#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sa1 s GLU 3 N 0.00 2.30 -0.29 5.56 8.01 -1.25 -4.73 118.70 128.30 1sa1 s GLU 3 Ca 0.00 -1.87 0.04 0.00 0.01 0.00 0.00 54.97 53.16 1sa1 s GLU 3 Cb 0.00 -2.08 0.18 0.00 -4.31 0.00 0.00 34.13 27.93 1sa1 s GLU 3 CO 0.00 -0.31 0.52 0.00 0.01 0.00 0.00 175.26 175.49 1sa1 s ILE 5 N 2.72 4.88 -0.09 0.00 1.01 -1.12 -4.74 121.20 123.87 1sa1 s ILE 5 Ca 0.10 0.81 -0.30 0.00 0.00 0.00 0.00 60.65 61.26 1sa1 s ILE 5 Cb -0.11 -4.06 -0.03 0.00 0.01 0.00 0.00 42.46 38.27 1sa1 s ILE 5 CO -0.27 -0.24 1.20 -0.44 0.00 0.00 0.00 174.94 175.18 1sa1 s SER 6 N 1.71 7.04 -0.23 3.58 0.01 0.05 -2.89 113.70 122.97 1sa1 s SER 6 Ca 0.26 1.75 -0.04 0.00 1.31 0.00 0.00 55.95 59.23 1sa1 s SER 6 Cb -0.14 -2.55 -0.01 0.00 0.21 0.00 0.00 66.02 63.53 1sa1 s SER 6 CO 0.13 -0.62 -0.03 -0.63 0.41 0.00 0.00 173.24 172.51 1sa1 s ILE 7 N 2.52 3.43 -0.54 1.44 1.01 0.01 -0.80 121.20 128.28 1sa1 s ILE 7 Ca 0.55 -0.51 -0.05 0.00 0.00 0.00 0.00 60.65 60.64 1sa1 s ILE 7 Cb -0.23 -2.59 0.14 0.00 0.01 0.00 0.00 42.46 39.79 1sa1 s ILE 7 CO 0.19 0.39 0.36 -1.00 0.00 0.00 0.00 174.94 174.89 1sa1 s HIS 8 N 1.48 3.49 0.22 3.97 3.76 0.30 -0.30 115.29 128.22 1sa1 s HIS 8 Ca 0.05 -2.42 -0.14 0.00 -0.15 0.00 0.00 55.06 52.40 1sa1 s HIS 8 Cb -0.15 -3.30 -0.08 0.00 1.11 0.00 0.00 32.58 30.17 1sa1 s HIS 8 CO -0.03 -0.92 0.63 0.54 -0.85 0.00 0.00 174.74 174.11 1sa1 s VAL 9 N 0.61 4.77 0.00 -0.90 0.11 -1.13 -1.22 120.40 122.64 1sa1 s VAL 9 Ca 0.12 0.87 0.00 0.00 -2.93 0.00 0.00 61.98 60.04 1sa1 s VAL 9 Cb -0.22 -3.70 0.00 0.00 -1.53 0.00 0.00 36.38 30.93 1sa1 s VAL 9 CO -0.04 0.06 0.00 0.61 -3.33 0.00 0.00 175.10 172.40 1sa1 n GLY 10 N 0.28 -0.94 0.31 6.54 0.00 -0.66 -4.05 105.19 106.67 1sa1 n GLY 10 Ca -0.01 -1.09 0.07 0.00 0.00 0.00 0.00 46.02 44.99 1sa1 n GLY 10 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1sa1 n GLN 11 N 1.40 -0.08 0.26 1.61 7.27 -1.26 0.15 117.38 126.73 1sa1 n GLN 11 Ca 0.00 1.35 -0.12 0.00 0.07 0.00 0.00 57.00 58.30 1sa1 n GLN 11 Cb 0.00 -2.05 -0.06 0.00 2.41 0.00 0.00 30.24 30.54 1sa1 n GLN 11 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1sa1 h ALA 12 N 1.75 -1.12 -0.92 1.69 0.00 -1.97 -2.31 119.26 116.37 1sa1 h ALA 12 Ca 0.45 -0.15 0.22 0.00 0.00 0.00 0.00 54.91 55.43 1sa1 h ALA 12 Cb 0.77 0.41 -0.17 0.00 0.00 0.00 0.00 17.79 18.80 1sa1 h ALA 12 CO -0.88 -1.10 -0.05 0.78 0.00 0.00 0.00 179.25 178.01 1sa1 h GLY 13 N -0.73 0.99 0.24 0.00 0.00 -0.43 0.23 103.07 103.37 1sa1 h GLY 13 Ca -0.06 0.19 0.01 0.00 0.00 0.00 0.00 47.33 47.46 1sa1 h GLY 13 CO 0.06 -0.42 -0.49 -2.08 0.00 0.00 0.00 176.54 173.62 1sa1 h VAL 14 N 0.03 0.06 -0.16 4.60 2.07 -0.54 0.76 116.25 123.07 1sa1 h VAL 14 Ca 0.51 0.00 0.00 0.00 0.82 0.00 0.00 66.70 68.04 1sa1 h VAL 14 Cb 0.96 0.06 -0.01 0.00 -1.52 0.00 0.00 31.29 30.78 1sa1 h VAL 14 CO -0.87 0.00 0.10 1.56 0.02 0.00 0.00 177.57 178.38 1sa1 h GLN 15 N -0.76 0.21 -0.31 1.57 4.20 -0.70 0.79 115.11 120.11 1sa1 h GLN 15 Ca -0.00 -0.01 0.07 0.00 0.06 0.00 0.00 58.65 58.76 1sa1 h GLN 15 Cb 0.75 -0.05 -0.07 0.00 0.30 0.00 0.00 27.48 28.41 1sa1 h GLN 15 CO -0.24 0.14 -0.19 0.97 -0.67 0.00 0.00 178.83 178.84 1sa1 h ILE 16 N 0.21 0.46 0.03 2.54 6.09 -0.93 0.23 117.51 126.14 1sa1 h ILE 16 Ca 0.06 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.55 1sa1 h ILE 16 Cb -0.02 0.46 -0.01 0.00 0.47 0.00 0.00 36.82 37.73 1sa1 h ILE 16 CO -0.02 0.00 -0.09 1.23 -3.07 0.00 0.00 178.15 176.20 1sa1 h GLY 17 N -0.15 -1.15 -1.80 8.18 0.00 0.11 0.11 103.07 108.37 1sa1 h GLY 17 Ca 0.16 0.52 0.54 0.00 0.00 0.00 0.00 47.33 48.55 1sa1 h GLY 17 CO -0.40 -0.41 1.27 -2.01 0.00 0.00 0.00 176.54 174.99 1sa1 n ASN 18 N -2.93 0.05 -0.63 0.19 5.15 0.27 0.05 115.26 117.40 1sa1 n ASN 18 Ca -0.02 1.06 0.08 0.00 -0.60 0.00 0.00 54.58 55.10 1sa1 n ASN 18 Cb 0.07 -0.52 0.06 0.00 -0.53 0.00 0.00 39.78 38.86 1sa1 n ASN 18 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1sa1 n ALA 19 N -2.81 2.54 0.00 5.20 0.00 0.03 -2.69 120.51 122.77 1sa1 n ALA 19 Ca 0.43 -0.62 0.05 0.00 0.00 0.00 0.00 53.44 53.29 1sa1 n ALA 19 Cb 1.87 -0.56 -0.08 0.00 0.00 0.00 0.00 19.45 20.69 1sa1 n ALA 19 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1sa1 h TRP 21 N 0.00 0.94 -0.47 0.00 4.06 -0.51 0.23 115.95 120.20 1sa1 h TRP 21 Ca 0.00 -0.15 0.09 0.00 2.06 0.00 0.00 58.89 60.89 1sa1 h TRP 21 Cb 0.46 -0.25 -0.08 0.00 -1.00 0.00 0.00 29.16 28.29 1sa1 h TRP 21 CO 0.00 0.87 -0.03 1.49 -3.56 0.00 0.00 178.44 177.21 1sa1 h GLU 22 N 0.80 0.08 -0.35 0.49 4.81 -1.71 -2.28 114.58 116.41 1sa1 h GLU 22 Ca 0.14 -0.00 -0.10 0.00 -0.13 0.00 0.00 59.36 59.27 1sa1 h GLU 22 Cb 0.53 -0.02 -0.01 0.00 0.63 0.00 0.00 28.75 29.88 1sa1 h GLU 22 CO 0.03 0.05 -0.21 1.25 -0.73 0.00 0.00 179.01 179.40 1sa1 h LEU 23 N 0.08 0.68 0.09 1.64 5.85 -1.60 -2.26 115.31 119.79 1sa1 h LEU 23 Ca 0.23 -0.23 0.02 0.00 0.84 0.00 0.00 57.88 58.74 1sa1 h LEU 23 Cb 0.35 -0.19 -0.05 0.00 0.37 0.00 0.00 40.66 41.14 1sa1 h LEU 23 CO -0.41 0.88 -0.52 1.88 -0.34 0.00 0.00 178.44 179.93 1sa1 h TYR 24 N 0.60 -1.51 -0.03 1.25 0.99 -0.43 -1.79 116.97 116.05 1sa1 h TYR 24 Ca 0.09 0.04 0.04 0.00 2.00 0.00 0.00 58.73 60.90 1sa1 h TYR 24 Cb 0.68 0.65 -0.06 0.00 1.00 0.00 0.00 36.73 39.00 1sa1 h TYR 24 CO 0.03 -0.59 -0.36 0.00 -0.00 0.00 0.00 178.16 177.24 1sa1 h LEU 26 N -0.50 0.49 -0.31 0.00 4.07 -1.28 0.84 115.31 118.62 1sa1 h LEU 26 Ca 0.06 0.13 -0.17 0.00 0.08 0.00 0.00 57.88 57.99 1sa1 h LEU 26 Cb 0.60 0.07 -0.00 0.00 1.08 0.00 0.00 40.66 42.41 1sa1 h LEU 26 CO -0.31 0.09 -0.47 -0.33 -1.08 0.00 0.00 178.44 176.34 1sa1 h GLU 27 N 0.51 0.87 0.00 1.13 5.08 -0.28 -3.32 114.58 118.58 1sa1 h GLU 27 Ca 0.57 -0.52 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 1sa1 h GLU 27 Cb 1.02 0.05 0.00 0.00 0.50 0.00 0.00 28.75 30.32 1sa1 h GLU 27 CO -0.47 1.16 -0.70 0.72 -1.00 0.00 0.00 179.01 178.72 1sa1 n HIS 28 N -4.06 0.45 -0.86 4.33 8.25 -0.48 -4.99 115.22 117.86 1sa1 n HIS 28 Ca -0.04 0.13 0.00 0.00 -0.26 0.00 0.00 57.72 57.55 1sa1 n HIS 28 Cb 0.59 -0.58 0.00 0.00 1.12 0.00 0.00 29.99 31.12 1sa1 n HIS 28 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1sa1 n GLY 29 N 1.36 -0.00 2.67 -1.41 0.00 0.17 -4.98 105.19 102.99 1sa1 n GLY 29 Ca 0.03 -0.37 -0.28 0.00 0.00 0.00 0.00 46.02 45.41 1sa1 n GLY 29 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1sa1 s ILE 30 N -1.23 0.28 -0.05 -0.61 1.01 -1.08 -3.70 121.20 115.82 1sa1 s ILE 30 Ca 0.00 -0.56 -0.30 0.00 0.00 0.00 0.00 60.65 59.79 1sa1 s ILE 30 Cb 0.00 -0.95 -0.06 0.00 0.01 0.00 0.00 42.46 41.46 1sa1 s ILE 30 CO 0.00 -0.37 1.65 0.00 0.00 0.00 0.00 174.94 176.22 1sa1 s GLN 31 N 1.96 4.18 0.00 2.79 0.00 -1.26 -4.69 119.66 122.65 1sa1 s GLN 31 Ca 0.03 2.19 0.00 0.00 -0.00 0.00 0.00 55.36 57.58 1sa1 s GLN 31 Cb -0.17 -3.97 0.00 0.00 0.00 0.00 0.00 33.01 28.88 1sa1 s GLN 31 CO -0.15 -0.84 0.00 -2.30 0.00 0.00 0.00 175.29 172.01 1sa1 n PRO 32 N 7.05 0.00 0.00 9.60 -0.02 -1.26 -1.76 135.00 148.61 1sa1 n PRO 32 Ca 0.17 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.65 1sa1 n PRO 32 Cb 0.43 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.91 1sa1 n PRO 32 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1sa1 n ASP 33 N -3.27 0.00 -3.06 2.55 8.00 -1.26 -4.02 116.55 115.50 1sa1 n ASP 33 Ca 0.00 0.15 0.00 0.00 0.71 0.00 0.00 54.79 55.65 1sa1 n ASP 33 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 