 0.50 -1.78 -0.15 0.00 -0.04 0.00 0.00 33.50 32.03 1sa0 n PRO 261 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1sa0 s TYR 262 N -3.36 1.37 0.54 0.54 1.51 -1.26 -5.01 117.35 111.68 1sa0 s TYR 262 Ca -0.01 -0.29 0.33 0.00 -1.01 0.00 0.00 57.07 56.09 1sa0 s TYR 262 Cb 0.10 -0.86 1.50 0.00 -0.11 0.00 0.00 41.96 42.59 1sa0 s TYR 262 CO 0.80 -0.00 1.87 -1.00 -1.11 0.00 0.00 175.55 176.11 1sa0 h PRO 263 N 5.51 0.01 -3.76 -1.71 0.13 -1.97 -3.27 132.00 126.94 1sa0 h PRO 263 Ca -0.36 -0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 64.69 1sa0 h PRO 263 Cb 1.16 -0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.29 1sa0 h PRO 263 CO 0.47 0.00 1.23 0.54 -0.23 0.00 0.00 178.00 180.01 1sa0 n ARG 264 N -4.25 0.41 0.00 0.86 5.12 -1.26 -4.55 116.66 113.00 1sa0 n ARG 264 Ca 0.20 -0.63 0.00 0.00 -1.93 0.00 0.00 57.85 55.49 1sa0 n ARG 264 Cb 1.03 -2.03 0.00 0.00 -1.16 0.00 0.00 32.46 30.30 1sa0 n ARG 264 CO 0.00 0.00 0.00 1.51 -1.93 0.00 0.00 177.63 177.21 1sa0 n ILE 265 N 4.61 0.00 0.00 0.55 3.06 -1.23 -4.72 119.36 121.63 1sa0 n ILE 265 Ca 0.09 0.00 0.00 0.00 -2.50 0.00 0.00 62.75 60.34 1sa0 n ILE 265 Cb 0.04 0.00 0.00 0.00 0.54 0.00 0.00 39.64 40.22 1sa0 n ILE 265 CO 0.00 0.00 0.00 1.41 -2.50 0.00 0.00 176.55 175.46 1sa0 n HIS 266 N 0.23 0.00 -3.73 9.51 8.25 -1.26 -3.21 115.22 125.00 1sa0 n HIS 266 Ca 0.00 0.00 -0.38 0.00 -0.26 0.00 0.00 57.72 57.08 1sa0 n HIS 266 Cb 0.00 0.00 -0.12 0.00 1.12 0.00 0.00 29.99 30.99 1sa0 n HIS 266 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 1sa0 s PHE 267 N 0.00 3.29 0.53 4.41 0.40 -1.26 -3.32 117.98 122.03 1sa0 s PHE 267 Ca 0.00 -1.51 -0.18 0.00 -0.60 0.00 0.00 56.93 54.64 1sa0 s PHE 267 Cb 0.00 -2.45 -0.07 0.00 0.51 0.00 0.00 43.02 41.01 1sa0 s PHE 267 CO 0.00 -0.77 1.04 -2.14 0.70 0.00 0.00 175.22 174.06 1sa0 s PRO 268 N 1.39 3.63 -0.26 0.24 0.02 -1.22 -4.73 135.00 134.07 1sa0 s PRO 268 Ca -0.00 1.27 -0.14 0.00 0.02 0.00 0.00 61.00 62.15 1sa0 s PRO 268 Cb -0.20 -2.07 -0.04 0.00 0.02 0.00 0.00 34.50 32.20 1sa0 s PRO 268 CO 0.02 -0.56 0.31 -1.17 -0.33 0.00 0.00 177.00 175.27 1sa0 s LEU 269 N -3.90 4.06 -0.14 -5.54 1.98 0.36 -4.30 118.68 111.20 1sa0 s LEU 269 Ca 0.65 0.23 -0.08 0.00 -2.89 0.00 0.00 54.13 52.05 1sa0 s LEU 269 Cb -0.16 -2.33 -0.04 0.00 0.66 0.00 0.00 46.19 44.32 1sa0 s LEU 269 CO 0.27 -0.11 0.14 0.00 -1.89 0.00 0.00 176.35 174.76 1sa0 s ALA 270 N 1.77 3.83 -0.15 5.97 0.00 -1.26 -0.72 121.76 131.19 1sa0 s ALA 270 Ca 0.13 -0.65 -0.01 0.00 0.00 0.00 0.00 51.96 51.42 1sa0 s ALA 270 Cb -0.15 -2.03 0.04 0.00 0.00 0.00 0.00 23.12 20.98 1sa0 s ALA 270 CO 0.09 0.49 -0.01 0.99 0.00 0.00 0.00 175.76 177.33 1sa0 s THR 271 N -0.65 0.72 0.08 0.00 2.01 -1.02 -2.61 115.64 114.17 1sa0 s THR 271 Ca 0.13 -0.41 -0.21 0.00 0.31 0.00 0.00 61.69 61.52 1sa0 s THR 271 Cb -0.12 -1.00 -0.07 0.00 0.01 0.00 0.00 72.50 71.32 1sa0 s THR 271 CO 0.02 0.05 0.61 -0.47 -0.69 0.00 0.00 174.62 174.15 1sa0 s TYR 272 N 1.80 3.81 0.00 4.92 5.04 -1.25 -4.18 117.35 127.50 1sa0 s TYR 272 Ca 0.01 1.34 0.00 0.00 -2.44 0.00 0.00 57.07 55.98 1sa0 s TYR 272 Cb -0.15 -2.56 0.00 0.00 0.35 0.00 0.00 41.96 39.60 1sa0 s TYR 272 CO -0.07 0.55 0.00 0.00 -1.34 0.00 0.00 175.55 174.69 1sa0 n ALA 273 N 1.81 0.00 -2.54 3.97 0.00 -0.49 -4.73 120.51 118.52 1sa0 n ALA 273 Ca -0.09 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 52.95 1sa0 n ALA 273 Cb 0.50 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.85 1sa0 n ALA 273 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1sa0 s PRO 274 N 0.00 3.58 -0.32 0.00 0.04 -1.26 -4.90 135.00 132.14 1sa0 s PRO 274 Ca 0.00 -0.54 -0.07 0.00 0.04 0.00 0.00 61.00 60.43 1sa0 s PRO 274 Cb 0.00 -3.78 0.02 0.00 0.04 0.00 0.00 34.50 30.78 1sa0 s PRO 274 CO 0.00 -0.42 0.10 0.08 0.04 0.00 0.00 177.00 176.80 1sa0 s VAL 275 N 1.79 3.94 -0.09 -0.36 1.01 -1.26 -5.05 120.40 120.38 1sa0 s VAL 275 Ca 0.07 -0.87 -0.04 0.00 0.00 0.00 0.00 61.98 61.14 1sa0 s VAL 275 Cb -0.17 -3.12 0.04 0.00 0.00 0.00 0.00 36.38 33.13 1sa0 s VAL 275 CO 0.11 -0.04 0.19 -0.51 0.00 0.00 0.00 175.10 174.84 1sa0 s ILE 276 N 1.47 -0.11 0.34 2.22 1.10 -1.26 -4.82 121.20 120.13 1sa0 s ILE 276 Ca 0.01 0.21 -0.29 0.00 -0.51 0.00 0.00 60.65 60.07 1sa0 s ILE 276 Cb -0.18 -0.31 -0.11 0.00 0.15 0.00 0.00 42.46 42.01 1sa0 s ILE 276 CO 0.03 0.09 1.52 -1.54 -2.11 0.00 0.00 174.94 172.93 1sa0 n SER 277 N 4.49 3.75 -4.71 4.50 3.41 -1.26 -1.43 113.62 122.38 1sa0 n SER 277 Ca -0.21 1.19 -0.33 0.00 -0.26 0.00 0.00 58.87 59.26 1sa0 n SER 277 Cb 0.52 -1.60 0.11 0.00 -0.26 0.00 0.00 64.21 62.98 1sa0 n SER 277 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1sa0 s ALA 278 N -0.63 1.98 0.00 7.33 0.00 -0.28 -1.42 121.76 128.74 1sa0 s ALA 278 Ca 0.58 0.80 0.00 0.00 0.00 0.00 0.00 51.96 53.34 1sa0 s ALA 278 Cb -0.49 -3.46 0.00 0.00 0.00 0.00 0.00 23.12 19.17 1sa0 s ALA 278 CO 0.57 -2.07 0.00 -1.91 0.00 0.00 0.00 175.76 172.35 1sa0 n GLU 279 N -3.09 0.00 0.00 0.00 0.00 -1.26 -4.48 120.64 111.81 1sa0 n GLU 279 Ca 0.13 0.00 0.13 0.00 0.00 0.00 0.00 57.16 57.42 1sa0 n GLU 279 Cb 0.51 0.00 0.31 0.00 0.00 0.00 0.00 31.44 32.25 1sa0 n GLU 279 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 1sa0 n LYS 280 N 0.00 0.92 -0.31 5.31 5.02 -0.51 -4.52 118.16 124.07 1sa0 n LYS 280 Ca 0.00 -0.59 -0.12 0.00 -2.02 0.00 0.00 58.31 55.58 1sa0 n LYS 280 Cb 0.00 -1.49 -0.10 0.00 -0.02 0.00 0.00 35.03 33.42 1sa0 n LYS 280 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1sa0 h ALA 281 N 3.73 -0.63 0.00 7.82 0.00 -1.75 -1.23 119.26 127.19 1sa0 h ALA 281 Ca 0.00 0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.98 1sa0 h ALA 281 Cb 0.55 1.28 0.00 0.00 0.00 0.00 0.00 17.79 19.63 1sa0 h ALA 281 CO 0.00 -0.99 0.00 0.66 0.00 0.00 0.00 179.25 178.92 1sa0 n TYR 282 N -5.26 0.00 0.00 0.00 4.02 -1.26 -4.76 117.16 109.90 1sa0 n TYR 282 Ca -0.00 -0.18 0.00 0.00 -0.01 0.00 0.00 