1sa1 n ASP 33 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1sa1 n GLY 34 N 0.90 -0.03 3.87 0.44 0.00 -0.72 -4.30 105.19 105.34 1sa1 n GLY 34 Ca 0.00 -1.53 -0.29 0.00 0.00 0.00 0.00 46.02 44.20 1sa1 n GLY 34 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1sa1 s GLN 35 N 0.00 1.90 -0.92 1.61 -2.07 -1.20 -4.13 119.66 114.85 1sa1 s GLN 35 Ca 0.00 0.23 -0.24 0.00 -1.82 0.00 0.00 55.36 53.53 1sa1 s GLN 35 Cb 0.00 -1.93 0.05 0.00 -1.09 0.00 0.00 33.01 30.04 1sa1 s GLN 35 CO 0.00 -1.66 1.35 -1.64 -1.32 0.00 0.00 175.29 172.02 1sa1 s MET 36 N -5.46 3.46 -0.05 9.60 -1.94 -1.24 -4.09 119.30 119.57 1sa1 s MET 36 Ca 0.62 -0.93 0.10 0.00 -1.71 0.00 0.00 55.69 53.76 1sa1 s MET 36 Cb -0.12 -4.95 0.36 0.00 2.01 0.00 0.00 34.83 32.13 1sa1 s MET 36 CO 0.51 -2.13 1.21 -0.35 -0.01 0.00 0.00 175.02 174.24 1sa1 n PRO 37 N 8.75 2.33 0.01 2.03 -0.04 -1.26 -5.11 135.00 141.71 1sa1 n PRO 37 Ca 0.22 -1.44 -0.13 0.00 -0.04 0.00 0.00 63.50 62.12 1sa1 n PRO 37 Cb 0.50 -1.54 -0.10 0.00 -0.04 0.00 0.00 33.50 32.32 1sa1 n PRO 37 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1sa1 h SER 38 N 2.10 -0.05 0.00 3.54 4.64 -1.97 -3.56 113.55 118.25 1sa1 h SER 38 Ca 0.00 -0.46 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 1sa1 h SER 38 Cb 0.82 0.01 0.00 0.00 -0.31 0.00 0.00 62.40 62.92 1sa1 h SER 38 CO 0.11 0.45 0.00 -0.67 -0.87 0.00 0.00 176.83 175.84 1sa1 n ASP 47 N -4.88 0.00 0.00 4.97 4.64 -1.26 -5.29 116.55 114.73 1sa1 n ASP 47 Ca -0.09 0.00 0.00 0.00 -1.38 0.00 0.00 54.79 53.32 1sa1 n ASP 47 Cb 0.26 0.00 0.00 0.00 -1.04 0.00 0.00 41.12 40.34 1sa1 n ASP 47 CO 0.00 0.00 0.00 -1.20 -0.82 0.00 0.00 177.20 175.18 1sa1 n SER 48 N 0.00 0.00 0.06 1.67 7.64 -1.25 -4.34 113.62 117.39 1sa1 n SER 48 Ca 0.00 0.00 0.11 0.00 1.01 0.00 0.00 58.87 59.99 1sa1 n SER 48 Cb 0.00 0.00 0.03 0.00 -1.01 0.00 0.00 64.21 63.23 1sa1 n SER 48 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 1sa1 n PHE 49 N 0.00 0.60 0.00 1.43 3.01 -1.25 -4.12 117.46 117.13 1sa1 n PHE 49 Ca 0.00 0.17 0.00 0.00 1.01 0.00 0.00 57.45 58.63 1sa1 n PHE 49 Cb 0.00 -0.71 0.00 0.00 -0.01 0.00 0.00 39.48 38.76 1sa1 n PHE 49 CO 0.00 0.00 0.00 -1.71 1.01 0.00 0.00 176.76 176.06 1sa1 n ASN 50 N -2.31 0.00 -0.24 4.37 2.85 -1.26 -3.24 115.26 115.43 1sa1 n ASN 50 Ca 0.01 0.30 0.02 0.00 -0.11 0.00 0.00 54.58 54.80 1sa1 n ASN 50 Cb 0.49 -0.30 0.15 0.00 1.24 0.00 0.00 39.78 41.36 1sa1 n ASN 50 CO 0.00 0.00 0.00 0.71 -2.11 0.00 0.00 177.26 175.86 1sa1 h THR 51 N 0.00 0.74 0.00 -0.44 1.35 -1.83 -3.30 112.91 109.43 1sa1 h THR 51 Ca 0.00 -0.16 -0.39 0.00 -0.55 0.00 0.00 66.41 65.31 1sa1 h THR 51 Cb 0.01 0.23 -0.06 0.00 -1.73 0.00 0.00 68.15 66.60 1sa1 h THR 51 CO 0.00 0.09 -2.34 0.49 -0.25 0.00 0.00 175.52 173.51 1sa1 n PHE 52 N -4.97 0.00 -3.14 4.73 3.01 -1.20 -2.74 117.46 113.15 1sa1 n PHE 52 Ca 0.12 0.00 -0.28 0.00 1.01 0.00 0.00 57.45 58.29 1sa1 n PHE 52 Cb 0.33 -0.87 -0.03 0.00 -0.01 0.00 0.00 39.48 38.91 1sa1 n PHE 52 CO 0.00 0.00 0.00 -0.06 1.01 0.00 0.00 176.76 177.71 1sa1 s PHE 53 N -2.45 3.49 -0.22 1.38 0.40 -1.23 -2.84 117.98 116.52 1sa1 s PHE 53 Ca -0.33 0.73 -0.04 0.00 -0.60 0.00 0.00 56.93 56.69 1sa1 s PHE 53 Cb 0.12 -2.19 -0.01 0.00 0.51 0.00 0.00 43.02 41.45 1sa1 s PHE 53 CO 0.45 0.05 -0.04 -1.54 0.70 0.00 0.00 175.22 174.84 1sa1 s SER 54 N -3.36 4.37 -1.20 1.36 1.04 -0.93 -4.45 113.70 110.53 1sa1 s SER 54 Ca 0.46 -0.37 -0.18 0.00 0.48 0.00 0.00 55.95 56.33 1sa1 s SER 54 Cb -0.10 -1.75 -0.03 0.00 0.10 0.00 0.00 66.02 64.24 1sa1 s SER 54 CO 0.33 -0.01 1.99 -1.84 0.98 0.00 0.00 173.24 174.68 1sa1 n GLU 55 N 4.74 2.37 -1.33 4.02 0.00 -1.26 -4.35 120.64 124.83 1sa1 n GLU 55 Ca -0.18 -2.54 -0.29 0.00 0.00 0.00 0.00 57.16 54.15 1sa1 n GLU 55 Cb 0.51 -3.31 0.16 0.00 0.00 0.00 0.00 31.44 28.80 1sa1 n GLU 55 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.13 178.08 1sa1 s THR 56 N 5.18 1.98 0.00 3.84 -4.23 -1.18 -4.83 115.64 116.40 1sa1 s THR 56 Ca 0.55 0.00 0.00 0.00 -1.18 0.00 0.00 61.69 61.06 1sa1 s THR 56 Cb 0.09 -2.61 0.00 0.00 1.34 0.00 0.00 72.50 71.32 1sa1 s THR 56 CO 0.04 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.73 1sa1 n GLY 57 N -1.61 2.76 0.38 3.99 0.00 -1.26 -3.85 105.19 105.60 1sa1 n GLY 57 Ca 0.06 -0.24 0.01 0.00 0.00 0.00 0.00 46.02 45.85 1sa1 n GLY 57 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sa1 n ALA 58 N 8.73 1.91 0.11 4.61 0.00 -1.26 -4.94 120.51 129.66 1sa1 n ALA 58 Ca 0.00 -1.12 0.00 0.00 0.00 0.00 0.00 53.44 52.32 1sa1 n ALA 58 Cb 0.00 -0.42 0.00 0.00 0.00 0.00 0.00 19.45 19.03 1sa1 n ALA 58 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1sa1 n GLY 59 N -0.17 -0.50 3.76 0.00 0.00 -1.25 -5.09 105.19 101.94 1sa1 n GLY 59 Ca 0.02 0.05 -0.40 0.00 0.00 0.00 0.00 46.02 45.69 1sa1 n GLY 59 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1sa1 s LYS 60 N -1.65 4.65 -0.06 1.61 -0.14 -1.25 -3.28 119.74 119.62 1sa1 s LYS 60 Ca 0.00 1.27 0.15 0.00 -1.36 0.00 0.00 55.97 56.03 1sa1 s LYS 60 Cb 0.00 -3.31 -0.22 0.00 -1.68 0.00 0.00 37.83 32.62 1sa1 s LYS 60 CO 0.00 0.44 0.55 0.72 -0.76 0.00 0.00 175.35 176.30 1sa1 n HIS 61 N 2.02 0.75 -1.51 3.18 -0.00 -1.26 -3.13 115.22 115.28 1sa1 n HIS 61 Ca -0.03 0.27 0.00 0.00 -0.00 0.00 0.00 57.72 57.96 1sa1 n HIS 61 Cb 0.49 -1.11 0.00 0.00 -0.00 0.00 0.00 29.99 29.36 1sa1 n HIS 61 CO 0.00 0.00 0.00 1.55 -0.00 0.00 0.00 176.34 177.89 1sa1 n VAL 62 N -2.94 -0.12 -1.42 1.59 3.14 -1.26 -3.83 118.33 113.49 1sa1 n VAL 62 Ca -0.19 0.03 -0.29 0.00 -2.96 0.00 0.00 64.34 60.94 1sa1 n VAL 62 Cb 1.03 -0.42 0.15 0.00 -1.06 0.00 0.00 33.84 33.54 1sa1 n VAL 62 CO 0.00 0.00 0.00 -2.16 -6.46 0.00 0.00 176.83 168.21 1sa1 s PRO 63 N -0.26 0.83 -0.69 1.45 0.04 -1.26 -2.18 135.00 132.92 1sa1 s PRO 63 Ca 0.00 0.33 -0.12 0.00 0.04 0.00 0.00 61.00 61.25 1sa1 s PRO 63 Cb 0.00 -1.80 0.18 0.00 0.04 0.00 0.00 34.50 32.92 1sa1 s PRO 63 CO 0.00 -2.42 0.61 1.03 0.04 0.00 0.00 177.00 176.26 1sa1 s ARG 64 N -5.20 3.18 0.01 4.56 0.52 -1.13 -4.65 118.95 116.24 1sa1 s ARG 64 Ca 0.65 -2.24 -0.01 0.00 -0.52 0.00 0.00 55.73 53.61 1sa1 s ARG 64 Cb -0.16 -4.23 -0.01 0.00 0.52 0.00 0.00 34.95 31.07 1sa1 s ARG 64 CO 0.55 -1.27 -0.00 0.00 0.02 0.00 0.00 175.30 174.59 1sa1 s ALA 65 N 0.56 0.04 -0.03 2.13 0.00 -1.26 -0.77 121.76 122.43 1sa1 s ALA 65 Ca 0.13 -0.31 0.01 0.00 0.00 0.00 0.00 51.96 51.79 1sa1 s ALA 65 Cb -0.18 0.08 0.02 0.00 0.00 0.00 0.00 23.12 23.04 1sa1 s ALA 65 CO -0.05 -0.10 -0.03 0.14 0.00 0.00 0.00 175.76 175.73 1sa1 s VAL 66 N -0.86 0.37 -0.09 0.00 -7.23 0.02 -4.76 120.40 107.85 1sa1 s VAL 66 Ca -0.09 -0.06 0.02 0.00 -1.81 0.00 0.00 61.98 60.04 1sa1 s VAL 66 Cb -0.06 -0.41 -0.02 0.00 0.56 0.00 0.00 36.38 36.46 1sa1 s VAL 66 CO -0.00 0.17 -0.15 -0.36 -0.31 0.00 0.00 175.10 174.45 1sa1 s PHE 67 N 0.76 2.72 -0.04 2.82 0.40 -0.62 0.11 117.98 124.13 1sa1 s PHE 67 Ca -0.09 -0.45 0.01 0.00 -0.60 0.00 0.00 56.93 55.80 1sa1 s PHE 67 Cb -0.12 -1.73 0.02 0.00 0.51 0.00 0.00 43.02 41.71 1sa1 s PHE 67 CO -0.01 -0.04 -0.02 0.08 0.70 0.00 0.00 175.22 175.93 1sa1 s VAL 68 N -0.16 0.34 0.13 -0.44 1.01 -0.36 -0.56 120.40 120.35 1sa1 s VAL 68 Ca -0.01 0.01 -0.10 0.00 0.00 0.00 0.00 61.98 61.88 1sa1 s VAL 68 Cb -0.13 -0.41 0.00 0.00 0.00 0.00 0.00 36.38 35.84 1sa1 s VAL 68 CO 0.03 0.19 0.27 -0.62 0.00 0.00 0.00 175.10 174.97 1sa1 s ASP 69 N 1.05 0.03 0.00 3.32 3.68 -1.14 -1.65 