57.90 57.71 1sa0 n TYR 282 Cb 0.29 -0.14 0.00 0.00 -0.02 0.00 0.00 39.34 39.46 1sa0 n TYR 282 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 176.86 176.57 1sa0 n HIS 283 N 0.39 0.00 -4.66 -0.72 8.25 -0.47 -5.04 115.22 112.97 1sa0 n HIS 283 Ca 0.00 0.00 -0.34 0.00 -0.26 0.00 0.00 57.72 57.12 1sa0 n HIS 283 Cb 0.27 0.00 -0.12 0.00 1.12 0.00 0.00 29.99 31.26 1sa0 n HIS 283 CO 0.00 0.00 0.00 -1.21 0.64 0.00 0.00 176.34 175.77 1sa0 s GLU 284 N 0.00 2.89 0.14 -0.41 8.01 -1.26 -5.10 118.70 122.97 1sa0 s GLU 284 Ca 0.00 -0.59 -0.31 0.00 0.01 0.00 0.00 54.97 54.08 1sa0 s GLU 284 Cb 0.00 -2.60 -0.10 0.00 -4.31 0.00 0.00 34.13 27.13 1sa0 s GLU 284 CO 0.00 0.55 1.60 1.14 0.01 0.00 0.00 175.26 178.57 1sa0 s GLN 285 N -0.52 4.21 0.07 1.61 0.00 -1.26 -4.96 119.66 118.81 1sa0 s GLN 285 Ca 0.08 2.37 -0.30 0.00 -0.00 0.00 0.00 55.36 57.50 1sa0 s GLN 285 Cb -0.12 -3.29 -0.06 0.00 0.00 0.00 0.00 33.01 29.55 1sa0 s GLN 285 CO 0.02 -0.65 1.14 -0.51 0.00 0.00 0.00 175.29 175.29 1sa0 s LEU 286 N 1.61 4.39 0.59 2.60 1.02 -1.26 -4.99 118.68 122.64 1sa0 s LEU 286 Ca 0.72 1.97 -0.20 0.00 0.02 0.00 0.00 54.13 56.63 1sa0 s LEU 286 Cb -0.43 -3.58 -0.03 0.00 0.02 0.00 0.00 46.19 42.17 1sa0 s LEU 286 CO 0.32 -0.38 1.34 -0.94 0.02 0.00 0.00 176.35 176.70 1sa0 s SER 287 N 0.82 4.98 0.38 2.29 1.04 -1.26 -4.86 113.70 117.10 1sa0 s SER 287 Ca 0.56 2.72 0.06 0.00 0.48 0.00 0.00 55.95 59.77 1sa0 s SER 287 Cb -0.28 -2.63 0.79 0.00 0.10 0.00 0.00 66.02 64.00 1sa0 s SER 287 CO 0.30 -1.76 2.01 0.58 0.98 0.00 0.00 173.24 175.35 1sa0 h VAL 288 N 1.08 1.07 -0.25 5.02 2.07 -1.97 -1.07 116.25 122.21 1sa0 h VAL 288 Ca -0.51 -0.23 -0.15 0.00 0.82 0.00 0.00 66.70 66.63 1sa0 h VAL 288 Cb 1.32 0.34 -0.01 0.00 -1.52 0.00 0.00 31.29 31.42 1sa0 h VAL 288 CO 0.56 0.12 -0.46 0.00 0.02 0.00 0.00 177.57 177.80 1sa0 h ALA 289 N 1.66 0.71 -0.24 1.67 0.00 -1.91 -3.22 119.26 117.94 1sa0 h ALA 289 Ca 0.23 -0.48 -0.07 0.00 0.00 0.00 0.00 54.91 54.59 1sa0 h ALA 289 Cb 0.09 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1sa0 h ALA 289 CO -0.06 0.67 -0.13 0.93 0.00 0.00 0.00 179.25 180.66 1sa0 h GLU 290 N 0.53 0.51 -0.11 0.00 5.08 -1.57 -1.72 114.58 117.30 1sa0 h GLU 290 Ca 0.03 -0.23 -0.10 0.00 -1.00 0.00 0.00 59.36 58.06 1sa0 h GLU 290 Cb 1.01 -0.01 -0.01 0.00 0.50 0.00 0.00 28.75 30.24 1sa0 h GLU 290 CO 0.09 0.79 -0.40 -0.84 -1.00 0.00 0.00 179.01 177.66 1sa0 h ILE 291 N 0.23 1.30 -0.29 3.13 3.07 -1.55 0.42 117.51 123.82 1sa0 h ILE 291 Ca 0.05 -1.48 -0.03 0.00 1.55 0.00 0.00 64.86 64.95 1sa0 h ILE 291 Cb 0.64 1.66 -0.01 0.00 -0.27 0.00 0.00 36.82 38.84 1sa0 h ILE 291 CO 0.04 0.44 0.05 0.74 -1.05 0.00 0.00 178.15 178.38 1sa0 h THR 292 N 0.20 1.23 -0.06 0.16 2.02 -1.56 -2.47 112.91 112.43 1sa0 h THR 292 Ca 0.02 -0.77 0.02 0.00 0.77 0.00 0.00 66.41 66.45 1sa0 h THR 292 Cb 0.79 1.18 -0.00 0.00 -1.74 0.00 0.00 68.15 68.38 1sa0 h THR 292 CO 0.06 0.25 0.06 0.78 0.37 0.00 0.00 175.52 177.05 1sa0 h ASN 293 N 0.30 0.00 0.36 4.18 2.35 -0.32 0.95 115.58 123.40 1sa0 h ASN 293 Ca 0.09 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.84 1sa0 h ASN 293 Cb 0.32 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.69 1sa0 h ASN 293 CO 0.00 0.00 -0.16 0.00 -1.65 0.00 0.00 177.43 175.62 1sa0 n ALA 294 N -2.37 2.86 0.15 -0.83 0.00 0.04 -3.63 120.51 116.73 1sa0 n ALA 294 Ca -0.01 -0.30 0.11 0.00 0.00 0.00 0.00 53.44 53.23 1sa0 n ALA 294 Cb 0.16 -1.27 0.06 0.00 0.00 0.00 0.00 19.45 18.40 1sa0 n ALA 294 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1sa0 n PHE 296 N -2.88 3.20 -3.61 0.00 3.01 -1.23 -4.92 117.46 111.03 1sa0 n PHE 296 Ca 0.01 -3.34 -0.10 0.00 1.01 0.00 0.00 57.45 55.03 1sa0 n PHE 296 Cb 0.57 -0.86 -0.10 0.00 -0.01 0.00 0.00 39.48 39.07 1sa0 n PHE 296 CO 0.00 0.00 0.00 -2.00 1.01 0.00 0.00 176.76 175.77 1sa0 s GLU 297 N -3.27 0.29 0.30 -1.08 2.56 -1.25 -5.05 118.70 111.20 1sa0 s GLU 297 Ca 0.40 0.88 0.02 0.00 0.00 0.00 0.00 54.97 56.27 1sa0 s GLU 297 Cb 0.17 0.10 0.58 0.00 2.00 0.00 0.00 34.13 36.98 1sa0 s GLU 297 CO -0.04 -0.33 1.87 -1.00 -0.56 0.00 0.00 175.26 175.21 1sa0 h PRO 298 N 8.20 0.94 0.00 4.30 0.13 -1.91 -2.62 132.00 141.04 1sa0 h PRO 298 Ca -0.16 -0.06 0.00 0.00 -0.87 0.00 0.00 66.00 64.91 1sa0 h PRO 298 Cb 1.12 -0.21 0.00 0.00 0.13 0.00 0.00 31.00 32.03 1sa0 h PRO 298 CO 0.15 0.62 0.00 0.00 -0.23 0.00 0.00 178.00 178.54 1sa0 n ALA 299 N -2.38 1.26 -1.11 -0.56 0.00 -1.26 -1.66 120.51 114.80 1sa0 n ALA 299 Ca 0.16 -0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.68 1sa0 n ALA 299 Cb 0.30 -1.02 0.11 0.00 0.00 0.00 0.00 19.45 18.84 1sa0 n ALA 299 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1sa0 n ASN 300 N -1.28 1.98 -3.13 0.00 3.02 -0.99 -4.81 115.26 110.04 1sa0 n ASN 300 Ca 0.00 -2.83 0.00 0.00 -0.03 0.00 0.00 54.58 51.73 1sa0 n ASN 300 Cb 0.01 -0.36 0.00 0.00 -0.61 0.00 0.00 39.78 38.82 1sa0 n ASN 300 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1sa0 n GLN 301 N -1.15 1.38 0.00 3.52 6.02 -0.67 -3.79 117.38 122.69 1sa0 n GLN 301 Ca 0.12 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.11 1sa0 n GLN 301 Cb 0.61 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.87 1sa0 n GLN 301 CO 0.00 0.00 0.00 -1.33 -1.01 0.00 0.00 177.06 174.72 1sa0 n MET 302 N 0.00 0.88 -3.58 -1.09 2.81 -1.07 -4.72 117.12 110.35 1sa0 n MET 302 Ca 0.00 -0.03 -0.21 0.00 -1.81 0.00 0.00 57.70 55.65 1sa0 n MET 302 Cb 0.00 -0.25 -0.15 0.00 -0.71 0.00 0.00 33.22 32.11 1sa0 n MET 302 CO 0.00 0.00 0.00 0.08 1.51 0.00 0.00 175.97 177.56 1sa0 s VAL 303 N -0.13 -0.21 0.04 2.03 1.01 -1.26 -0.02 120.40 121.86 1sa0 s VAL 303 Ca 0.00 -0.02 -0.30 0.00 0.00 0.00 0.00 61.98 61.66 1sa0 s VAL 303 Cb 0.00 -0.54 -0.09 0.00 0.00 0.00 0.00 36.38 35.75 1sa0 s VAL 303 CO 0.00 -0.15 1.92 -0.75 0.00 0.00 0.00 175.10 176.12 1sa0 s LYS 304 N 2.24 4.15 0.00 2.72 2.47 -1.26 -4.81 119.74 125.24 1sa0 s LYS 304 Ca 0.04 