116.67 121.97 1sa1 s ASP 69 Ca -0.09 -0.69 0.24 0.00 2.13 0.00 0.00 52.55 54.13 1sa1 s ASP 69 Cb -0.14 0.40 0.21 0.00 -1.45 0.00 0.00 42.92 41.95 1sa1 s ASP 69 CO -0.01 -0.82 1.27 0.18 0.13 0.00 0.00 175.17 175.91 1sa1 n LEU 70 N -0.15 3.03 -4.51 -1.34 4.32 -1.26 -1.18 117.00 115.91 1sa1 n LEU 70 Ca -0.12 -1.05 -0.24 0.00 -0.02 0.00 0.00 56.01 54.58 1sa1 n LEU 70 Cb 0.63 -0.03 -0.10 0.00 -1.62 0.00 0.00 43.42 42.31 1sa1 n LEU 70 CO 0.22 0.52 -0.44 -1.83 -1.22 0.00 0.00 177.39 174.65 1sa1 s GLU 71 N -1.93 1.81 0.00 3.23 -1.05 -1.26 -0.93 118.70 118.56 1sa1 s GLU 71 Ca 0.29 -1.73 0.00 0.00 -0.15 0.00 0.00 54.97 53.37 1sa1 s GLU 71 Cb 0.20 -1.83 0.00 0.00 -0.44 0.00 0.00 34.13 32.06 1sa1 s GLU 71 CO 0.30 0.31 0.00 -2.30 0.95 0.00 0.00 175.26 174.51 1sa1 n PRO 72 N -0.70 0.00 0.00 -4.83 -0.02 -1.26 -4.40 135.00 123.79 1sa1 n PRO 72 Ca -0.05 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.43 1sa1 n PRO 72 Cb 0.60 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 34.08 1sa1 n PRO 72 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 1sa1 n THR 73 N 0.00 0.00 0.05 3.45 -1.04 -1.26 -2.94 114.28 112.53 1sa1 n THR 73 Ca 0.00 0.00 -0.13 0.00 -2.04 0.00 0.00 64.05 61.88 1sa1 n THR 73 Cb 0.00 0.00 -0.09 0.00 -1.82 0.00 0.00 70.33 68.42 1sa1 n THR 73 CO 0.00 0.00 0.00 0.58 -0.64 0.00 0.00 175.07 175.01 1sa1 h VAL 74 N 0.00 1.10 -0.63 12.58 2.07 -1.99 -3.19 116.25 126.18 1sa1 h VAL 74 Ca 0.00 -0.67 -0.02 0.00 0.82 0.00 0.00 66.70 66.83 1sa1 h VAL 74 Cb 0.00 1.53 -0.03 0.00 -1.52 0.00 0.00 31.29 31.27 1sa1 h VAL 74 CO 0.00 0.17 0.33 0.40 0.02 0.00 0.00 177.57 178.48 1sa1 h ILE 75 N -0.42 1.20 -0.74 4.57 1.08 -1.83 -2.69 117.51 118.69 1sa1 h ILE 75 Ca -0.01 -0.51 0.01 0.00 -0.39 0.00 0.00 64.86 63.95 1sa1 h ILE 75 Cb 0.36 0.36 -0.04 0.00 -3.07 0.00 0.00 36.82 34.43 1sa1 h ILE 75 CO 0.02 0.22 0.49 0.44 -0.69 0.00 0.00 178.15 178.63 1sa1 h ASP 76 N 0.88 0.84 -0.15 1.72 5.19 -1.77 -1.17 116.42 121.96 1sa1 h ASP 76 Ca 0.22 -0.02 0.04 0.00 -0.62 0.00 0.00 57.03 56.65 1sa1 h ASP 76 Cb 0.05 -0.21 -0.01 0.00 0.18 0.00 0.00 39.33 39.34 1sa1 h ASP 76 CO -0.03 0.61 0.16 -0.08 -3.12 0.00 0.00 179.24 176.77 1sa1 h GLU 77 N 0.99 0.00 -0.32 3.56 4.57 -1.47 0.46 114.58 122.38 1sa1 h GLU 77 Ca 0.27 0.00 -0.17 0.00 -1.18 0.00 0.00 59.36 58.28 1sa1 h GLU 77 Cb -0.11 0.00 -0.00 0.00 -0.16 0.00 0.00 28.75 28.48 1sa1 h GLU 77 CO -0.06 0.00 -0.46 0.28 -1.18 0.00 0.00 179.01 177.59 1sa1 h VAL 78 N 0.00 1.28 -0.07 0.32 2.07 -1.26 -2.99 116.25 115.60 1sa1 h VAL 78 Ca 0.07 -1.64 0.00 0.00 0.82 0.00 0.00 66.70 65.95 1sa1 h VAL 78 Cb 0.38 1.55 0.00 0.00 -1.52 0.00 0.00 31.29 31.70 1sa1 h VAL 78 CO -0.00 0.54 0.00 0.54 0.02 0.00 0.00 177.57 178.67 1sa1 n ARG 79 N -4.07 1.17 -0.04 1.57 1.74 0.15 -3.08 116.66 114.10 1sa1 n ARG 79 Ca -0.04 -0.26 -0.06 0.00 -0.77 0.00 0.00 57.85 56.72 1sa1 n ARG 79 Cb 0.58 -1.07 -0.02 0.00 -1.02 0.00 0.00 32.46 30.93 1sa1 n ARG 79 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 1sa1 n THR 80 N -0.28 1.40 -3.76 0.55 -1.04 -0.45 -4.91 114.28 105.80 1sa1 n THR 80 Ca 0.02 0.22 -0.28 0.00 -2.04 0.00 0.00 64.05 61.97 1sa1 n THR 80 Cb 0.07 -2.08 -0.03 0.00 -1.82 0.00 0.00 70.33 66.46 1sa1 n THR 80 CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 1sa1 s GLY 81 N -4.61 1.90 0.44 3.41 0.00 -1.14 -4.86 107.32 102.45 1sa1 s GLY 81 Ca -0.19 -0.82 -0.21 0.00 0.00 0.00 0.00 44.72 43.50 1sa1 s GLY 81 CO 0.28 -0.78 0.23 -1.30 0.00 0.00 0.00 173.10 171.53 1sa1 n THR 82 N -0.41 1.03 0.00 0.90 -2.24 -1.26 -1.09 114.28 111.22 1sa1 n THR 82 Ca -0.05 -0.50 0.00 0.00 -2.27 0.00 0.00 64.05 61.23 1sa1 n THR 82 Cb 0.53 -0.21 0.00 0.00 -2.10 0.00 0.00 70.33 68.55 1sa1 n THR 82 CO 0.00 0.00 0.00 -1.22 -0.57 0.00 0.00 175.07 173.28 1sa1 n TYR 83 N -1.10 0.00 0.23 4.78 0.53 -1.26 -4.90 117.16 115.45 1sa1 n TYR 83 Ca 0.11 0.00 0.14 0.00 -1.02 0.00 0.00 57.90 57.13 1sa1 n TYR 83 Cb 0.41 0.00 0.75 0.00 -1.03 0.00 0.00 39.34 39.48 1sa1 n TYR 83 CO 0.00 0.00 0.00 0.07 -1.02 0.00 0.00 176.86 175.91 1sa1 h ARG 84 N 1.87 0.00 -0.01 -0.72 0.11 -1.04 0.41 114.38 115.00 1sa1 h ARG 84 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1sa1 h ARG 84 Cb 0.00 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.08 1sa1 h ARG 84 CO 0.00 0.00 -0.56 1.04 0.10 0.00 0.00 179.97 180.55 1sa1 n GLN 85 N -2.52 0.67 0.04 0.08 1.13 -1.26 -4.50 117.38 111.02 1sa1 n GLN 85 Ca -0.02 -0.51 0.11 0.00 -1.94 0.00 0.00 57.00 54.65 1sa1 n GLN 85 Cb 0.13 -1.49 0.01 0.00 0.11 0.00 0.00 30.24 29.00 1sa1 n GLN 85 CO 0.00 0.00 0.00 -0.11 -1.44 0.00 0.00 177.06 175.51 1sa1 n LEU 86 N -0.72 0.61 -4.84 1.08 7.94 0.14 -4.71 117.00 116.50 1sa1 n LEU 86 Ca 0.08 0.08 -0.22 0.00 -1.11 0.00 0.00 56.01 54.85 1sa1 n LEU 86 Cb 0.39 -0.09 -0.04 0.00 0.53 0.00 0.00 43.42 44.21 1sa1 n LEU 86 CO 0.32 -0.02 -0.04 -0.36 -1.11 0.00 0.00 177.39 176.18 1sa1 s PHE 87 N -3.27 2.69 0.35 1.96 2.99 -1.24 -4.35 117.98 117.11 1sa1 s PHE 87 Ca 0.02 -0.51 -0.16 0.00 0.00 0.00 0.00 56.93 56.28 1sa1 s PHE 87 Cb 0.13 -2.11 -0.09 0.00 0.00 0.00 0.00 43.02 40.95 1sa1 s PHE 87 CO 0.80 -0.04 0.78 -1.58 -0.00 0.00 0.00 175.22 175.19 1sa1 s HIS 88 N -2.50 3.37 -0.66 0.36 2.46 -1.26 -4.95 115.29 112.10 1sa1 s HIS 88 Ca 0.46 1.28 0.16 0.00 0.47 0.00 0.00 55.06 57.43 1sa1 s HIS 88 Cb -0.02 -2.59 0.75 0.00 -0.13 0.00 0.00 32.58 30.59 1sa1 s HIS 88 CO 0.27 0.03 1.51 -0.35 -2.47 0.00 0.00 174.74 173.73 1sa1 n PRO 89 N -0.51 0.09 0.08 2.88 -0.04 -1.26 -2.45 135.00 133.80 1sa1 n PRO 89 Ca 0.04 0.43 -0.11 0.00 -0.04 0.00 0.00 63.50 63.82 1sa1 n PRO 89 Cb 0.53 -1.72 -0.13 0.00 -0.04 0.00 0.00 33.50 32.14 1sa1 n PRO 89 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 1sa1 h GLU 90 N 0.00 0.12 0.00 0.54 4.81 -2.01 -3.10 114.58 114.94 1sa1 h GLU 90 Ca 0.00 -0.21 0.00 0.00 -0.13 0.00 0.00 59.36 59.02 1sa1 h GLU 90 Cb 0.19 0.08 0.00 0.00 0.63 0.00 0.00 28.75 29.65 1sa1 h GLU 90 CO 0.00 1.09 0.00 1.04 -0.73 0.00 0.00 179.01 180.41 1sa1 n GLN 91 N -3.42 0.65 -3.54 1.92 6.02 -1.02 -4.41 117.38 113.58 1sa1 n GLN 91 Ca -0.04 0.02 -0.31 0.00 -0.01 0.00 0.00 57.00 56.65 1sa1 n GLN 91 Cb 0.98 -1.50 -0.08 0.00 1.02 0.00 0.00 30.24 30.66 1sa1 n GLN 91 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1sa1 n LEU 92 N -1.06 4.01 -4.66 1.08 4.77 -1.17 -1.59 117.00 118.38 1sa1 n LEU 92 Ca 0.16 -5.30 -0.43 0.00 -0.03 0.00 0.00 56.01 50.42 1sa1 n LEU 92 Cb 0.10 -0.86 -0.02 0.00 -2.33 0.00 0.00 43.42 40.31 1sa1 n LEU 92 CO 0.14 1.83 1.03 -0.63 -1.33 0.00 0.00 177.39 178.44 1sa1 s ILE 93 N -2.04 4.41 -0.12 -0.08 1.01 0.27 -4.98 121.20 119.67 1sa1 s ILE 93 Ca 0.33 1.70 0.01 0.00 0.00 0.00 0.00 60.65 62.69 1sa1 s ILE 93 Cb 0.04 -4.11 -0.01 0.00 0.01 0.00 0.00 42.46 38.39 1sa1 s ILE 93 CO -0.06 -0.16 -0.16 0.28 0.00 0.00 0.00 174.94 174.83 1sa1 s THR 94 N 3.43 2.80 -1.49 2.92 -1.32 -1.26 -2.88 115.64 117.83 1sa1 s THR 94 Ca 0.51 -0.76 0.17 0.00 -1.21 0.00 0.00 61.69 60.40 1sa1 s THR 94 Cb -0.19 -2.15 0.60 0.00 -1.51 0.00 0.00 72.50 69.25 1sa1 s THR 94 CO 0.12 0.54 1.49 0.61 -2.21 0.00 0.00 174.62 175.17 1sa1 n GLY 95 N 3.44 2.19 1.58 6.08 0.00 -0.32 -4.92 105.19 113.24 1sa1 n GLY 95 Ca -0.18 -0.71 0.00 0.00 0.00 0.00 0.00 46.02 45.13 1sa1 n GLY 95 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1sa1 n LYS 96 N 1.08 0.00 -4.06 1.61 -0.00 -1.23 -4.70 118.16 110.87 1sa1 n LYS 96 Ca 0.22 0.00 -0.34 0.00 -0.00 0.00 0.00 58.31 58.19 1sa1 n LYS 96 Cb 0.69 0.00 -0.15 0.00 -0.00 0.00 0.00 35.03 35.57 1sa1 n LYS 96 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.40 176.19 1sa1 s GLU 97 N 0.00 3.13 -0.17 -1.58 2.02 -0.11 -4.73 118.70 117.27 1sa1 s GLU 97 Ca 0.00 -0.76 -0.09 0.00 0.02 0.00 0.00 54.97 54.15 1sa1 s GLU 97 Cb 0.00 -2.73 0.01 0.00 0.10 0.00 0.00 34.13 31.52 1sa1 s GLU 97 CO 0.00 -0.20 0.16 -0.25 0.02 0.00 0.00 175.26 174.99 1sa1 n ASP 98 N 4.67 -6.69 0.00 -0.19 8.00 -1.25 -4.42 116.55 116.67 1sa1 n ASP 98 Ca -0.20 0.48 0.00 0.00 0.71 0.00 0.00 54.79 55.78 1sa1 n ASP 98 Cb 0.50 -2.46 0.00 0.00 -0.02 0.00 0.00 41.12 39.15 1sa1 n ASP 98 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1sa1 n ALA 99 N 0.81 0.00 0.00 2.24 0.00 -1.26 -4.84 120.51 117.46 1sa1 n ALA 99 Ca -0.01 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.43 1sa1 n ALA 99 Cb 0.45 0.05 0.00 0.00 0.00 0.00 0.00 19.45 19.95 1sa1 n ALA 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1sa1 n ALA 100 N -1.20 0.00 -0.46 0.00 0.00 -1.26 -4.57 120.51 113.01 1sa1 n ALA 100 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1sa1 n ALA 100 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1sa1 n ALA 100 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1sa1 n ASN 101 N 0.00 -0.94 -3.65 0.00 3.02 -1.26 -4.89 115.26 107.54 1sa1 n ASN 101 Ca 0.00 0.00 -0.11 0.00 -0.03 0.00 0.00 54.58 54.44 1sa1 n ASN 101 Cb 0.00 -0.19 -0.08 0.00 -0.61 0.00 0.00 39.78 38.91 1sa1 n ASN 101 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1sa1 s ASN 102 N -2.37 -0.77 0.31 6.41 4.22 -1.26 -4.50 114.94 116.99 1sa1 s ASN 102 Ca 0.00 1.37 0.03 0.00 -2.14 0.00 0.00 52.86 52.13 1sa1 s ASN 102 Cb 0.00 1.33 0.62 0.00 1.28 0.00 0.00 41.25 44.49 1sa1 s ASN 102 CO 0.00 -0.23 1.88 0.22 -2.04 0.00 0.00 177.10 176.93 1sa1 h TYR 103 N 5.85 1.00 -0.59 1.54 3.20 -1.92 1.77 116.97 127.82 1sa1 h TYR 103 Ca -0.30 0.03 0.13 0.00 3.14 0.00 0.00 58.73 61.73 1sa1 h TYR 103 Cb 1.19 -0.32 -0.03 0.00 1.54 0.00 0.00 36.73 39.10 1sa1 h TYR 103 CO 0.27 0.45 0.41 0.00 -1.64 0.00 0.00 178.16 177.64 1sa1 h ALA 104 N 1.55 2.27 -0.05 1.82 0.00 -1.91 -2.30 119.26 120.62 1sa1 h ALA 104 Ca 0.43 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.33 1sa1 h ALA 104 Cb 0.42 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1sa1 h ALA 104 CO -0.19 -0.42 0.00 -2.13 0.00 0.00 0.00 179.25 176.51 1sa1 n ARG 105 N -4.43 0.00 0.00 0.00 3.00 0.60 -3.10 116.66 112.72 1sa1 n ARG 105 Ca 0.11 0.49 0.00 0.00 -0.00 0.00 0.00 57.85 58.45 1sa1 n ARG 105 Cb 0.51 -1.44 0.00 0.00 0.00 0.00 0.00 32.46 31.53 1sa1 n ARG 105 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 1sa1 n GLY 106 N -0.70 -2.95 0.02 5.14 0.00 -1.04 -0.32 105.19 105.35 1sa1 n GLY 106 Ca 0.00 0.23 0.00 0.00 0.00 0.00 0.00 46.02 46.26 1sa1 n GLY 106 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1sa1 n HIS 107 N -0.56 0.01 0.12 1.61 -0.00 -0.89 -1.05 115.22 114.46 1sa1 n HIS 107 Ca 0.00 0.01 0.00 0.00 -0.00 0.00 0.00 57.72 57.73 1sa1 n HIS 107 Cb 0.00 -0.07 0.00 0.00 -0.00 0.00 0.00 29.99 29.92 1sa1 n HIS 107 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.34 177.00 1sa1 n TYR 108 N -1.17 -2.13 0.00 1.57 4.02 -1.16 -4.76 117.16 113.54 1sa1 n TYR 108 Ca -0.00 0.38 0.00 0.00 -0.01 0.00 0.00 57.90 58.27 1sa1 n TYR 108 Cb 0.47 0.54 0.00 0.00 -0.02 0.00 0.00 39.34 40.33 1sa1 n TYR 108 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 176.86 178.26 1sa1 n THR 109 N -3.36 0.00 0.21 -0.72 -1.04 0.57 -3.52 114.28 106.42 1sa1 n THR 109 Ca 0.00 0.06 0.08 0.00 -2.04 0.00 0.00 64.05 62.15 1sa1 n THR 109 Cb 0.00 -0.26 0.45 0.00 -1.82 0.00 0.00 70.33 68.70 1sa1 n THR 109 CO 0.00 0.00 0.00 -0.29 -0.64 0.00 0.00 175.07 174.14 1sa1 h ILE 110 N 0.00 0.73 0.53 12.58 6.09 -1.54 -3.34 117.51 132.57 1sa1 h ILE 110 Ca 0.00 -1.19 -0.03 0.00 -1.37 0.00 0.00 64.86 62.28 1sa1 h ILE 110 Cb 0.00 1.75 0.01 0.00 0.47 0.00 0.00 36.82 39.05 1sa1 h ILE 110 CO 0.00 0.27 -0.26 1.23 -3.07 0.00 0.00 178.15 176.32 1sa1 h GLY 111 N 1.80 -0.75 -0.35 8.18 0.00 -1.13 -2.97 103.07 107.85 1sa1 h GLY 111 Ca -0.00 0.28 0.12 0.00 0.00 0.00 0.00 47.33 47.73 1sa1 h GLY 111 CO 0.04 -0.27 0.22 1.17 0.00 0.00 0.00 176.54 177.70 1sa1 n LYS 112 N -5.29 -0.01 -0.05 4.80 4.81 -1.23 0.11 118.16 121.30 1sa1 n LYS 112 Ca -0.11 0.33 -0.13 0.00 -0.87 0.00 0.00 58.31 57.54 1sa1 n LYS 112 Cb 0.32 -0.65 -0.07 0.00 0.02 0.00 0.00 35.03 34.65 1sa1 n LYS 112 CO 0.00 0.00 0.00 1.49 1.17 0.00 0.00 177.40 180.06 1sa1 h GLU 113 N 0.00 0.27 0.00 1.64 4.57 -1.71 -3.37 114.58 115.99 1sa1 h GLU 113 Ca 0.23 -0.13 0.00 0.00 -1.18 0.00 0.00 59.36 58.28 1sa1 h GLU 113 Cb 0.73 -0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.32 1sa1 h GLU 113 CO -0.13 0.64 -1.74 1.51 -1.18 0.00 0.00 179.01 178.12 1sa1 n ILE 114 N -4.65 0.00 -0.38 2.32 0.13 0.12 -4.49 119.36 112.41 1sa1 n ILE 114 Ca -0.06 -0.38 0.30 0.00 -1.10 0.00 0.00 62.75 61.50 1sa1 n ILE 114 Cb 0.31 0.22 0.58 0.00 -0.84 0.00 0.00 39.64 39.91 1sa1 n ILE 114 CO 0.00 0.00 0.00 -0.29 2.80 0.00 0.00 176.55 179.06 1sa1 h ILE 115 N 0.00 0.31 0.29 9.51 -0.00 -1.57 -0.77 117.51 125.28 1sa1 h ILE 115 Ca 0.00 -0.08 -0.01 0.00 -0.00 0.00 0.00 64.86 64.77 1sa1 h ILE 115 Cb 0.84 0.06 0.00 0.00 -0.00 0.00 0.00 36.82 37.72 1sa1 h ILE 115 CO 0.00 0.04 -0.14 0.44 -0.00 0.00 0.00 178.15 178.49 1sa1 h ASP 116 N 0.23 -0.33 -0.38 2.19 3.32 -1.81 0.13 116.42 119.77 1sa1 h ASP 116 Ca 0.72 -0.20 -0.01 0.00 0.02 0.00 0.00 57.03 57.55 1sa1 h ASP 116 Cb 2.05 0.09 -0.02 0.00 0.22 0.00 0.00 39.33 41.67 1sa1 h ASP 116 CO -0.38 0.10 0.21 0.25 -1.72 0.00 0.00 179.24 177.71 1sa1 h LEU 117 N -0.85 0.49 0.24 1.55 5.85 -1.48 0.92 115.31 122.03 1sa1 h LEU 117 Ca -0.04 -0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.64 1sa1 h LEU 117 Cb 0.52 -0.12 0.00 0.00 0.37 0.00 0.00 40.66 41.43 1sa1 h LEU 117 CO 0.07 0.40 -0.11 0.58 -0.34 0.00 0.00 178.44 179.04 1sa1 h VAL 118 N 0.56 0.00 -1.37 1.05 2.07 -1.24 -2.85 116.25 114.47 1sa1 h VAL 118 Ca 0.14 -0.36 0.46 0.00 0.82 0.00 0.00 66.70 67.76 1sa1 h VAL 118 Cb 0.03 0.00 -0.12 0.00 -1.52 0.00 0.00 31.29 29.68 1sa1 h VAL 118 CO -0.02 0.00 0.91 -0.11 0.02 0.00 0.00 177.57 178.36 1sa1 n LEU 119 N -3.86 0.16 0.00 2.57 7.94 0.47 -1.07 117.00 123.20 1sa1 n LEU 119 Ca -0.04 1.20 0.00 0.00 -1.11 0.00 0.00 56.01 56.06 1sa1 n LEU 119 Cb 0.13 -0.59 0.00 0.00 0.53 0.00 0.00 43.42 43.48 1sa1 n LEU 119 CO 0.10 -1.29 0.09 -0.67 -1.11 0.00 0.00 177.39 174.51 1sa1 n ASP 120 N -4.39 0.00 -0.46 1.96 -0.08 0.28 -3.35 116.55 110.51 1sa1 n ASP 120 Ca 0.38 0.18 0.36 0.00 -1.51 0.00 0.00 54.79 54.21 1sa1 n ASP 120 Cb 1.52 0.00 0.59 0.00 2.34 0.00 0.00 41.12 45.57 1sa1 n ASP 120 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 1sa1 n ARG 121 N -0.20 -0.02 0.03 -0.67 5.12 -0.23 0.95 116.66 121.64 1sa1 n ARG 121 Ca 0.00 0.94 -0.18 0.00 -1.93 0.00 0.00 57.85 56.68 1sa1 n ARG 121 Cb 0.00 -1.98 -0.08 0.00 -1.16 0.00 0.00 32.46 29.24 1sa1 n ARG 121 CO 0.00 0.00 0.00 -0.84 -1.93 0.00 0.00 177.63 174.86 1sa1 h ILE 122 N 0.00 1.30 0.07 0.55 3.07 -1.60 -2.36 117.51 118.54 1sa1 h ILE 122 Ca 0.72 -2.22 -0.00 0.00 1.55 0.00 0.00 64.86 64.91 1sa1 h ILE 122 Cb 2.58 2.30 0.00 0.00 -0.27 0.00 0.00 36.82 41.42 1sa1 h ILE 122 CO -0.22 0.69 -0.03 -0.09 -1.05 0.00 0.00 178.15 177.44 1sa1 h ARG 123 N 0.39 -0.09 -1.36 0.16 2.43 