2.57 0.00 0.00 -1.56 0.00 0.00 55.97 57.03 1sa0 s LYS 304 Cb -0.15 -4.07 0.00 0.00 -1.46 0.00 0.00 37.83 32.15 1sa0 s LYS 304 CO -0.09 -0.93 0.00 0.00 0.16 0.00 0.00 175.35 174.49 1sa0 s ASP 306 N -4.00 -1.11 0.00 0.00 1.47 -1.26 -4.93 116.67 106.84 1sa0 s ASP 306 Ca 0.00 1.57 0.25 0.00 1.18 0.00 0.00 52.55 55.55 1sa0 s ASP 306 Cb 0.00 2.13 1.33 0.00 -0.34 0.00 0.00 42.92 46.03 1sa0 s ASP 306 CO 0.00 -0.22 1.88 -2.65 0.68 0.00 0.00 175.17 174.85 1sa0 n PRO 307 N 5.22 1.23 0.00 2.11 -0.02 -1.26 -2.91 135.00 139.38 1sa0 n PRO 307 Ca -0.14 -0.34 0.09 0.00 -2.02 0.00 0.00 63.50 61.10 1sa0 n PRO 307 Cb 0.51 -1.41 0.42 0.00 -0.02 0.00 0.00 33.50 33.00 1sa0 n PRO 307 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1sa0 n ARG 308 N -0.52 0.06 -0.05 -0.52 1.74 -1.26 -3.59 116.66 112.52 1sa0 n ARG 308 Ca 0.19 0.16 -0.03 0.00 -0.77 0.00 0.00 57.85 57.39 1sa0 n ARG 308 Cb 0.17 -1.50 -0.01 0.00 -1.02 0.00 0.00 32.46 30.10 1sa0 n ARG 308 CO 0.00 0.00 0.00 1.58 -1.52 0.00 0.00 177.63 177.69 1sa0 n HIS 309 N -1.45 0.48 0.00 -1.55 -0.00 -1.14 -5.02 115.22 106.53 1sa0 n HIS 309 Ca 0.06 0.21 0.00 0.00 -0.00 0.00 0.00 57.72 57.99 1sa0 n HIS 309 Cb 0.21 -0.53 0.00 0.00 -0.00 0.00 0.00 29.99 29.67 1sa0 n HIS 309 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1sa0 n GLY 310 N 1.63 0.20 3.33 1.57 0.00 -1.24 -5.05 105.19 105.63 1sa0 n GLY 310 Ca -0.05 -1.44 -0.17 0.00 0.00 0.00 0.00 46.02 44.35 1sa0 n GLY 310 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1sa0 s LYS 311 N 0.00 1.35 -0.10 1.61 -0.14 -1.26 -4.93 119.74 116.27 1sa0 s LYS 311 Ca 0.00 -1.69 -0.01 0.00 -1.36 0.00 0.00 55.97 52.91 1sa0 s LYS 311 Cb 0.00 -0.55 -0.03 0.00 -1.68 0.00 0.00 37.83 35.57 1sa0 s LYS 311 CO 0.00 -0.14 -0.05 0.71 -0.76 0.00 0.00 175.35 175.12 1sa0 s TYR 312 N -3.48 3.00 -0.14 3.18 1.51 -0.86 -1.49 117.35 119.06 1sa0 s TYR 312 Ca 0.30 -0.06 0.17 0.00 -1.01 0.00 0.00 57.07 56.46 1sa0 s TYR 312 Cb 0.06 -1.80 0.43 0.00 -0.11 0.00 0.00 41.96 40.54 1sa0 s TYR 312 CO 0.09 0.23 1.20 0.00 -1.11 0.00 0.00 175.55 175.96 1sa0 n MET 313 N 2.64 1.10 0.00 -0.62 0.00 -0.85 -0.40 117.12 118.99 1sa0 n MET 313 Ca -0.18 -2.88 0.00 0.00 0.00 0.00 0.00 57.70 54.64 1sa0 n MET 313 Cb 0.53 -1.06 0.00 0.00 0.00 0.00 0.00 33.22 32.69 1sa0 n MET 313 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1sa0 n ALA 314 N -0.51 0.00 -2.64 3.17 0.00 -1.26 -4.88 120.51 114.39 1sa0 n ALA 314 Ca 0.15 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.27 1sa0 n ALA 314 Cb 0.87 0.00 -0.09 0.00 0.00 0.00 0.00 19.45 20.23 1sa0 n ALA 314 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1sa0 s LEU 317 N 0.51 2.40 -0.35 0.00 1.43 -0.90 -1.04 118.68 120.74 1sa0 s LEU 317 Ca -0.05 -0.55 0.00 0.00 -1.03 0.00 0.00 54.13 52.50 1sa0 s LEU 317 Cb -0.08 -1.57 0.09 0.00 0.03 0.00 0.00 46.19 44.66 1sa0 s LEU 317 CO -0.01 0.01 0.08 -0.76 0.23 0.00 0.00 176.35 175.90 1sa0 s LEU 318 N 1.27 4.65 0.39 1.79 1.02 -1.26 -0.96 118.68 125.58 1sa0 s LEU 318 Ca 0.03 -1.86 -0.03 0.00 0.02 0.00 0.00 54.13 52.29 1sa0 s LEU 318 Cb -0.14 -1.71 -0.04 0.00 0.02 0.00 0.00 46.19 44.32 1sa0 s LEU 318 CO -0.08 -0.40 0.64 -0.31 0.02 0.00 0.00 176.35 176.22 1sa0 s TYR 319 N 1.08 3.52 -0.13 0.29 1.51 0.66 0.25 117.35 124.53 1sa0 s TYR 319 Ca 0.05 0.58 -0.07 0.00 -1.01 0.00 0.00 57.07 56.63 1sa0 s TYR 319 Cb -0.21 -2.09 0.06 0.00 -0.11 0.00 0.00 41.96 39.61 1sa0 s TYR 319 CO -0.05 -0.02 0.31 1.03 -1.11 0.00 0.00 175.55 175.71 1sa0 s ARG 320 N -4.33 0.26 0.00 -0.62 0.52 0.71 -1.81 118.95 113.69 1sa0 s ARG 320 Ca 0.44 0.67 0.00 0.00 -0.52 0.00 0.00 55.73 56.32 1sa0 s ARG 320 Cb -0.10 -0.05 0.00 0.00 0.52 0.00 0.00 34.95 35.32 1sa0 s ARG 320 CO 0.38 -0.18 0.00 0.41 0.02 0.00 0.00 175.30 175.93 1sa0 n GLY 321 N 4.46 0.20 3.55 -3.53 0.00 -1.01 -0.99 105.19 107.88 1sa0 n GLY 321 Ca -0.21 -1.96 -0.40 0.00 0.00 0.00 0.00 46.02 43.44 1sa0 n GLY 321 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1sa0 s ASP 322 N -4.00 6.09 -0.23 1.61 2.15 -1.20 -4.04 116.67 117.05 1sa0 s ASP 322 Ca 0.00 -0.51 -0.10 0.00 0.43 0.00 0.00 52.55 52.37 1sa0 s ASP 322 Cb 0.00 -2.56 0.09 0.00 -0.30 0.00 0.00 42.92 40.15 1sa0 s ASP 322 CO 0.00 -1.87 0.52 -0.69 -0.17 0.00 0.00 175.17 172.96 1sa0 s VAL 323 N 6.09 -0.43 -0.05 1.11 1.01 -1.26 -4.85 120.40 122.02 1sa0 s VAL 323 Ca 0.41 0.08 -0.04 0.00 0.00 0.00 0.00 61.98 62.42 1sa0 s VAL 323 Cb -0.07 -0.79 -0.04 0.00 0.00 0.00 0.00 36.38 35.48 1sa0 s VAL 323 CO 0.12 0.03 0.16 -0.69 0.00 0.00 0.00 175.10 174.72 1sa0 s VAL 324 N 2.16 5.43 0.30 2.92 1.01 -1.26 -4.99 120.40 125.97 1sa0 s VAL 324 Ca -0.06 -0.03 0.02 0.00 0.00 0.00 0.00 61.98 61.91 1sa0 s VAL 324 Cb -0.10 -3.47 0.29 0.00 0.00 0.00 0.00 36.38 33.10 1sa0 s VAL 324 CO -0.16 0.44 1.86 -0.65 0.00 0.00 0.00 175.10 176.59 1sa0 h PRO 325 N 4.28 0.94 -1.00 2.72 0.11 -2.01 -2.78 132.00 134.26 1sa0 h PRO 325 Ca -0.51 -0.06 0.39 0.00 0.11 0.00 0.00 66.00 65.93 1sa0 h PRO 325 Cb 1.20 -0.21 -0.18 0.00 0.11 0.00 0.00 31.00 31.92 1sa0 h PRO 325 CO 0.64 0.62 0.43 -0.22 -0.21 0.00 0.00 178.00 179.27 1sa0 h LYS 326 N 0.97 0.01 0.05 1.05 3.64 -2.00 0.22 116.57 120.51 1sa0 h LYS 326 Ca 0.47 -0.00 -0.08 0.00 -1.27 0.00 0.00 60.65 59.77 1sa0 h LYS 326 Cb 0.46 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.28 1sa0 h LYS 326 CO -0.23 0.01 -0.39 -0.44 -2.27 0.00 0.00 179.45 176.13 1sa0 h ASP 327 N 0.01 0.16 -1.29 4.20 3.32 -1.92 -3.17 116.42 117.73 1sa0 h ASP 327 Ca 0.79 -0.95 0.37 0.00 0.02 0.00 0.00 57.03 57.27 1sa0 h ASP 327 Cb 2.02 -0.05 -0.07 0.00 0.22 0.00 0.00 39.33 41.45 1sa0 h ASP 327 CO -0.80 1.18 0.90 0.58 -1.72 0.00 0.00 179.24 179.38 1sa0 h VAL 328 N -0.78 0.34 0.43 -1.35 2.07 -1.04 0.35 116.25 116.27 1sa0 h VAL 328 Ca -0.08 -0.03 -0.02 0.00 0.82 0.00 0.00 66.70 67.39 1sa0 h VAL 328 Cb 1.25 0.25 0.00 0.00 -1.52 0.00 0.00 31.29 31.27 1sa0 h VAL 328 CO 0.04 0.01 -0.21 