0.58 -1.34 114.38 115.15 1sa1 h ARG 123 Ca -0.10 0.01 0.39 0.00 -0.81 0.00 0.00 59.98 59.47 1sa1 h ARG 123 Cb 1.61 0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 31.12 1sa1 h ARG 123 CO 0.19 0.05 1.27 0.87 -1.51 0.00 0.00 179.97 180.84 1sa1 h LYS 124 N -0.22 0.00 0.04 0.20 1.57 -1.41 0.93 116.57 117.69 1sa1 h LYS 124 Ca -0.01 0.00 -0.36 0.00 -1.87 0.00 0.00 60.65 58.41 1sa1 h LYS 124 Cb 0.18 0.00 -0.05 0.00 0.08 0.00 0.00 32.23 32.45 1sa1 h LYS 124 CO 0.02 0.00 -2.12 -0.11 -0.57 0.00 0.00 179.45 176.66 1sa1 n LEU 125 N -3.52 1.87 -0.34 2.94 0.00 -0.63 -3.63 117.00 113.69 1sa1 n LEU 125 Ca 0.31 0.13 0.13 0.00 0.00 0.00 0.00 56.01 56.58 1sa1 n LEU 125 Cb 1.68 -0.49 0.59 0.00 0.00 0.00 0.00 43.42 45.20 1sa1 n LEU 125 CO 0.31 0.71 0.90 0.00 0.00 0.00 0.00 177.39 179.32 1sa1 n ALA 126 N -2.92 2.59 0.07 1.96 0.00 0.78 -3.11 120.51 119.88 1sa1 n ALA 126 Ca -0.32 -0.37 -0.13 0.00 0.00 0.00 0.00 53.44 52.62 1sa1 n ALA 126 Cb 1.05 -1.24 -0.04 0.00 0.00 0.00 0.00 19.45 19.22 1sa1 n ALA 126 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1sa1 h ASP 127 N 1.57 0.50 -3.36 0.00 3.45 0.62 -3.39 116.42 115.81 1sa1 h ASP 127 Ca 0.00 -0.40 -0.56 0.00 0.43 0.00 0.00 57.03 56.50 1sa1 h ASP 127 Cb 0.34 -0.15 -0.05 0.00 -0.56 0.00 0.00 39.33 38.90 1sa1 h ASP 127 CO 0.00 1.20 0.22 0.00 -1.57 0.00 0.00 179.24 179.08 1sa1 s GLN 128 N -3.26 4.42 0.00 3.56 0.00 -1.18 -4.86 119.66 118.33 1sa1 s GLN 128 Ca -0.05 1.01 0.00 0.00 -0.00 0.00 0.00 55.36 56.31 1sa1 s GLN 128 Cb 0.09 -3.49 0.00 0.00 0.00 0.00 0.00 33.01 29.61 1sa1 s GLN 128 CO 0.86 -0.07 0.00 0.00 0.00 0.00 0.00 175.29 176.09 1sa1 s THR 130 N 0.00 4.84 0.00 0.00 -4.23 -1.26 -4.43 115.64 110.56 1sa1 s THR 130 Ca 0.00 -2.32 0.00 0.00 -1.18 0.00 0.00 61.69 58.19 1sa1 s THR 130 Cb 0.00 -4.93 0.00 0.00 1.34 0.00 0.00 72.50 68.91 1sa1 s THR 130 CO 0.00 -1.66 0.00 0.61 -0.54 0.00 0.00 174.62 173.03 1sa1 n GLY 131 N 4.58 0.06 3.51 3.99 0.00 -1.26 -4.90 105.19 111.17 1sa1 n GLY 131 Ca 0.36 -0.40 -0.29 0.00 0.00 0.00 0.00 46.02 45.70 1sa1 n GLY 131 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1sa1 s LEU 132 N -0.70 1.04 -0.01 0.99 2.96 -1.26 -3.77 118.68 117.93 1sa1 s LEU 132 Ca 0.00 1.57 -0.00 0.00 -0.22 0.00 0.00 54.13 55.48 1sa1 s LEU 132 Cb 0.00 -3.53 -0.00 0.00 0.50 0.00 0.00 46.19 43.15 1sa1 s LEU 132 CO 0.00 -4.09 -0.01 1.67 -1.32 0.00 0.00 176.35 172.60 1sa1 n GLN 133 N -4.84 0.02 -3.26 1.98 7.27 -0.82 -4.73 117.38 112.99 1sa1 n GLN 133 Ca 0.04 0.01 0.00 0.00 0.07 0.00 0.00 57.00 57.12 1sa1 n GLN 133 Cb 0.54 -0.56 0.00 0.00 2.41 0.00 0.00 30.24 32.63 1sa1 n GLN 133 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 1sa1 n GLY 134 N 2.98 -1.44 3.27 1.69 0.00 -1.25 -3.20 105.19 107.23 1sa1 n GLY 134 Ca -0.02 -1.02 -0.31 0.00 0.00 0.00 0.00 46.02 44.68 1sa1 n GLY 134 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1sa1 s PHE 135 N -2.42 2.32 -0.20 1.61 0.40 -1.09 -2.77 117.98 115.83 1sa1 s PHE 135 Ca 0.00 -0.60 -0.12 0.00 -0.60 0.00 0.00 56.93 55.61 1sa1 s PHE 135 Cb 0.00 -1.51 -0.05 0.00 0.51 0.00 0.00 43.02 41.97 1sa1 s PHE 135 CO 0.00 -0.15 0.23 -1.54 0.70 0.00 0.00 175.22 174.46 1sa1 s SER 136 N -0.31 6.30 -0.19 1.36 1.04 -1.14 -1.58 113.70 119.18 1sa1 s SER 136 Ca 0.01 0.33 0.00 0.00 0.48 0.00 0.00 55.95 56.78 1sa1 s SER 136 Cb -0.12 -2.15 0.02 0.00 0.10 0.00 0.00 66.02 63.87 1sa1 s SER 136 CO 0.02 0.09 -0.18 -0.69 0.98 0.00 0.00 173.24 173.46 1sa1 s VAL 137 N 0.71 2.24 -0.15 5.02 1.01 -0.62 -0.81 120.40 127.80 1sa1 s VAL 137 Ca 0.12 -0.89 -0.04 0.00 0.00 0.00 0.00 61.98 61.16 1sa1 s VAL 137 Cb -0.13 -1.96 -0.03 0.00 0.00 0.00 0.00 36.38 34.26 1sa1 s VAL 137 CO 0.03 0.51 -0.00 -0.36 0.00 0.00 0.00 175.10 175.28 1sa1 s PHE 138 N 1.31 3.12 0.03 5.22 0.40 0.59 -0.86 117.98 127.78 1sa1 s PHE 138 Ca 0.05 -0.10 -0.28 0.00 -0.60 0.00 0.00 56.93 56.00 1sa1 s PHE 138 Cb -0.13 -1.96 0.07 0.00 0.51 0.00 0.00 43.02 41.51 1sa1 s PHE 138 CO -0.12 0.12 0.65 -3.38 0.70 0.00 0.00 175.22 173.19 1sa1 s HIS 139 N 0.12 -0.62 0.44 0.36 -3.43 -0.68 -2.82 115.29 108.66 1sa1 s HIS 139 Ca 0.01 0.84 -0.22 0.00 -0.80 0.00 0.00 55.06 54.89 1sa1 s HIS 139 Cb -0.13 0.46 -0.09 0.00 -1.43 0.00 0.00 32.58 31.40 1sa1 s HIS 139 CO 0.02 -0.70 1.06 -1.54 -2.00 0.00 0.00 174.74 171.58 1sa1 s SER 140 N -1.76 6.53 -0.07 7.38 1.04 -1.25 -2.14 113.70 123.43 1sa1 s SER 140 Ca -0.07 2.02 -0.19 0.00 0.48 0.00 0.00 55.95 58.20 1sa1 s SER 140 Cb -0.00 -2.58 -0.14 0.00 0.10 0.00 0.00 66.02 63.39 1sa1 s SER 140 CO 0.02 -0.65 0.71 0.15 0.98 0.00 0.00 173.24 174.44 1sa1 h PHE 141 N 2.09 -0.15 -2.34 5.02 -0.00 -0.91 -3.32 116.94 117.33 1sa1 h PHE 141 Ca -0.49 -0.00 -0.44 0.00 -0.00 0.00 0.00 57.97 57.04 1sa1 h PHE 141 Cb 1.22 0.05 0.04 0.00 -0.00 0.00 0.00 35.95 37.26 1sa1 h PHE 141 CO 0.57 0.29 -0.10 0.20 -0.00 0.00 0.00 178.31 179.28 1sa1 s GLY 142 N -3.45 1.80 0.00 2.40 0.00 -1.26 -3.40 107.32 103.40 1sa1 s GLY 142 Ca -0.11 -1.35 0.00 0.00 0.00 0.00 0.00 44.72 43.26 1sa1 s GLY 142 CO 0.42 -1.11 0.00 0.61 0.00 0.00 0.00 173.10 173.03 1sa1 n GLY 143 N -2.19 1.19 0.00 0.20 0.00 -1.26 -4.45 105.19 98.68 1sa1 n GLY 143 Ca 0.07 -1.27 0.00 0.00 0.00 0.00 0.00 46.02 44.82 1sa1 n GLY 143 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sa1 n GLY 144 N 2.77 0.00 2.72 -0.02 0.00 -1.26 -1.07 105.19 108.33 1sa1 n GLY 144 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.62 1sa1 n GLY 144 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1sa1 n THR 145 N -0.45 5.16 0.00 2.61 -2.24 -1.26 -0.13 114.28 117.96 1sa1 n THR 145 Ca 0.00 -5.24 0.00 0.00 -2.27 0.00 0.00 64.05 56.54 1sa1 n THR 145 Cb 0.00 -1.48 0.00 0.00 -2.10 0.00 0.00 70.33 66.75 1sa1 n THR 145 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1sa1 n GLY 146 N -0.09 0.00 0.04 3.38 0.00 -1.17 -3.73 105.19 103.63 1sa1 n GLY 146 Ca 0.50 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.52 1sa1 n GLY 146 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1sa1 h SER 147 N 0.00 0.00 0.01 1.61 0.87 -1.06 -3.35 113.55 111.63 1sa1 h SER 147 Ca 0.00 0.00 -0.00 0.00 -1.23 0.00 0.00 61.79 60.56 1sa1 h SER 147 Cb 0.00 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 61.96 1sa1 h SER 147 CO 0.00 0.38 -0.00 1.23 -0.53 0.00 0.00 176.83 177.91 1sa1 h GLY 148 N -0.70 -0.01 0.97 5.77 0.00 -0.72 -3.24 103.07 105.14 1sa1 h GLY 148 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.33 1sa1 h GLY 148 CO 0.00 -0.00 0.19 -2.75 0.00 0.00 0.00 176.54 173.97 1sa1 h PHE 149 N -0.01 0.44 -0.71 5.60 3.04 -1.77 -1.13 116.94 122.39 1sa1 h PHE 149 Ca -0.00 -0.01 0.08 0.00 3.98 0.00 0.00 57.97 62.02 1sa1 h PHE 149 Cb 0.01 -0.14 -0.09 0.00 2.56 0.00 0.00 35.95 38.28 1sa1 h PHE 149 CO 0.19 0.35 -0.38 2.41 -2.02 0.00 0.00 178.31 178.85 1sa1 n THR 150 N -4.80 -0.46 0.11 4.41 -1.04 -1.26 0.34 114.28 111.58 1sa1 n THR 150 Ca -0.01 1.71 -0.12 0.00 -2.04 0.00 0.00 64.05 63.59 1sa1 n THR 150 Cb 0.07 -2.16 -0.06 0.00 -1.82 0.00 0.00 70.33 66.37 1sa1 n THR 150 CO 0.00 0.00 0.00 -1.28 -0.64 0.00 0.00 175.07 173.15 1sa1 h SER 151 N 0.00 -0.67 -0.58 8.00 0.87 -1.23 0.16 113.55 120.10 1sa1 h SER 151 Ca 0.15 0.08 0.12 0.00 -1.23 0.00 0.00 61.79 60.91 1sa1 h SER 151 Cb 0.33 0.26 -0.11 0.00 -0.44 0.00 0.00 62.40 62.43 1sa1 h SER 151 CO -0.68 -0.32 -0.19 0.25 -0.53 0.00 0.00 176.83 175.36 1sa1 h LEU 152 N -0.43 -0.67 -0.15 2.23 5.85 -0.51 -0.03 115.31 