0.78 0.02 0.00 0.00 177.57 178.21 1sa0 h ASN 329 N 0.08 -0.49 0.03 0.57 -0.26 -1.10 -2.56 115.58 111.85 1sa0 h ASN 329 Ca 0.65 -0.00 0.00 0.00 -0.56 0.00 0.00 56.30 56.39 1sa0 h ASN 329 Cb 2.38 0.13 0.00 0.00 -1.06 0.00 0.00 38.32 39.77 1sa0 h ASN 329 CO -0.11 -0.06 0.00 0.00 -1.06 0.00 0.00 177.43 176.20 1sa0 h ALA 330 N -1.11 1.00 0.18 -0.83 0.00 -0.82 0.18 119.26 117.86 1sa0 h ALA 330 Ca -0.06 0.00 -0.31 0.00 0.00 0.00 0.00 54.91 54.54 1sa0 h ALA 330 Cb 0.46 0.00 0.03 0.00 0.00 0.00 0.00 17.79 18.28 1sa0 h ALA 330 CO 0.10 0.00 -1.34 0.00 0.00 0.00 0.00 179.25 178.01 1sa0 h ALA 331 N 2.00 -0.04 -0.15 0.00 0.00 -0.49 -3.00 119.26 117.58 1sa0 h ALA 331 Ca 0.00 -0.84 -0.03 0.00 0.00 0.00 0.00 54.91 54.05 1sa0 h ALA 331 Cb 0.01 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.91 1sa0 h ALA 331 CO 0.00 0.76 -0.00 0.82 0.00 0.00 0.00 179.25 180.83 1sa0 h ILE 332 N 0.17 1.26 -0.26 0.00 2.04 -0.31 -0.29 117.51 120.12 1sa0 h ILE 332 Ca -0.20 -0.86 0.06 0.00 1.00 0.00 0.00 64.86 64.86 1sa0 h ILE 332 Cb 2.03 1.52 -0.08 0.00 -0.74 0.00 0.00 36.82 39.56 1sa0 h ILE 332 CO 0.25 0.25 -0.41 0.00 0.00 0.00 0.00 178.15 178.24 1sa0 h ALA 333 N 0.76 -0.48 0.00 1.87 0.00 -1.03 -0.43 119.26 119.95 1sa0 h ALA 333 Ca 0.04 0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 1sa0 h ALA 333 Cb 0.39 0.81 -0.00 0.00 0.00 0.00 0.00 17.79 18.98 1sa0 h ALA 333 CO 0.01 -0.88 -0.12 1.79 0.00 0.00 0.00 179.25 180.05 1sa0 h THR 334 N -0.40 0.28 0.00 0.00 1.35 -1.53 -2.31 112.91 110.30 1sa0 h THR 334 Ca 0.11 -0.89 0.00 0.00 -0.55 0.00 0.00 66.41 65.08 1sa0 h THR 334 Cb 0.60 1.70 0.00 0.00 -1.73 0.00 0.00 68.15 68.72 1sa0 h THR 334 CO -0.47 0.12 0.00 -0.38 -0.25 0.00 0.00 175.52 174.53 1sa0 n ILE 335 N -3.24 0.74 -0.08 6.82 5.41 -0.12 -3.43 119.36 125.46 1sa0 n ILE 335 Ca 0.01 0.12 -0.21 0.00 1.00 0.00 0.00 62.75 63.67 1sa0 n ILE 335 Cb 0.40 -0.94 -0.12 0.00 -0.71 0.00 0.00 39.64 38.26 1sa0 n ILE 335 CO 0.00 0.00 0.00 2.29 0.00 0.00 0.00 176.55 178.84 1sa0 n LYS 336 N -1.96 0.68 -0.23 0.38 2.85 -0.77 -4.45 118.16 114.65 1sa0 n LYS 336 Ca 0.04 0.23 -0.05 0.00 -1.05 0.00 0.00 58.31 57.47 1sa0 n LYS 336 Cb 0.26 -1.60 0.00 0.00 -0.65 0.00 0.00 35.03 33.04 1sa0 n LYS 336 CO 0.00 0.00 0.00 1.15 -0.05 0.00 0.00 177.40 178.50 1sa0 h THR 337 N -0.14 0.13 -2.20 0.58 2.02 -1.54 -3.12 112.91 108.64 1sa0 h THR 337 Ca -0.52 0.00 -0.58 0.00 0.77 0.00 0.00 66.41 66.08 1sa0 h THR 337 Cb 1.88 0.13 -0.42 0.00 -1.74 0.00 0.00 68.15 68.00 1sa0 h THR 337 CO -0.06 0.00 -0.72 0.29 0.37 0.00 0.00 175.52 175.40 1sa0 n LYS 338 N -5.43 2.52 -3.96 6.66 4.01 -1.26 -5.06 118.16 115.64 1sa0 n LYS 338 Ca 0.04 -4.50 -0.10 0.00 -0.51 0.00 0.00 58.31 53.24 1sa0 n LYS 338 Cb 0.36 -2.10 -0.02 0.00 -0.51 0.00 0.00 35.03 32.75 1sa0 n LYS 338 CO 0.00 0.00 0.00 -0.98 -1.11 0.00 0.00 177.40 175.31 1sa0 s ARG 339 N -2.77 1.87 -1.08 1.97 1.70 -1.18 -5.04 118.95 114.42 1sa0 s ARG 339 Ca 0.43 -1.42 -0.12 0.00 -0.47 0.00 0.00 55.73 54.15 1sa0 s ARG 339 Cb 0.22 0.52 0.22 0.00 -0.57 0.00 0.00 34.95 35.34 1sa0 s ARG 339 CO -0.08 -0.82 1.17 0.99 -1.08 0.00 0.00 175.30 175.48 1sa0 s THR 340 N -3.26 5.48 0.06 4.99 2.01 -1.26 -4.88 115.64 118.77 1sa0 s THR 340 Ca 0.21 -2.81 -0.28 0.00 0.31 0.00 0.00 61.69 59.12 1sa0 s THR 340 Cb -0.02 -4.71 -0.15 0.00 0.01 0.00 0.00 72.50 67.63 1sa0 s THR 340 CO 0.13 -1.34 1.43 0.16 -0.69 0.00 0.00 174.62 174.31 1sa0 h ILE 341 N 4.41 0.00 -6.77 1.82 3.07 -1.91 -3.48 117.51 114.66 1sa0 h ILE 341 Ca 0.21 0.00 -0.38 0.00 1.55 0.00 0.00 64.86 66.24 1sa0 h ILE 341 Cb 0.92 0.00 -0.01 0.00 -0.27 0.00 0.00 36.82 37.46 1sa0 h ILE 341 CO 1.06 0.00 -0.71 0.00 -1.05 0.00 0.00 178.15 177.45 1sa0 n GLN 342 N -4.80 -0.69 -2.81 0.16 6.02 -1.26 -4.78 117.38 109.21 1sa0 n GLN 342 Ca -0.11 0.11 -0.28 0.00 -0.01 0.00 0.00 57.00 56.70 1sa0 n GLN 342 Cb 0.39 -1.39 -0.01 0.00 1.02 0.00 0.00 30.24 30.24 1sa0 n GLN 342 CO 0.00 0.00 0.00 0.12 -1.01 0.00 0.00 177.06 176.17 1sa0 s PHE 343 N -3.49 3.52 -0.36 1.08 5.36 -1.26 -2.04 117.98 120.79 1sa0 s PHE 343 Ca 0.21 0.84 -0.18 0.00 -0.96 0.00 0.00 56.93 56.83 1sa0 s PHE 343 Cb -0.12 -2.30 -0.00 0.00 -0.34 0.00 0.00 43.02 40.26 1sa0 s PHE 343 CO 0.64 -0.16 0.50 0.54 -1.46 0.00 0.00 175.22 175.28 1sa0 s VAL 344 N -2.54 5.02 0.00 3.12 0.11 0.47 -4.77 120.40 121.80 1sa0 s VAL 344 Ca 0.48 0.24 0.00 0.00 -2.93 0.00 0.00 61.98 59.76 1sa0 s VAL 344 Cb -0.10 -3.97 0.00 0.00 -1.53 0.00 0.00 36.38 30.77 1sa0 s VAL 344 CO 0.39 -0.25 0.00 -0.67 -3.33 0.00 0.00 175.10 171.24 1sa0 n ASP 345 N 5.73 0.00 -2.05 3.54 -0.08 -1.26 -1.47 116.55 120.96 1sa0 n ASP 345 Ca -0.05 0.00 -0.19 0.00 -1.51 0.00 0.00 54.79 53.04 1sa0 n ASP 345 Cb 0.49 0.00 0.20 0.00 2.34 0.00 0.00 41.12 44.15 1sa0 n ASP 345 CO 0.00 0.00 0.00 -2.67 0.12 0.00 0.00 177.20 174.65 1sa0 n TRP 346 N 0.00 2.71 -3.63 -0.67 4.27 -1.26 -4.92 117.44 113.94 1sa0 n TRP 346 Ca 0.00 -1.73 -0.19 0.00 -3.89 0.00 0.00 57.50 51.69 1sa0 n TRP 346 Cb 0.00 -0.85 -0.16 0.00 -1.36 0.00 0.00 31.31 28.94 1sa0 n TRP 346 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1sa0 n PRO 348 N 5.32 0.00 0.00 0.00 -0.02 -1.26 -4.60 135.00 134.43 1sa0 n PRO 348 Ca -0.05 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.43 1sa0 n PRO 348 Cb 0.50 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.98 1sa0 n PRO 348 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 1sa0 n THR 349 N 0.00 0.00 0.00 3.45 -1.04 -1.26 -4.96 114.28 110.47 1sa0 n THR 349 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1sa0 n THR 349 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 1sa0 n THR 349 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1sa0 n GLY 350 N 0.00 0.00 3.08 3.41 0.00 -1.26 -4.92 105.19 105.50 1sa0 n GLY 350 Ca 0.00 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.88 1sa0 n GLY 350 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1sa0 n PHE 351 N 0.00 -2.12 -2.58 1.61 0.99 -0.38 -4.93 117.46 110.05 1sa0 n PHE 351 Ca 0.00 0.78 -0.42 0.00 -0.00 0.00 0.00 57.45 57.81 1sa0 n PHE 351 Cb 0.00 -4.15 -0.02 0.00 -1.00 0.00 0.00 39.48 34.30 1sa0 n PHE 351 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 176.76 176.91 1sa0 s LYS 352 N -4.49 3.55 -0.04 -1.08 -0.14 -1.21 -4.87 119.74 111.46 1sa0 s LYS 352 Ca 0.30 0.32 -0.15 0.00 -1.36 0.00 0.00 55.97 55.08 1sa0 s LYS 352 Cb -0.04 -4.00 -0.05 0.00 -1.68 0.00 0.00 37.83 32.06 1sa0 s LYS 352 CO 0.65 -1.64 0.39 0.08 -0.76 0.00 0.00 175.35 174.08 1sa0 s VAL 353 N 4.91 5.10 -0.04 3.17 1.01 -1.26 -2.11 120.40 131.18 1sa0 s VAL 353 Ca 0.44 0.79 0.01 0.00 0.00 0.00 0.00 61.98 63.23 1sa0 s VAL 353 Cb -0.07 -3.70 0.02 0.00 0.00 0.00 0.00 36.38 32.63 1sa0 s VAL 353 CO 0.27 0.53 -0.05 -0.83 0.00 0.00 0.00 175.10 175.01 1sa0 s GLY 354 N -0.71 0.48 -0.07 4.51 0.00 -0.13 -4.90 107.32 106.50 1sa0 s GLY 354 Ca 0.23 -0.09 0.04 0.00 0.00 0.00 0.00 44.72 44.90 1sa0 s GLY 354 CO 0.12 0.37 -0.19 -0.42 0.00 0.00 0.00 173.10 172.97 1sa0 s ILE 355 N 0.83 2.58 -0.58 0.90 1.01 -1.26 -0.24 121.20 124.43 1sa0 s ILE 355 Ca -0.12 -0.88 0.04 0.00 0.00 0.00 0.00 60.65 59.69 1sa0 s ILE 355 Cb -0.14 -1.99 0.16 0.00 0.01 0.00 0.00 42.46 40.50 1sa0 s ILE 355 CO 0.01 0.57 0.40 0.21 0.00 0.00 0.00 174.94 176.13 1sa0 s ASN 356 N -0.29 3.82 0.18 3.58 3.04 -0.75 -4.94 114.94 119.58 1sa0 s ASN 356 Ca 0.01 -3.43 0.14 0.00 0.04 0.00 0.00 52.86 49.61 1sa0 s ASN 356 Cb -0.13 -1.27 0.60 0.00 -1.54 0.00 0.00 41.25 38.91 1sa0 s ASN 356 CO 0.03 -0.14 0.61 -1.22 -3.04 0.00 0.00 177.10 173.34 1sa0 n TYR 357 N 2.48 0.24 -1.63 0.43 0.53 -1.26 -2.39 117.16 115.57 1sa0 n TYR 357 Ca 0.19 0.24 -0.43 0.00 -1.02 0.00 0.00 57.90 56.88 1sa0 n TYR 357 Cb 0.38 -0.57 -0.03 0.00 -1.03 0.00 0.00 39.34 38.09 1sa0 n TYR 357 CO 0.00 0.00 0.00 -2.00 -1.02 0.00 0.00 176.86 173.84 1sa0 s GLU 358 N -4.17 3.44 0.67 -0.72 2.56 -1.26 -3.63 118.70 115.58 1sa0 s GLU 358 Ca -0.03 2.21 -0.17 0.00 0.00 0.00 0.00 54.97 56.98 1sa0 s GLU 358 Cb 0.12 -4.31 0.01 0.00 2.00 0.00 0.00 34.13 31.94 1sa0 s GLU 358 CO 0.33 -1.76 1.26 -2.14 -0.56 0.00 0.00 175.26 172.39 1sa0 s PRO 359 N 5.78 2.42 -0.60 4.30 0.02 -1.26 -3.63 135.00 142.02 1sa0 s PRO 359 Ca 0.97 1.95 -0.27 0.00 0.02 0.00 0.00 61.00 63.67 1sa0 s PRO 359 Cb -0.36 -1.84 0.01 0.00 0.02 0.00 0.00 34.50 32.33 1sa0 s PRO 359 CO 0.37 -1.67 1.48 -2.14 -0.33 0.00 0.00 177.00 174.72 1sa0 s PRO 360 N -3.55 3.15 0.23 5.54 0.02 -1.26 -4.93 135.00 134.20 1sa0 s PRO 360 Ca 0.80 0.36 -0.20 0.00 0.02 0.00 0.00 61.00 61.98 1sa0 s PRO 360 Cb -0.34 -4.19 -0.08 0.00 0.02 0.00 0.00 34.50 29.90 1sa0 s PRO 360 CO 0.41 -2.14 0.74 0.95 -0.33 0.00 0.00 177.00 176.63 1sa0 s THR 361 N 6.60 4.55 0.15 0.99 -4.23 -1.26 -4.23 115.64 118.21 1sa0 s THR 361 Ca 0.52 1.30 0.07 0.00 -1.18 0.00 0.00 61.69 62.40 1sa0 s THR 361 Cb -0.11 -3.85 -0.04 0.00 1.34 0.00 0.00 72.50 69.84 1sa0 s THR 361 CO 0.22 0.19 -0.14 0.68 -0.54 0.00 0.00 174.62 175.02 1sa0 s VAL 362 N -1.55 1.50 0.53 2.29 -7.23 -1.26 -4.96 120.40 109.72 1sa0 s VAL 362 Ca 0.44 -1.91 -0.21 0.00 -1.81 0.00 0.00 61.98 58.49 1sa0 s VAL 362 Cb -0.16 -1.75 -0.07 0.00 0.56 0.00 0.00 36.38 34.96 1sa0 s VAL 362 CO 0.21 -0.48 1.03 0.52 -0.31 0.00 0.00 175.10 176.08 1sa0 n VAL 363 N 0.19 3.21 0.03 1.32 0.31 -1.26 -4.95 118.33 117.18 1sa0 n VAL 363 Ca -0.13 -0.50 -0.13 0.00 -0.01 0.00 0.00 64.34 63.58 1sa0 n VAL 363 Cb 0.58 -1.23 -0.09 0.00 -0.91 0.00 0.00 33.84 32.19 1sa0 n VAL 363 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 1sa0 h PRO 364 N 1.02 -0.08 -0.33 5.55 0.11 -2.00 -2.93 132.00 133.34 1sa0 h PRO 364 Ca -0.47 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.64 1sa0 h PRO 364 Cb 1.34 0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.47 1sa0 h PRO 364 CO 0.54 0.31 0.00 0.41 -0.21 0.00 0.00 178.00 179.05 1sa0 n GLY 365 N -0.03 0.60 3.18 -0.55 0.00 -1.26 -4.97 105.19 102.16 1sa0 n GLY 365 Ca -0.08 -0.38 -0.26 0.00 0.00 0.00 0.00 46.02 45.29 1sa0 n GLY 365 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sa0 n GLY 366 N 1.07 -3.16 0.00 -0.02 0.00 -1.11 -4.98 105.19 96.99 1sa0 n GLY 366 Ca 0.12 -1.30 0.08 0.00 0.00 0.00 0.00 46.02 44.93 1sa0 n GLY 366 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1sa0 n ASP 367 N -3.93 0.84 -4.84 1.61 8.00 -1.26 -4.84 116.55 112.12 1sa0 n ASP 367 Ca 0.09 -0.73 -0.30 0.00 0.71 0.00 0.00 54.79 54.56 1sa0 n ASP 367 Cb 0.51 1.14 -0.05 0.00 -0.02 0.00 0.00 41.12 42.69 1sa0 n ASP 367 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1sa0 s LEU 368 N -3.03 4.05 0.43 0.64 1.02 -1.26 -1.13 118.68 119.41 1sa0 s LEU 368 Ca 0.04 0.10 0.06 0.00 0.02 0.00 0.00 54.13 54.34 1sa0 s LEU 368 Cb 0.12 -2.69 0.01 0.00 0.02 0.00 0.00 46.19 43.65 1sa0 s LEU 368 CO 0.68 0.15 0.59 0.00 0.02 0.00 0.00 176.35 177.80 1sa0 s ALA 369 N -1.50 4.25 0.48 4.21 0.00 -0.51 -4.45 121.76 124.24 1sa0 s ALA 369 Ca 0.32 -1.48 -0.24 0.00 0.00 0.00 0.00 51.96 50.56 1sa0 s ALA 369 Cb -0.12 -1.78 -0.07 0.00 0.00 0.00 0.00 23.12 21.15 1sa0 s ALA 369 CO 0.25 -0.32 1.34 -1.59 0.00 0.00 0.00 175.76 175.43 1sa0 s LYS 370 N -4.41 3.54 -0.01 0.00 -2.85 -1.26 -4.89 119.74 109.86 1sa0 s LYS 370 Ca 0.52 2.20 0.03 0.00 -1.00 0.00 0.00 55.97 57.72 1sa0 s LYS 370 Cb -0.10 -2.48 -0.01 0.00 -2.06 0.00 0.00 37.83 33.18 1sa0 s LYS 370 CO 0.34 -0.86 -0.09 0.14 0.10 0.00 0.00 175.35 174.98 1sa0 s VAL 371 N -1.30 0.74 0.32 1.79 -7.23 -1.26 -5.02 120.40 108.44 1sa0 s VAL 371 Ca 0.65 -0.39 0.03 0.00 -1.81 0.00 0.00 61.98 60.46 1sa0 s VAL 371 Cb -0.39 -0.63 0.29 0.00 0.56 0.00 0.00 36.38 36.21 1sa0 s VAL 371 CO 0.48 0.21 1.90 1.56 -0.31 0.00 0.00 175.10 178.95 1sa0 h GLN 372 N 5.98 0.88 -2.17 4.82 1.08 -1.95 -3.39 115.11 120.37 1sa0 h GLN 372 Ca -0.31 -0.05 -0.06 0.00 -1.45 0.00 0.00 58.65 56.77 1sa0 h GLN 372 Cb 1.18 -0.20 -0.21 0.00 -0.05 0.00 0.00 