121.59 1sa1 h LEU 152 Ca 0.03 0.19 0.05 0.00 0.84 0.00 0.00 57.88 58.99 1sa1 h LEU 152 Cb 0.46 0.41 -0.06 0.00 0.37 0.00 0.00 40.66 41.83 1sa1 h LEU 152 CO -0.14 -0.22 -0.30 0.25 -0.34 0.00 0.00 178.44 177.69 1sa1 h LEU 153 N -0.04 -0.92 -1.62 2.25 7.12 0.62 -1.55 115.31 121.16 1sa1 h LEU 153 Ca 0.27 0.14 0.02 0.00 0.13 0.00 0.00 57.88 58.45 1sa1 h LEU 153 Cb 0.46 0.40 -0.02 0.00 -0.53 0.00 0.00 40.66 40.97 1sa1 h LEU 153 CO -0.62 -0.33 0.29 0.24 -0.13 0.00 0.00 178.44 177.89 1sa1 h MET 154 N -0.35 0.49 0.68 1.25 2.86 0.56 -0.58 114.93 119.84 1sa1 h MET 154 Ca 0.11 -0.03 -0.03 0.00 -2.06 0.00 0.00 59.70 57.68 1sa1 h MET 154 Cb 0.52 -0.11 0.01 0.00 0.06 0.00 0.00 31.60 32.07 1sa1 h MET 154 CO -0.35 0.33 -0.33 0.93 1.06 0.00 0.00 176.91 178.55 1sa1 h GLU 155 N 0.51 -0.88 -0.40 1.72 4.39 -0.05 -2.97 114.58 116.91 1sa1 h GLU 155 Ca 0.17 0.06 0.07 0.00 0.34 0.00 0.00 59.36 60.01 1sa1 h GLU 155 Cb 0.06 0.20 -0.07 0.00 -0.10 0.00 0.00 28.75 28.85 1sa1 h GLU 155 CO -0.04 -0.59 -0.01 -0.09 -1.16 0.00 0.00 179.01 177.12 1sa1 h ARG 156 N -0.91 0.09 -0.79 2.33 2.43 -0.99 -2.23 114.38 114.30 1sa1 h ARG 156 Ca -0.09 -0.01 0.14 0.00 -0.81 0.00 0.00 59.98 59.21 1sa1 h ARG 156 Cb 0.70 -0.02 -0.14 0.00 -0.42 0.00 0.00 29.97 30.09 1sa1 h ARG 156 CO 0.15 0.06 -0.32 -0.07 -1.51 0.00 0.00 179.97 178.28 1sa1 h LEU 157 N 0.09 -1.15 -2.27 3.80 3.38 -1.12 0.79 115.31 118.83 1sa1 h LEU 157 Ca 0.19 0.26 0.01 0.00 0.09 0.00 0.00 57.88 58.44 1sa1 h LEU 157 Cb 0.28 0.62 -0.00 0.00 0.09 0.00 0.00 40.66 41.65 1sa1 h LEU 157 CO -0.34 -0.29 0.04 0.28 0.09 0.00 0.00 178.44 178.22 1sa1 h SER 158 N -0.07 0.00 0.81 -0.43 0.02 -1.24 0.25 113.55 112.90 1sa1 h SER 158 Ca 0.31 0.00 -0.20 0.00 -0.84 0.00 0.00 61.79 61.06 1sa1 h SER 158 Cb 0.58 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.10 1sa1 h SER 158 CO -0.83 0.00 -0.93 0.58 -1.14 0.00 0.00 176.83 174.51 1sa1 h VAL 159 N 0.00 1.60 0.00 2.27 2.07 0.63 -3.29 116.25 119.54 1sa1 h VAL 159 Ca 0.02 -3.00 0.00 0.00 0.82 0.00 0.00 66.70 64.54 1sa1 h VAL 159 Cb 0.09 2.66 0.00 0.00 -1.52 0.00 0.00 31.29 32.52 1sa1 h VAL 159 CO -0.00 0.86 -1.46 0.47 0.02 0.00 0.00 177.57 177.47 1sa1 n ASP 160 N -3.51 0.44 -3.23 0.57 8.00 0.41 -4.60 116.55 114.63 1sa1 n ASP 160 Ca -0.02 0.11 -0.24 0.00 0.71 0.00 0.00 54.79 55.35 1sa1 n ASP 160 Cb 0.87 1.19 -0.07 0.00 -0.02 0.00 0.00 41.12 43.08 1sa1 n ASP 160 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 1sa1 n TYR 161 N -2.40 0.53 0.05 1.24 4.02 0.60 -5.04 117.16 116.16 1sa1 n TYR 161 Ca -0.02 -3.70 -0.06 0.00 -0.01 0.00 0.00 57.90 54.11 1sa1 n TYR 161 Cb 0.55 -0.40 -0.04 0.00 -0.02 0.00 0.00 39.34 39.43 1sa1 n TYR 161 CO 0.00 0.00 0.00 0.78 -1.01 0.00 0.00 176.86 176.63 1sa1 h GLY 162 N 3.98 -1.18 0.00 2.72 0.00 -1.81 -3.10 103.07 103.67 1sa1 h GLY 162 Ca 0.10 0.56 0.00 0.00 0.00 0.00 0.00 47.33 47.99 1sa1 h GLY 162 CO 0.54 -0.39 0.00 0.28 0.00 0.00 0.00 176.54 176.98 1sa1 n LYS 163 N -3.58 0.00 -0.79 4.80 4.01 -1.26 -4.80 118.16 116.53 1sa1 n LYS 163 Ca -0.03 0.45 -0.31 0.00 -0.51 0.00 0.00 58.31 57.90 1sa1 n LYS 163 Cb 0.16 -1.24 -0.05 0.00 -0.51 0.00 0.00 35.03 33.39 1sa1 n LYS 163 CO 0.00 0.00 0.00 1.63 -1.11 0.00 0.00 177.40 177.92 1sa1 n LYS 164 N -1.53 0.00 -2.51 1.97 4.76 -1.17 -4.85 118.16 114.82 1sa1 n LYS 164 Ca 0.00 0.00 -0.28 0.00 -2.87 0.00 0.00 58.31 55.16 1sa1 n LYS 164 Cb 0.00 -0.70 0.00 0.00 -1.84 0.00 0.00 35.03 32.50 1sa1 n LYS 164 CO 0.00 0.00 0.00 -1.54 -1.37 0.00 0.00 177.40 174.49 1sa1 s SER 165 N 1.53 6.17 0.00 4.39 1.04 -1.19 -4.93 113.70 120.71 1sa1 s SER 165 Ca 0.49 0.96 0.03 0.00 0.48 0.00 0.00 55.95 57.91 1sa1 s SER 165 Cb -0.70 -2.20 -0.01 0.00 0.10 0.00 0.00 66.02 63.21 1sa1 s SER 165 CO 0.37 -0.68 -0.09 -0.54 0.98 0.00 0.00 173.24 173.29 1sa1 s LYS 166 N -4.83 0.68 -0.23 4.02 1.02 -1.26 -2.67 119.74 116.47 1sa1 s LYS 166 Ca 0.49 -0.40 -0.00 0.00 0.02 0.00 0.00 55.97 56.08 1sa1 s LYS 166 Cb -0.10 -0.64 0.06 0.00 -0.52 0.00 0.00 37.83 36.63 1sa1 s LYS 166 CO 0.46 0.17 -0.01 -0.51 -0.92 0.00 0.00 175.35 174.54 1sa1 s LEU 167 N -0.45 2.16 0.11 3.17 1.02 -0.61 -1.04 118.68 123.04 1sa1 s LEU 167 Ca 0.02 -1.13 -0.23 0.00 0.02 0.00 0.00 54.13 52.80 1sa1 s LEU 167 Cb -0.04 -0.98 -0.07 0.00 0.02 0.00 0.00 46.19 45.12 1sa1 s LEU 167 CO -0.00 -0.28 0.70 -1.83 0.02 0.00 0.00 176.35 174.96 1sa1 s GLU 168 N 1.55 4.43 -0.44 1.70 -1.05 -1.08 -1.59 118.70 122.21 1sa1 s GLU 168 Ca -0.02 0.98 -0.08 0.00 -0.15 0.00 0.00 54.97 55.70 1sa1 s GLU 168 Cb -0.18 -3.28 0.10 0.00 -0.44 0.00 0.00 34.13 30.34 1sa1 s GLU 168 CO -0.09 0.54 0.29 -0.06 0.95 0.00 0.00 175.26 176.89 1sa1 s PHE 169 N -0.90 3.43 -0.13 4.83 0.40 -0.04 0.39 117.98 125.95 1sa1 s PHE 169 Ca 0.34 -1.87 -0.09 0.00 -0.60 0.00 0.00 56.93 54.70 1sa1 s PHE 169 Cb -0.21 -3.26 -0.04 0.00 0.51 0.00 0.00 43.02 40.01 1sa1 s PHE 169 CO 0.23 -0.94 0.17 -1.12 0.70 0.00 0.00 175.22 174.26 1sa1 s SER 170 N 2.33 6.39 -0.43 1.36 0.01 -0.32 -1.68 113.70 121.36 1sa1 s SER 170 Ca 0.05 0.46 -0.10 0.00 1.31 0.00 0.00 55.95 57.67 1sa1 s SER 170 Cb -0.25 -2.10 0.08 0.00 0.21 0.00 0.00 66.02 63.97 1sa1 s SER 170 CO -0.01 0.32 0.28 -0.63 0.41 0.00 0.00 173.24 173.62 1sa1 s ILE 171 N -0.58 4.34 -0.14 1.44 1.01 -0.91 -0.42 121.20 125.95 1sa1 s ILE 171 Ca 0.14 -1.40 -0.26 0.00 0.00 0.00 0.00 60.65 59.13 1sa1 s ILE 171 Cb -0.12 -3.67 -0.02 0.00 0.01 0.00 0.00 42.46 38.66 1sa1 s ILE 171 CO 0.03 -0.54 0.86 -0.47 0.00 0.00 0.00 174.94 174.83 1sa1 s TYR 172 N 1.44 3.47 0.14 3.97 6.14 0.56 -0.28 117.35 132.78 1sa1 s TYR 172 Ca 0.03 1.35 -0.18 0.00 0.64 0.00 0.00 57.07 58.91 1sa1 s TYR 172 Cb -0.23 -3.04 -0.07 0.00 0.42 0.00 0.00 41.96 39.04 1sa1 s TYR 172 CO 0.02 -0.20 0.62 -1.25 0.64 0.00 0.00 175.55 175.38 1sa1 s PRO 173 N 1.94 4.18 -0.30 4.97 0.05 -1.26 -2.74 135.00 141.84 1sa1 s PRO 173 Ca 0.41 0.73 -0.00 0.00 0.05 0.00 0.00 61.00 62.19 1sa1 s PRO 173 Cb -0.17 -3.07 0.06 0.00 0.05 0.00 0.00 34.50 31.37 1sa1 s PRO 173 CO 0.15 0.53 -0.01 0.00 0.05 0.00 0.00 177.00 177.72 1sa1 s ALA 174 N -1.31 2.79 0.00 8.56 0.00 -1.26 -4.91 121.76 125.63 1sa1 s ALA 174 Ca 0.35 -1.89 0.00 0.00 0.00 0.00 0.00 51.96 50.42 1sa1 s ALA 174 Cb -0.18 -1.89 0.00 0.00 0.00 0.00 0.00 23.12 21.05 1sa1 s ALA 174 CO 0.20 -1.33 0.00 -2.30 0.00 0.00 0.00 175.76 172.33 1sa1 n PRO 175 N 4.54 0.00 -0.07 0.00 -0.02 -1.26 -0.93 135.00 137.26 1sa1 n PRO 175 Ca -0.11 0.00 -0.09 0.00 -2.02 0.00 0.00 63.50 61.28 1sa1 n PRO 175 Cb 0.43 0.00 -0.07 0.00 -0.02 0.00 0.00 33.50 33.84 1sa1 n PRO 175 CO 0.00 0.00 0.00 -0.56 1.98 0.00 0.00 175.50 176.92 1sa1 h GLN 176 N 0.00 0.00 -2.63 -0.52 -0.00 -2.02 -3.38 115.11 106.56 1sa1 h GLN 176 Ca 0.00 0.00 -0.81 0.00 -0.00 0.00 0.00 58.65 57.84 1sa1 h GLN 176 Cb 0.00 0.00 -0.26 0.00 -0.00 0.00 0.00 27.48 27.22 1sa1 h GLN 176 CO 0.00 0.55 1.01 0.28 -0.00 0.00 0.00 178.83 180.67 1sa1 n VAL 177 N -4.66 5.65 -4.48 1.86 0.31 -0.11 -4.93 118.33 111.98 1sa1 n VAL 177 Ca -0.08 -5.84 -0.25 0.00 -0.01 0.00 0.00 64.34 58.16 1sa1 n VAL 177 Cb 0.30 -1.85 -0.08 0.00 -0.91 0.00 0.00 33.84 31.30 1sa1 n VAL 177 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 1sa1 s SER 178 N -1.42 2.63 0.00 4.52 1.04 -1.16 -4.43 113.70 114.88 1sa1 s SER 178 Ca 0.36 -1.71 0.00 0.00 0.48 0.00 0.00 55.95 55.08 1sa1 s SER 178 Cb 0.12 0.55 0.00 0.00 0.10 0.00 0.00 66.02 66.79 1sa1 s SER 178 CO -0.01 -0.98 0.00 0.41 0.98 