27.48 28.20 1sa0 h GLN 372 CO 0.49 0.58 0.06 -0.98 -0.95 0.00 0.00 178.83 178.04 1sa0 s ARG 373 N -5.82 0.80 0.03 1.46 1.70 -1.26 -3.23 118.95 112.63 1sa0 s ARG 373 Ca -0.11 0.77 0.00 0.00 -0.47 0.00 0.00 55.73 55.92 1sa0 s ARG 373 Cb 0.20 0.39 -0.03 0.00 -0.57 0.00 0.00 34.95 34.95 1sa0 s ARG 373 CO 0.79 -0.13 -0.04 0.00 -1.08 0.00 0.00 175.30 174.85 1sa0 s ALA 374 N 0.06 0.30 0.33 7.88 0.00 -0.16 -4.78 121.76 125.39 1sa0 s ALA 374 Ca -0.02 -0.80 0.10 0.00 0.00 0.00 0.00 51.96 51.24 1sa0 s ALA 374 Cb -0.04 0.17 -0.06 0.00 0.00 0.00 0.00 23.12 23.19 1sa0 s ALA 374 CO 0.02 -0.20 -0.06 0.08 0.00 0.00 0.00 175.76 175.61 1sa0 s VAL 375 N -2.17 2.50 0.00 0.00 1.01 -1.26 -0.20 120.40 120.27 1sa0 s VAL 375 Ca -0.08 -2.11 0.00 0.00 0.00 0.00 0.00 61.98 59.79 1sa0 s VAL 375 Cb -0.05 -2.68 0.00 0.00 0.00 0.00 0.00 36.38 33.65 1sa0 s VAL 375 CO -0.03 -0.23 0.00 0.00 0.00 0.00 0.00 175.10 174.84 1sa0 n MET 377 N -1.94 -2.10 -3.83 0.00 0.00 -1.20 -2.77 117.12 105.28 1sa0 n MET 377 Ca 0.00 1.79 -0.36 0.00 0.00 0.00 0.00 57.70 59.12 1sa0 n MET 377 Cb 0.31 -1.92 -0.13 0.00 0.00 0.00 0.00 33.22 31.47 1sa0 n MET 377 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 175.97 175.46 1sa0 s LEU 378 N -0.22 3.71 -0.01 -0.89 1.43 -0.20 -2.44 118.68 120.04 1sa0 s LEU 378 Ca -0.07 -0.86 0.07 0.00 -1.03 0.00 0.00 54.13 52.24 1sa0 s LEU 378 Cb 0.00 -1.80 -0.02 0.00 0.03 0.00 0.00 46.19 44.40 1sa0 s LEU 378 CO 0.20 -0.19 -0.23 -0.94 0.23 0.00 0.00 176.35 175.43 1sa0 s SER 379 N 1.41 3.37 -0.70 2.29 1.04 0.10 -1.67 113.70 119.54 1sa0 s SER 379 Ca 0.01 -0.41 -0.09 0.00 0.48 0.00 0.00 55.95 55.93 1sa0 s SER 379 Cb -0.18 -0.48 0.18 0.00 0.10 0.00 0.00 66.02 65.65 1sa0 s SER 379 CO 0.00 0.31 0.58 0.21 0.98 0.00 0.00 173.24 175.32 1sa0 s ASN 380 N -0.79 5.99 0.36 7.02 3.04 -0.48 0.14 114.94 130.22 1sa0 s ASN 380 Ca 0.11 -2.66 0.07 0.00 0.04 0.00 0.00 52.86 50.42 1sa0 s ASN 380 Cb -0.10 -2.04 -0.01 0.00 -1.54 0.00 0.00 41.25 37.56 1sa0 s ASN 380 CO 0.00 -0.51 0.48 0.28 -3.04 0.00 0.00 177.10 174.32 1sa0 s THR 381 N 0.23 3.75 -0.51 -5.21 -1.32 -1.26 -2.00 115.64 109.32 1sa0 s THR 381 Ca 0.16 -1.02 0.24 0.00 -1.21 0.00 0.00 61.69 59.85 1sa0 s THR 381 Cb -0.17 -3.29 0.09 0.00 -1.51 0.00 0.00 72.50 67.63 1sa0 s THR 381 CO -0.05 -0.12 1.32 0.71 -2.21 0.00 0.00 174.62 174.27 1sa0 h THR 382 N 0.85 0.00 0.00 5.08 1.35 -1.62 -3.32 112.91 115.26 1sa0 h THR 382 Ca -0.44 -0.69 0.00 0.00 -0.55 0.00 0.00 66.41 64.73 1sa0 h THR 382 Cb 1.26 1.34 0.00 0.00 -1.73 0.00 0.00 68.15 69.02 1sa0 h THR 382 CO 0.51 0.00 0.00 0.00 -0.25 0.00 0.00 175.52 175.78 1sa0 n ALA 383 N -1.95 2.30 0.40 6.62 0.00 -1.26 -2.53 120.51 124.09 1sa0 n ALA 383 Ca 0.03 -0.12 0.13 0.00 0.00 0.00 0.00 53.44 53.48 1sa0 n ALA 383 Cb 0.48 -1.42 0.47 0.00 0.00 0.00 0.00 19.45 18.98 1sa0 n ALA 383 CO 0.00 0.00 0.00 0.97 0.00 0.00 0.00 177.50 178.47 1sa0 h ILE 384 N 0.00 0.00 0.00 0.00 -0.00 -1.94 -2.42 117.51 113.15 1sa0 h ILE 384 Ca 0.00 -0.47 0.00 0.00 -0.00 0.00 0.00 64.86 64.39 1sa0 h ILE 384 Cb 0.26 1.36 0.00 0.00 -0.00 0.00 0.00 36.82 38.44 1sa0 h ILE 384 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 178.15 178.15 1sa0 n ALA 385 N -1.89 1.98 0.32 0.18 0.00 -1.05 -2.37 120.51 117.68 1sa0 n ALA 385 Ca 0.03 -0.08 0.15 0.00 0.00 0.00 0.00 53.44 53.54 1sa0 n ALA 385 Cb 0.34 -1.31 0.66 0.00 0.00 0.00 0.00 19.45 19.14 1sa0 n ALA 385 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1sa0 h GLU 386 N 0.00 0.00 0.00 0.00 5.08 -1.66 -1.81 114.58 116.19 1sa0 h GLU 386 Ca 0.00 0.00 -0.30 0.00 -1.00 0.00 0.00 59.36 58.06 1sa0 h GLU 386 Cb 0.22 0.00 -0.05 0.00 0.50 0.00 0.00 28.75 29.42 1sa0 h GLU 386 CO 0.00 0.00 -1.74 0.00 -1.00 0.00 0.00 179.01 176.27 1sa0 n ALA 387 N -1.93 1.49 0.27 3.43 0.00 -1.00 -3.03 120.51 119.74 1sa0 n ALA 387 Ca 0.01 -0.78 0.16 0.00 0.00 0.00 0.00 53.44 52.83 1sa0 n ALA 387 Cb 0.23 -0.83 0.65 0.00 0.00 0.00 0.00 19.45 19.50 1sa0 n ALA 387 CO 0.00 0.00 0.00 -1.49 0.00 0.00 0.00 177.50 176.01 1sa0 h TRP 388 N 0.00 0.00 0.01 0.00 -0.00 -1.46 -3.03 115.95 111.47 1sa0 h TRP 388 Ca -0.30 0.00 -0.00 0.00 -0.00 0.00 0.00 58.89 58.59 1sa0 h TRP 388 Cb 2.02 0.00 0.00 0.00 -0.00 0.00 0.00 29.16 31.18 1sa0 h TRP 388 CO 0.00 0.02 -0.00 0.00 -0.00 0.00 0.00 178.44 178.46 1sa0 h ALA 389 N 1.98 -0.01 -1.14 1.49 0.00 -1.52 -2.84 119.26 117.21 1sa0 h ALA 389 Ca -0.00 -0.29 0.32 0.00 0.00 0.00 0.00 54.91 54.95 1sa0 h ALA 389 Cb 0.55 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.28 1sa0 h ALA 389 CO 0.00 -0.02 0.79 0.00 0.00 0.00 0.00 179.25 180.03 1sa0 h ARG 390 N -0.99 0.12 0.07 0.00 3.08 -1.52 -0.58 114.38 114.56 1sa0 h ARG 390 Ca -0.00 -0.01 -0.15 0.00 0.07 0.00 0.00 59.98 59.89 1sa0 h ARG 390 Cb 0.58 -0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.60 1sa0 h ARG 390 CO 0.00 0.08 -0.76 1.25 -1.07 0.00 0.00 179.97 179.47 1sa0 h LEU 391 N 0.12 0.22 -0.22 3.04 5.85 -1.64 -3.27 115.31 119.41 1sa0 h LEU 391 Ca 0.58 -0.87 0.06 0.00 0.84 0.00 0.00 57.88 58.48 1sa0 h LEU 391 Cb 2.04 -0.07 -0.06 0.00 0.37 0.00 0.00 40.66 42.94 1sa0 h LEU 391 CO -0.11 1.33 -0.17 0.44 -0.34 0.00 0.00 178.44 179.60 1sa0 h ASP 392 N -0.66 -0.54 -0.47 1.25 3.45 -0.91 -1.29 116.42 117.25 1sa0 h ASP 392 Ca -0.17 0.11 0.09 0.00 0.43 0.00 0.00 57.03 57.50 1sa0 h ASP 392 Cb 1.41 0.27 -0.10 0.00 -0.56 0.00 0.00 39.33 40.35 1sa0 h ASP 392 CO 0.02 -0.21 -0.28 -0.74 -1.57 0.00 0.00 179.24 176.47 1sa0 h HIS 393 N -0.17 -0.74 0.30 4.55 2.76 -1.35 1.18 115.15 121.69 1sa0 h HIS 393 Ca 0.13 0.06 -0.00 0.00 -2.20 0.00 0.00 60.37 58.35 1sa0 h HIS 393 Cb 0.36 0.39 -0.03 0.00 1.55 0.00 0.00 27.41 29.69 1sa0 h HIS 393 CO -0.32 -0.35 -0.43 0.87 -1.30 0.00 0.00 177.93 176.40 1sa0 h LYS 394 N -0.17 -0.73 -0.10 5.26 1.57 -1.52 -0.45 116.57 120.43 1sa0 h LYS 394 Ca 0.21 0.05 0.03 0.00 -1.87 0.00 0.00 60.65 59.07 1sa0 h LYS 394 Cb 0.51 0.17 -0.06 0.00 