0.00 0.00 173.24 173.65 1sa1 n THR 179 N -0.88 0.00 -3.89 2.02 -1.04 -1.26 -5.07 114.28 104.17 1sa1 n THR 179 Ca -0.04 0.00 -0.33 0.00 -2.04 0.00 0.00 64.05 61.65 1sa1 n THR 179 Cb 0.64 -0.22 -0.05 0.00 -1.82 0.00 0.00 70.33 68.89 1sa1 n THR 179 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1sa1 s ALA 180 N -3.61 3.96 0.23 2.41 0.00 -1.26 -4.99 121.76 118.51 1sa1 s ALA 180 Ca 0.00 -0.77 -0.09 0.00 0.00 0.00 0.00 51.96 51.10 1sa1 s ALA 180 Cb 0.00 -1.89 0.35 0.00 0.00 0.00 0.00 23.12 21.58 1sa1 s ALA 180 CO 0.00 0.77 1.35 0.28 0.00 0.00 0.00 175.76 178.15 1sa1 n VAL 181 N 0.69 -0.38 1.30 0.00 0.31 -1.26 -1.64 118.33 117.34 1sa1 n VAL 181 Ca -0.08 1.99 0.10 0.00 -0.01 0.00 0.00 64.34 66.33 1sa1 n VAL 181 Cb 0.52 -2.73 0.57 0.00 -0.91 0.00 0.00 33.84 31.30 1sa1 n VAL 181 CO 0.00 0.00 0.00 1.33 -1.32 0.00 0.00 176.83 176.84 1sa1 n VAL 182 N -5.38 0.00 -0.24 2.52 0.24 -1.26 -4.22 118.33 109.99 1sa1 n VAL 182 Ca 0.13 0.00 -0.03 0.00 -2.04 0.00 0.00 64.34 62.40 1sa1 n VAL 182 Cb 0.41 -0.64 0.03 0.00 -1.47 0.00 0.00 33.84 32.17 1sa1 n VAL 182 CO 0.00 0.00 0.00 -0.33 -2.14 0.00 0.00 176.83 174.36 1sa1 h GLU 183 N 0.00 -0.10 -0.46 7.34 3.07 -1.69 -1.47 114.58 121.27 1sa1 h GLU 183 Ca 0.00 0.01 0.05 0.00 -0.50 0.00 0.00 59.36 58.91 1sa1 h GLU 183 Cb 0.00 0.02 -0.07 0.00 -0.84 0.00 0.00 28.75 27.87 1sa1 h GLU 183 CO 0.00 -0.07 -0.37 -1.35 -1.40 0.00 0.00 179.01 175.82 1sa1 h PRO 184 N -0.10 -0.12 -0.95 2.33 0.11 -1.86 -1.15 132.00 130.25 1sa1 h PRO 184 Ca 0.28 0.01 0.27 0.00 0.11 0.00 0.00 66.00 66.67 1sa1 h PRO 184 Cb 0.56 0.03 -0.17 0.00 0.11 0.00 0.00 31.00 31.52 1sa1 h PRO 184 CO -0.74 -0.08 0.11 1.88 -0.21 0.00 0.00 178.00 178.96 1sa1 h TYR 185 N -0.13 0.10 -0.36 0.65 0.99 -1.60 -1.56 116.97 115.06 1sa1 h TYR 185 Ca 0.08 0.06 -0.05 0.00 2.00 0.00 0.00 58.73 60.82 1sa1 h TYR 185 Cb 0.33 0.11 -0.01 0.00 1.00 0.00 0.00 36.73 38.15 1sa1 h TYR 185 CO -0.84 -0.38 0.01 -0.91 -0.00 0.00 0.00 178.16 176.04 1sa1 h ASN 186 N 0.05 0.61 0.48 3.88 2.35 -1.00 0.10 115.58 122.05 1sa1 h ASN 186 Ca 0.60 -0.30 -0.02 0.00 -0.55 0.00 0.00 56.30 56.03 1sa1 h ASN 186 Cb 1.26 -0.16 0.00 0.00 0.05 0.00 0.00 38.32 39.47 1sa1 h ASN 186 CO -0.84 0.76 -0.23 0.28 -1.65 0.00 0.00 177.43 175.75 1sa1 h SER 187 N 0.45 -0.54 -1.07 5.81 0.02 -0.45 -0.21 113.55 117.56 1sa1 h SER 187 Ca 0.10 0.02 0.29 0.00 -0.84 0.00 0.00 61.79 61.36 1sa1 h SER 187 Cb 0.44 0.14 -0.10 0.00 0.14 0.00 0.00 62.40 63.01 1sa1 h SER 187 CO 0.02 -0.22 0.68 0.40 -1.14 0.00 0.00 176.83 176.56 1sa1 h ILE 188 N -0.96 0.47 0.49 3.27 1.08 -1.41 0.99 117.51 121.44 1sa1 h ILE 188 Ca -0.07 -0.13 -0.02 0.00 -0.39 0.00 0.00 64.86 64.25 1sa1 h ILE 188 Cb 0.49 0.06 0.00 0.00 -3.07 0.00 0.00 36.82 34.31 1sa1 h ILE 188 CO 0.11 0.07 -0.24 -0.07 -0.69 0.00 0.00 178.15 177.33 1sa1 h LEU 189 N 0.37 -0.56 0.38 1.44 3.38 -0.79 -3.00 115.31 116.53 1sa1 h LEU 189 Ca 0.63 0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.62 1sa1 h LEU 189 Cb 1.61 0.15 -0.02 0.00 0.09 0.00 0.00 40.66 42.48 1sa1 h LEU 189 CO -0.34 -0.34 -0.39 0.74 0.09 0.00 0.00 178.44 178.19 1sa1 h THR 190 N -0.78 0.20 -0.10 0.22 2.02 0.12 -2.70 112.91 111.89 1sa1 h THR 190 Ca -0.07 0.00 0.03 0.00 0.77 0.00 0.00 66.41 67.14 1sa1 h THR 190 Cb 0.51 0.20 -0.00 0.00 -1.74 0.00 0.00 68.15 67.11 1sa1 h THR 190 CO 0.11 0.00 0.18 0.00 0.37 0.00 0.00 175.52 176.18 1sa1 h THR 191 N -0.80 0.26 0.60 3.16 1.03 0.69 0.80 112.91 118.64 1sa1 h THR 191 Ca -0.03 0.00 -0.03 0.00 -0.01 0.00 0.00 66.41 66.34 1sa1 h THR 191 Cb 0.72 0.84 0.01 0.00 -1.07 0.00 0.00 68.15 68.64 1sa1 h THR 191 CO -0.08 0.00 -0.29 -0.74 -0.01 0.00 0.00 175.52 174.41 1sa1 h HIS 192 N 0.00 -0.74 0.38 0.00 6.17 -1.33 -2.62 115.15 117.01 1sa1 h HIS 192 Ca 0.05 -0.02 -0.01 0.00 0.71 0.00 0.00 60.37 61.10 1sa1 h HIS 192 Cb 0.41 0.25 -0.01 0.00 2.52 0.00 0.00 27.41 30.58 1sa1 h HIS 192 CO 0.00 -0.46 -0.25 1.15 0.71 0.00 0.00 177.93 179.07 1sa1 h THR 193 N -1.15 0.47 -1.01 6.26 2.02 -0.63 -3.15 112.91 115.72 1sa1 h THR 193 Ca -0.08 0.00 0.15 0.00 0.77 0.00 0.00 66.41 67.24 1sa1 h THR 193 Cb 0.61 0.47 -0.09 0.00 -1.74 0.00 0.00 68.15 67.40 1sa1 h THR 193 CO 0.13 0.00 0.63 0.00 0.37 0.00 0.00 175.52 176.65 1sa1 h THR 194 N -0.62 0.84 0.00 3.16 1.03 0.33 -3.09 112.91 114.56 1sa1 h THR 194 Ca -0.04 -0.31 -0.00 0.00 -0.01 0.00 0.00 66.41 66.05 1sa1 h THR 194 Cb 0.52 -0.15 -0.00 0.00 -1.07 0.00 0.00 68.15 67.45 1sa1 h THR 194 CO 0.03 0.17 -0.01 0.25 -0.01 0.00 0.00 175.52 175.94 1sa1 h LEU 195 N 0.91 0.00 -1.58 0.00 6.46 -1.42 -1.26 115.31 118.43 1sa1 h LEU 195 Ca 0.53 0.00 -0.00 0.00 -0.12 0.00 0.00 57.88 58.28 1sa1 h LEU 195 Cb 0.64 0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 40.57 1sa1 h LEU 195 CO -0.31 0.01 -0.02 -0.33 -0.62 0.00 0.00 178.44 177.17 1sa1 h GLU 196 N 0.00 0.00 0.00 1.25 5.08 -1.70 -3.32 114.58 115.89 1sa1 h GLU 196 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1sa1 h GLU 196 Cb 0.03 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.28 1sa1 h GLU 196 CO 0.00 0.02 -0.67 0.72 -1.00 0.00 0.00 179.01 178.08 1sa1 n HIS 197 N -3.13 0.00 -3.55 4.33 8.25 -0.50 -4.99 115.22 115.62 1sa1 n HIS 197 Ca 0.00 0.00 -0.37 0.00 -0.26 0.00 0.00 57.72 57.09 1sa1 n HIS 197 Cb 0.29 -0.06 -0.06 0.00 1.12 0.00 0.00 29.99 31.29 1sa1 n HIS 197 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 1sa1 s SER 198 N -2.02 6.65 0.00 0.41 0.01 -1.05 -4.74 113.70 112.95 1sa1 s SER 198 Ca 0.01 0.77 0.26 0.00 1.31 0.00 0.00 55.95 58.30 1sa1 s SER 198 Cb 0.05 -2.21 0.74 0.00 0.21 0.00 0.00 66.02 64.81 1sa1 s SER 198 CO 0.26 0.26 1.57 0.47 0.41 0.00 0.00 173.24 176.21 1sa1 n ASP 199 N 2.40 0.54 0.00 2.44 9.92 -0.20 -4.53 116.55 127.12 1sa1 n ASP 199 Ca -0.14 -0.32 0.00 0.00 -0.53 0.00 0.00 54.79 53.80 1sa1 n ASP 199 Cb 0.53 0.09 0.00 0.00 -0.64 0.00 0.00 41.12 41.09 1sa1 n ASP 199 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1sa1 s ALA 201 N -1.43 -0.59 -0.65 0.00 0.00 -1.07 -2.64 121.76 115.38 1sa1 s ALA 201 Ca 0.00 0.97 -0.19 0.00 0.00 0.00 0.00 51.96 52.74 1sa1 s ALA 201 Cb 0.00 -0.61 0.11 0.00 0.00 0.00 0.00 23.12 22.62 1sa1 s ALA 201 CO 0.00 -0.19 0.78 -0.06 0.00 0.00 0.00 175.76 176.29 1sa1 s PHE 202 N 1.07 3.03 0.34 0.00 2.99 0.16 -3.57 117.98 122.00 1sa1 s PHE 202 Ca -0.08 -1.04 -0.27 0.00 0.00 0.00 0.00 56.93 55.54 1sa1 s PHE 202 Cb -0.09 -4.06 -0.09 0.00 0.00 0.00 0.00 43.02 38.78 1sa1 s PHE 202 CO -0.07 -1.33 1.18 -1.64 -0.00 0.00 0.00 175.22 173.35 1sa1 s MET 203 N 2.64 4.32 -0.06 0.44 -1.94 -1.26 -1.17 119.30 122.28 1sa1 s MET 203 Ca 0.15 1.91 -0.01 0.00 -1.71 0.00 0.00 55.69 56.03 1sa1 s MET 203 Cb -0.21 -2.93 0.03 0.00 2.01 0.00 0.00 34.83 33.73 1sa1 s MET 203 CO 0.04 -0.11 0.02 0.08 -0.01 0.00 0.00 175.02 175.04 1sa1 s VAL 204 N -1.27 0.22 -0.19 -6.03 1.01 0.44 -4.70 120.40 109.87 1sa1 s VAL 204 Ca 0.51 0.22 -0.06 0.00 0.00 0.00 0.00 61.98 62.65 1sa1 s VAL 204 Cb -0.33 -0.41 -0.03 0.00 0.00 0.00 0.00 36.38 35.61 1sa1 s VAL 204 CO 0.43 0.23 0.02 -0.62 0.00 0.00 0.00 175.10 175.15 1sa1 s ASP 205 N 2.00 5.08 0.12 3.32 -1.08 -0.66 -0.33 116.67 125.12 1sa1 s ASP 205 Ca 0.04 -0.10 -0.16 0.00 -0.52 0.00 0.00 52.55 51.81 1sa1 s ASP 205 Cb -0.12 -1.86 -0.03 0.00 -1.46 0.00 0.00 42.92 39.44 1sa1 s ASP 205 CO -0.04 0.11 1.59 0.78 0.52 0.00 0.00 175.17 178.13 1sa1 h ASN 206 N 7.15 0.59 0.00 -0.34 -0.26 -1.81 -0.92 115.58 119.99 1sa1 