0.08 0.00 0.00 32.23 32.92 1sa0 h LYS 394 CO -0.57 -0.49 -0.53 0.35 -0.57 0.00 0.00 179.45 177.64 1sa0 h PHE 395 N -0.76 -1.57 -0.87 -1.35 3.57 -0.16 -2.06 116.94 113.75 1sa0 h PHE 395 Ca -0.03 0.06 0.21 0.00 3.53 0.00 0.00 57.97 61.73 1sa0 h PHE 395 Cb 0.69 0.70 -0.13 0.00 2.79 0.00 0.00 35.95 40.01 1sa0 h PHE 395 CO -0.30 -0.55 0.32 -0.44 -2.23 0.00 0.00 178.31 175.11 1sa0 h ASP 396 N -0.60 0.21 1.01 0.41 3.32 0.15 0.19 116.42 121.11 1sa0 h ASP 396 Ca 0.03 0.16 -0.10 0.00 0.02 0.00 0.00 57.03 57.14 1sa0 h ASP 396 Cb 0.69 0.17 -0.01 0.00 0.22 0.00 0.00 39.33 40.40 1sa0 h ASP 396 CO -0.41 -0.04 -0.48 0.25 -1.72 0.00 0.00 179.24 176.83 1sa0 h LEU 397 N 0.34 0.00 0.05 1.55 6.46 -0.51 -2.16 115.31 121.03 1sa0 h LEU 397 Ca 0.53 0.00 -0.16 0.00 -0.12 0.00 0.00 57.88 58.13 1sa0 h LEU 397 Cb 1.01 0.00 -0.01 0.00 -0.73 0.00 0.00 40.66 40.94 1sa0 h LEU 397 CO -0.55 0.48 -0.83 0.24 -0.62 0.00 0.00 178.44 177.17 1sa0 h MET 398 N 0.00 0.11 -0.05 1.25 2.86 -0.56 -3.31 114.93 115.23 1sa0 h MET 398 Ca -0.00 -0.18 0.01 0.00 -2.06 0.00 0.00 59.70 57.47 1sa0 h MET 398 Cb 1.12 0.07 -0.00 0.00 0.06 0.00 0.00 31.60 32.84 1sa0 h MET 398 CO 0.06 1.09 0.13 -0.92 1.06 0.00 0.00 176.91 178.32 1sa0 h TYR 399 N -0.73 0.00 0.00 -0.22 3.20 -0.67 -0.88 116.97 117.67 1sa0 h TYR 399 Ca -0.19 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.68 1sa0 h TYR 399 Cb 1.37 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.64 1sa0 h TYR 399 CO 0.18 0.00 0.02 0.00 -1.64 0.00 0.00 178.16 176.72 1sa0 n ALA 400 N -2.14 1.06 -1.70 1.82 0.00 -0.82 -1.80 120.51 116.93 1sa0 n ALA 400 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.42 1sa0 n ALA 400 Cb 0.21 -0.95 0.00 0.00 0.00 0.00 0.00 19.45 18.70 1sa0 n ALA 400 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1sa0 n LYS 401 N -1.36 0.00 -1.91 0.00 5.02 -0.35 -4.98 118.16 114.58 1sa0 n LYS 401 Ca 0.00 -0.75 -0.17 0.00 -2.02 0.00 0.00 58.31 55.37 1sa0 n LYS 401 Cb 0.02 -0.45 -0.04 0.00 -0.02 0.00 0.00 35.03 34.53 1sa0 n LYS 401 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1sa0 n ARG 402 N 0.00 -1.63 0.00 1.97 5.12 -0.75 -4.83 116.66 116.54 1sa0 n ARG 402 Ca 0.00 0.90 0.00 0.00 -1.93 0.00 0.00 57.85 56.82 1sa0 n ARG 402 Cb 0.62 -5.36 0.00 0.00 -1.16 0.00 0.00 32.46 26.56 1sa0 n ARG 402 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1sa0 n ALA 403 N -0.48 0.00 -0.65 7.54 0.00 -1.11 -1.50 120.51 124.31 1sa0 n ALA 403 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.26 1sa0 n ALA 403 Cb 0.59 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.04 1sa0 n ALA 403 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1sa0 n PHE 404 N -3.28 0.00 -0.40 0.00 3.01 -1.26 -4.86 117.46 110.66 1sa0 n PHE 404 Ca 0.00 -0.07 0.34 0.00 1.01 0.00 0.00 57.45 58.72 1sa0 n PHE 404 Cb 0.00 -0.01 0.61 0.00 -0.01 0.00 0.00 39.48 40.07 1sa0 n PHE 404 CO 0.00 0.00 0.00 -0.24 1.01 0.00 0.00 176.76 177.53 1sa0 h VAL 405 N 1.21 0.13 -0.09 -4.37 3.04 -1.65 -1.75 116.25 112.78 1sa0 h VAL 405 Ca 0.00 -0.04 0.03 0.00 -1.01 0.00 0.00 66.70 65.68 1sa0 h VAL 405 Cb 0.54 0.01 -0.00 0.00 -2.01 0.00 0.00 31.29 29.83 1sa0 h VAL 405 CO 0.00 0.02 0.12 1.12 -1.01 0.00 0.00 177.57 177.82 1sa0 h HIS 406 N 0.11 0.00 0.00 3.17 2.07 -1.89 0.33 115.15 118.93 1sa0 h HIS 406 Ca 0.81 0.00 -0.10 0.00 -2.85 0.00 0.00 60.37 58.23 1sa0 h HIS 406 Cb 2.36 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 32.32 1sa0 h HIS 406 CO -0.01 0.00 -0.47 -1.49 -3.07 0.00 0.00 177.93 172.89 1sa0 h TRP 407 N 0.00 0.00 0.14 6.12 4.06 -1.71 -1.66 115.95 122.91 1sa0 h TRP 407 Ca 0.04 0.00 -0.23 0.00 2.06 0.00 0.00 58.89 60.76 1sa0 h TRP 407 Cb 0.27 0.00 0.01 0.00 -1.00 0.00 0.00 29.16 28.45 1sa0 h TRP 407 CO 0.00 0.47 -1.10 1.88 -3.56 0.00 0.00 178.44 176.14 1sa0 h TYR 408 N 0.00 0.54 -0.04 0.49 -1.99 -1.13 -3.16 116.97 111.68 1sa0 h TYR 408 Ca -0.00 -0.39 0.01 0.00 2.00 0.00 0.00 58.73 60.34 1sa0 h TYR 408 Cb 0.89 -0.02 -0.00 0.00 2.00 0.00 0.00 36.73 39.60 1sa0 h TYR 408 CO 0.00 1.42 0.03 0.28 -0.00 0.00 0.00 178.16 179.89 1sa0 h VAL 409 N -0.31 0.81 -0.51 -2.88 2.07 -1.38 -2.06 116.25 111.99 1sa0 h VAL 409 Ca -0.21 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.31 1sa0 h VAL 409 Cb 1.73 0.98 -0.02 0.00 -1.52 0.00 0.00 31.29 32.45 1sa0 h VAL 409 CO 0.13 0.00 0.32 1.23 0.02 0.00 0.00 177.57 179.26 1sa0 h GLY 410 N 0.00 0.73 2.00 2.17 0.00 -1.27 -2.34 103.07 104.36 1sa0 h GLY 410 Ca 0.02 -0.30 0.00 0.00 0.00 0.00 0.00 47.33 47.05 1sa0 h GLY 410 CO -0.00 0.29 0.00 0.83 0.00 0.00 0.00 176.54 177.66 1sa0 h GLU 411 N 0.69 0.00 0.00 4.80 4.39 -1.37 -3.46 114.58 119.62 1sa0 h GLU 411 Ca 0.18 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.88 1sa0 h GLU 411 Cb -0.03 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.62 1sa0 h GLU 411 CO -0.04 0.00 0.00 0.41 -1.16 0.00 0.00 179.01 178.22 1sa0 n GLY 412 N 0.72 1.48 3.96 -3.84 0.00 -0.88 -4.70 105.19 101.92 1sa0 n GLY 412 Ca 0.03 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.83 1sa0 n GLY 412 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1sa0 s MET 413 N 0.00 3.42 0.04 1.61 1.75 -0.98 -5.01 119.30 120.12 1sa0 s MET 413 Ca 0.00 -0.56 -0.11 0.00 -1.25 0.00 0.00 55.69 53.77 1sa0 s MET 413 Cb 0.00 -2.76 -0.05 0.00 2.84 0.00 0.00 34.83 34.86 1sa0 s MET 413 CO 0.00 0.23 0.37 -2.00 -0.65 0.00 0.00 175.02 172.97 1sa0 s GLU 414 N -4.18 3.76 0.52 4.11 2.56 -1.26 -4.31 118.70 119.89 1sa0 s GLU 414 Ca 0.38 0.19 0.20 0.00 0.00 0.00 0.00 54.97 55.75 1sa0 s GLU 414 Cb -0.09 -3.08 1.37 0.00 2.00 0.00 0.00 34.13 34.32 1sa0 s GLU 414 CO 0.33 0.62 2.13 0.93 -0.56 0.00 0.00 175.26 178.71 1sa0 h GLU 415 N 4.09 0.00 -0.93 4.30 5.08 -1.98 -1.92 114.58 123.22 1sa0 h GLU 415 Ca -0.50 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 57.85 1sa0 h GLU 415 Cb 1.20 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.41 1sa0 h GLU 415 CO 0.64 0.06 0.53 0.78 -1.00 0.00 0.00 179.01 180.03 1sa0 h GLY 416 N 0.23 1.37 2.00 -3.84 0.00 -2.00 -2.47 103.07 98.35 1sa0 h GLY 416 Ca -0.00 -0.60 -0.01 0.00 0.00 0.00 0.00 47.33 46.73 1sa0 h GLY 416 CO 0.01 0.57 -0.03 -2.09 0.00 0.00 0.00 176.54 175.00 1sa0 h GLU 417 N 1.29 0.00 -0.11 4.80 4.81 -1.75 0.92 114.58 124.54 1sa0 h GLU 417 Ca 0.33 0.00 -0.12 0.00 -0.13 0.00 0.00 59.36 59.44 1sa0 h GLU 417 Cb -0.01 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.37 1sa0 h GLU 417 CO -0.06 0.03 -0.41 0.74 -0.73 0.00 0.00 179.01 178.59 1sa0 h PHE 418 N 0.00 0.62 0.66 0.92 -1.00 -1.51 -2.49 116.94 114.14 1sa0 h PHE 418 Ca -0.00 -0.26 -0.03 0.00 2.81 0.00 0.00 57.97 60.49 1sa0 h PHE 418 Cb 0.12 -0.10 0.01 0.00 3.61 0.00 0.00 35.95 39.59 1sa0 h PHE 418 CO 0.00 1.01 -0.32 0.77 -1.61 0.00 0.00 178.31 178.16 1sa0 h SER 419 N 0.06 -0.75 -1.46 2.17 0.02 -1.27 -2.42 113.55 109.90 1sa0 h SER 419 Ca -0.02 0.03 0.42 0.00 -0.84 0.00 0.00 61.79 61.38 1sa0 h SER 419 Cb 1.04 0.20 -0.06 0.00 0.14 0.00 0.00 62.40 63.71 1sa0 h SER 419 CO 0.09 -0.47 1.12 -0.08 -1.14 0.00 0.00 176.83 176.34 1sa0 h GLU 420 N -1.03 0.00 0.06 3.45 4.81 -0.96 0.60 114.58 121.51 1sa0 h GLU 420 Ca -0.09 0.00 -0.23 0.00 -0.13 0.00 0.00 59.36 58.91 1sa0 h GLU 420 Cb 0.68 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.05 1sa0 h GLU 420 CO 0.15 0.00 -1.20 0.00 -0.73 0.00 0.00 179.01 177.23 1sa0 h ALA 421 N 1.13 0.20 -0.24 2.92 0.00 -1.39 -3.25 119.26 118.63 1sa0 h ALA 421 Ca 0.69 -1.07 -0.03 0.00 0.00 0.00 0.00 54.91 54.51 1sa0 h ALA 421 Cb 2.92 0.52 -0.01 0.00 0.00 0.00 0.00 17.79 21.21 1sa0 h ALA 421 CO -0.01 0.70 0.04 -0.09 0.00 0.00 0.00 179.25 179.89 1sa0 h ARG 422 N -0.61 0.34 -0.46 0.00 9.65 -0.57 -1.53 114.38 121.21 1sa0 h ARG 422 Ca -0.29 -0.05 0.13 0.00 -1.10 0.00 0.00 59.98 58.67 1sa0 h ARG 422 Cb 1.52 -0.06 -0.02 0.00 -1.39 0.00 0.00 29.97 30.02 1sa0 h ARG 422 CO -0.04 0.34 0.33 0.93 2.80 0.00 0.00 179.97 184.33 1sa0 h GLU 423 N 0.34 0.03 0.20 0.20 4.39 0.04 0.84 114.58 120.62 1sa0 h GLU 423 Ca 0.08 -0.00 -0.32 0.00 0.34 0.00 0.00 59.36 59.46 1sa0 h GLU 423 Cb 0.17 -0.01 0.02 0.00 -0.10 0.00 0.00 28.75 28.84 1sa0 h GLU 423 CO -0.00 0.02 -1.47 0.22 -1.16 0.00 0.00 179.01 176.62 1sa0 h ASP 424 N 0.03 0.65 0.51 1.42 3.58 -1.32 -3.09 116.42 118.22 1sa0 h ASP 424 Ca 0.22 -0.75 -0.05 0.00 0.42 0.00 0.00 57.03 56.86 1sa0 h ASP 424 Cb 0.83 -0.21 -0.01 0.00 1.72 0.00 0.00 39.33 41.66 1sa0 h ASP 424 CO -0.01 1.60 -0.26 0.24 -2.88 0.00 0.00 179.24 177.93 1sa0 h MET 425 N 0.11 0.00 -0.31 0.28 2.86 -0.91 0.51 114.93 117.48 1sa0 h MET 425 Ca -0.24 0.00 -0.11 0.00 -2.06 0.00 0.00 59.70 57.29 1sa0 h MET 425 Cb 2.09 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 33.75 1sa0 h MET 425 CO 0.23 0.26 -0.24 0.00 1.06 0.00 0.00 176.91 178.22 1sa0 h ALA 426 N 1.74 0.44 0.13 6.32 0.00 -0.94 -2.80 119.26 124.15 1sa0 h ALA 426 Ca -0.00 -0.38 -0.01 0.00 0.00 0.00 0.00 54.91 54.52 1sa0 h ALA 426 Cb 0.59 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1sa0 h ALA 426 CO 0.03 0.42 -0.06 0.00 0.00 0.00 0.00 179.25 179.64 1sa0 h ALA 427 N 0.73 -0.18 0.11 0.00 0.00 -1.09 -2.82 119.26 116.01 1sa0 h ALA 427 Ca 0.06 -0.16 0.02 0.00 0.00 0.00 0.00 54.91 54.83 1sa0 h ALA 427 Cb 0.80 0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.61 1sa0 h ALA 427 CO 0.06 -0.45 -0.38 1.25 0.00 0.00 0.00 179.25 179.73 1sa0 h LEU 428 N -0.47 -1.13 -1.87 0.00 5.85 -0.11 0.48 115.31 118.06 1sa0 h LEU 428 Ca -0.02 0.13 0.17 0.00 0.84 0.00 0.00 57.88 59.00 1sa0 h LEU 428 Cb 0.38 0.43 -0.02 0.00 0.37 0.00 0.00 40.66 41.81 1sa0 h LEU 428 CO 0.03 -0.46 0.58 -0.33 -0.34 0.00 0.00 178.44 177.92 1sa0 h GLU 429 N -0.61 0.00 -0.00 1.25 5.08 -1.53 0.26 114.58 119.03 1sa0 h GLU 429 Ca 0.03 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.38 1sa0 h GLU 429 Cb 0.64 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.89 1sa0 h GLU 429 CO -0.23 0.00 -0.05 -0.22 -1.00 0.00 0.00 179.01 177.51 1sa0 h LYS 430 N 0.00 0.04 -0.28 2.33 3.11 -0.72 -3.09 116.57 117.96 1sa0 h LYS 430 Ca 0.28 -0.04 0.05 0.00 -2.81 0.00 0.00 60.65 58.14 1sa0 h LYS 430 Cb 1.44 0.01 -0.05 0.00 -1.00 0.00 0.00 32.23 32.63 1sa0 h LYS 430 CO -0.00 0.77 -0.04 -0.44 -2.81 0.00 0.00 179.45 176.93 1sa0 h ASP 431 N -0.69 -0.20 -0.23 4.20 3.32 0.12 0.13 116.42 123.07 1sa0 h ASP 431 Ca -0.00 0.08 0.06 0.00 0.02 0.00 0.00 57.03 57.18 1sa0 h ASP 431 Cb 0.79 0.15 -0.06 0.00 0.22 0.00 0.00 39.33 40.42 1sa0 h ASP 431 CO 0.01 -0.07 -0.17 1.88 -1.72 0.00 0.00 179.24 179.17 1sa0 h TYR 432 N 0.03 -0.44 -0.16 4.55 -1.99 -1.10 -1.31 116.97 116.54 1sa0 h TYR 432 Ca 0.13 0.03 -0.07 0.00 2.00 0.00 0.00 58.73 60.83 1sa0 h TYR 432 Cb 0.19 0.23 -0.01 0.00 2.00 0.00 0.00 36.73 39.14 1sa0 h TYR 432 CO -0.25 -0.25 -0.21 1.49 -0.00 0.00 0.00 178.16 178.94 1sa0 h GLU 433 N -0.17 0.28 0.00 4.88 4.81 -1.36 -2.92 114.58 120.10 1sa0 h GLU 433 Ca 0.13 -0.08 -0.03 0.00 -0.13 0.00 0.00 59.36 59.25 1sa0 h GLU 433 Cb 0.37 -0.03 -0.00 0.00 0.63 0.00 0.00 28.75 29.72 1sa0 h GLU 433 CO -0.34 0.48 -0.15 0.93 -0.73 0.00 0.00 179.01 179.21 1sa0 h GLU 434 N 0.25 0.00 0.00 1.92 5.08 0.39 -2.51 114.58 119.72 1sa0 h GLU 434 Ca 0.04 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.39 1sa0 h GLU 434 Cb 0.52 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.77 1sa0 h GLU 434 CO 0.04 0.15 -0.07 0.28 -1.00 0.00 0.00 179.01 178.40 1sa0 h VAL 435 N 0.00 0.16 -2.40 3.13 2.07 -1.22 -3.45 116.25 114.54 1sa0 h VAL 435 Ca -0.00 -0.82 -0.56 0.00 0.82 0.00 0.00 66.70 66.14 1sa0 h VAL 435 Cb 0.41 1.71 0.05 0.00 -1.52 0.00 0.00 31.29 31.95 1sa0 h VAL 435 CO 0.02 0.07 0.97 0.61 0.02 0.00 0.00 177.57 179.26 1sa0 n GLY 436 N 0.35 1.42 0.00 2.17 0.00 -0.95 -4.95 105.19 103.23 1sa0 n GLY 436 Ca 0.01 0.69 0.00 0.00 0.00 0.00 0.00 46.02 46.72 1sa0 n GLY 436 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70