h ASN 206 Ca -0.35 -0.27 0.00 0.00 -0.56 0.00 0.00 56.30 55.12 1sa1 h ASN 206 Cb 1.18 -0.16 0.00 0.00 -1.06 0.00 0.00 38.32 38.28 1sa1 h ASN 206 CO 0.63 0.71 0.18 1.21 -1.06 0.00 0.00 177.43 179.10 1sa1 n GLU 207 N -4.55 0.00 -0.12 0.81 2.13 -1.26 0.15 120.64 117.80 1sa1 n GLU 207 Ca -0.01 0.24 -0.16 0.00 0.66 0.00 0.00 57.16 57.89 1sa1 n GLU 207 Cb 0.23 -1.68 -0.11 0.00 0.27 0.00 0.00 31.44 30.15 1sa1 n GLU 207 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1sa1 n ALA 208 N -1.21 1.49 0.21 4.31 0.00 -0.37 -3.43 120.51 121.51 1sa1 n ALA 208 Ca 0.00 -1.03 -0.13 0.00 0.00 0.00 0.00 53.44 52.28 1sa1 n ALA 208 Cb 0.18 -0.06 -0.07 0.00 0.00 0.00 0.00 19.45 19.50 1sa1 n ALA 208 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1sa1 h ILE 209 N 0.00 0.45 -0.39 0.00 1.08 -0.32 0.24 117.51 118.57 1sa1 h ILE 209 Ca -0.53 -0.56 0.08 0.00 -0.39 0.00 0.00 64.86 63.47 1sa1 h ILE 209 Cb 1.85 0.66 -0.09 0.00 -3.07 0.00 0.00 36.82 36.17 1sa1 h ILE 209 CO -0.07 0.08 -0.27 0.22 -0.69 0.00 0.00 178.15 177.42 1sa1 h TYR 210 N -0.94 -0.72 -0.14 1.37 5.03 0.11 0.17 116.97 121.86 1sa1 h TYR 210 Ca -0.06 0.05 0.01 0.00 2.58 0.00 0.00 58.73 61.31 1sa1 h TYR 210 Cb 0.56 0.38 -0.01 0.00 1.55 0.00 0.00 36.73 39.21 1sa1 h TYR 210 CO 0.02 -0.34 0.09 -0.44 -1.32 0.00 0.00 178.16 176.17 1sa1 h ASP 211 N -0.20 0.14 -0.40 -2.11 3.32 -1.55 0.54 116.42 116.16 1sa1 h ASP 211 Ca 0.18 -0.00 -0.15 0.00 0.02 0.00 0.00 57.03 57.08 1sa1 h ASP 211 Cb 0.50 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 40.00 1sa1 h ASP 211 CO -0.51 0.10 -0.35 0.40 -1.72 0.00 0.00 179.24 177.16 1sa1 h ILE 212 N 0.17 1.27 0.00 0.35 5.03 0.22 -3.15 117.51 121.39 1sa1 h ILE 212 Ca 0.05 -1.52 0.00 0.00 -0.12 0.00 0.00 64.86 63.27 1sa1 h ILE 212 Cb 0.01 1.34 0.00 0.00 -3.03 0.00 0.00 36.82 35.15 1sa1 h ILE 212 CO -0.01 0.51 0.00 0.00 -0.68 0.00 0.00 178.15 177.97 1sa1 n ARG 214 N 1.61 0.00 0.20 0.00 1.74 -1.21 -3.14 116.66 115.86 1sa1 n ARG 214 Ca 0.00 0.00 0.06 0.00 -0.77 0.00 0.00 57.85 57.14 1sa1 n ARG 214 Cb 0.30 0.00 0.38 0.00 -1.02 0.00 0.00 32.46 32.12 1sa1 n ARG 214 CO 0.00 0.00 0.00 -0.09 -1.52 0.00 0.00 177.63 176.02 1sa1 h ARG 215 N 0.00 0.00 0.00 5.56 2.43 -1.45 -3.19 114.38 117.74 1sa1 h ARG 215 Ca 0.00 0.00 -0.07 0.00 -0.81 0.00 0.00 59.98 59.10 1sa1 h ARG 215 Cb 0.00 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.54 1sa1 h ARG 215 CO 0.00 0.35 -1.16 0.09 -1.51 0.00 0.00 179.97 177.74 1sa1 n ASN 216 N -3.59 0.39 0.00 -3.80 3.02 0.26 -4.63 115.26 106.90 1sa1 n ASN 216 Ca -0.01 0.06 0.13 0.00 -0.03 0.00 0.00 54.58 54.74 1sa1 n ASN 216 Cb 0.47 -0.15 0.39 0.00 -0.61 0.00 0.00 39.78 39.88 1sa1 n ASN 216 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1sa1 n LEU 217 N -3.24 0.31 -3.81 3.41 4.32 -1.21 -4.08 117.00 112.70 1sa1 n LEU 217 Ca -0.08 0.19 -0.31 0.00 -0.02 0.00 0.00 56.01 55.79 1sa1 n LEU 217 Cb 0.52 -0.34 0.01 0.00 -1.62 0.00 0.00 43.42 41.99 1sa1 n LEU 217 CO 0.01 0.08 -0.15 -0.67 -1.22 0.00 0.00 177.39 175.44 1sa1 n ASP 218 N -1.51 -4.94 -4.00 -1.43 2.03 -1.20 -4.88 116.55 100.62 1sa1 n ASP 218 Ca 0.06 -1.01 -0.27 0.00 0.52 0.00 0.00 54.79 54.08 1sa1 n ASP 218 Cb 0.34 -2.22 -0.17 0.00 -0.72 0.00 0.00 41.12 38.35 1sa1 n ASP 218 CO 0.00 0.00 0.00 0.27 -1.92 0.00 0.00 177.20 175.55 1sa1 s ILE 219 N -3.24 1.29 -1.67 5.18 -5.25 -1.19 -4.98 121.20 111.35 1sa1 s ILE 219 Ca 0.23 -0.50 0.00 0.00 -0.99 0.00 0.00 60.65 59.39 1sa1 s ILE 219 Cb -0.11 -1.21 0.00 0.00 2.95 0.00 0.00 42.46 44.08 1sa1 s ILE 219 CO 0.90 0.40 0.31 1.21 -1.79 0.00 0.00 174.94 175.97 1sa1 n GLU 220 N 4.39 0.37 -0.04 0.37 2.13 -1.26 -4.12 120.64 122.47 1sa1 n GLU 220 Ca -0.18 0.00 -0.04 0.00 0.66 0.00 0.00 57.16 57.60 1sa1 n GLU 220 Cb 0.51 -1.06 -0.06 0.00 0.27 0.00 0.00 31.44 31.10 1sa1 n GLU 220 CO 0.00 0.00 0.00 0.54 -0.41 0.00 0.00 177.13 177.26 1sa1 n ARG 221 N -0.23 2.36 0.00 5.31 5.12 -1.26 -5.09 116.66 122.88 1sa1 n ARG 221 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 1sa1 n ARG 221 Cb 0.03 -1.21 0.00 0.00 -1.16 0.00 0.00 32.46 30.12 1sa1 n ARG 221 CO 0.00 0.00 0.00 -2.30 -1.93 0.00 0.00 177.63 173.40 1sa1 n PRO 222 N -2.37 0.00 -2.70 5.56 -0.01 -1.26 -4.95 135.00 129.27 1sa1 n PRO 222 Ca -0.14 0.00 -0.34 0.00 -0.01 0.00 0.00 63.50 63.01 1sa1 n PRO 222 Cb 0.76 0.00 -0.06 0.00 -0.01 0.00 0.00 33.50 34.19 1sa1 n PRO 222 CO 0.00 0.00 0.00 0.99 -0.01 0.00 0.00 175.50 176.48 1sa1 s THR 223 N 0.00 4.12 0.14 3.45 2.01 -1.26 -4.91 115.64 119.18 1sa1 s THR 223 Ca 0.00 1.40 -0.27 0.00 0.31 0.00 0.00 61.69 63.13 1sa1 s THR 223 Cb 0.00 -3.61 -0.02 0.00 0.01 0.00 0.00 72.50 68.88 1sa1 s THR 223 CO 0.00 -0.20 1.59 1.88 -0.69 0.00 0.00 174.62 177.20 1sa1 h TYR 224 N 2.03 -1.05 -0.61 4.92 0.99 -2.00 0.51 116.97 121.76 1sa1 h TYR 224 Ca -0.49 0.05 0.13 0.00 2.00 0.00 0.00 58.73 60.42 1sa1 h TYR 224 Cb 1.20 0.49 -0.11 0.00 1.00 0.00 0.00 36.73 39.31 1sa1 h TYR 224 CO 0.60 -0.43 -0.08 1.79 -0.00 0.00 0.00 178.16 180.04 1sa1 h THR 225 N -0.41 0.44 -0.71 -2.88 1.35 -1.99 -1.16 112.91 107.55 1sa1 h THR 225 Ca 0.10 -0.02 0.12 0.00 -0.55 0.00 0.00 66.41 66.07 1sa1 h THR 225 Cb 0.58 0.38 -0.13 0.00 -1.73 0.00 0.00 68.15 67.26 1sa1 h THR 225 CO -0.42 0.01 -0.34 0.78 -0.25 0.00 0.00 175.52 175.30 1sa1 h ASN 226 N 0.05 -1.21 0.00 5.36 -0.26 -1.32 -0.56 115.58 117.65 1sa1 h ASN 226 Ca 0.31 0.25 0.00 0.00 -0.56 0.00 0.00 56.30 56.30 1sa1 h ASN 226 Cb 0.49 0.62 -0.00 0.00 -1.06 0.00 0.00 38.32 38.36 1sa1 h ASN 226 CO -0.57 -0.30 -0.01 -0.07 -1.06 0.00 0.00 177.43 175.42 1sa1 h LEU 227 N -0.11 -0.02 -0.07 1.61 -0.00 -0.59 -3.23 115.31 112.91 1sa1 h LEU 227 Ca 0.27 0.00 0.03 0.00 -0.00 0.00 0.00 57.88 58.18 1sa1 h LEU 227 Cb 0.56 0.01 -0.06 0.00 -0.00 0.00 0.00 40.66 41.17 1sa1 h LEU 227 CO -0.77 -0.01 -0.50 0.78 -0.00 0.00 0.00 178.44 177.94 1sa1 h ASN 228 N -0.01 -1.58 -0.51 -0.43 2.35 0.07 -0.95 115.58 114.52 1sa1 h ASN 228 Ca 0.00 0.19 0.15 0.00 -0.55 0.00 0.00 56.30 56.09 1sa1 h ASN 228 Cb 0.02 0.61 -0.02 0.00 0.05 0.00 0.00 38.32 38.98 1sa1 h ASN 228 CO -0.00 -0.49 0.47 0.03 -1.65 0.00 0.00 177.43 175.78 1sa1 h ARG 229 N -0.60 0.00 -0.01 0.81 3.08 -1.30 0.91 114.38 117.26 1sa1 h ARG 229 Ca 0.04 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.06 1sa1 h ARG 229 Cb 0.69 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.74 1sa1 h ARG 229 CO -0.39 0.00 -0.09 1.25 -1.07 0.00 0.00 179.97 179.67 1sa1 h LEU 230 N 0.00 0.09 0.07 3.04 5.85 -1.24 -1.08 115.31 122.05 1sa1 h LEU 230 Ca 0.24 -0.72 0.00 0.00 0.84 0.00 0.00 57.88 58.24 1sa1 h LEU 230 Cb 1.18 -0.03 -0.00 0.00 0.37 0.00 0.00 40.66 42.17 1sa1 h LEU 230 CO -0.00 0.80 -0.05 0.40 -0.34 0.00 0.00 178.44 179.24 1sa1 h ILE 231 N -0.61 0.88 -0.92 4.05 1.08 0.09 -2.39 117.51 119.70 1sa1 h ILE 231 Ca -0.01 0.00 0.14 0.00 -0.39 0.00 0.00 64.86 64.60 1sa1 h ILE 231 Cb 0.81 0.88 -0.15 0.00 -3.07 0.00 0.00 36.82 35.29 1sa1 h ILE 231 CO 0.02 0.00 -0.36 0.61 -0.69 0.00 0.00 178.15 177.73 1sa1 n GLY 232 N -1.16 -1.89 0.43 5.37 0.00 0.29 -0.42 105.19 107.81 1sa1 n GLY 232 Ca -0.07 1.03 -0.16 0.00 0.00 0.00 0.00 46.02 46.81 1sa1 n GLY 232 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1sa1 h GLN 233 N 0.00 -0.79 -0.37 1.61 5.75 -0.92 -1.02 115.11 119.37 1sa1 h GLN 233 Ca 0.32 0.05 0.06 0.00 -0.15 0.00 0.00 58.65 58.93 1sa1 h GLN 233 Cb 0.54 0.18 -0.08 0.00 1.07 0.00 0.00 27.48 29.19 1sa1 h GLN 233 CO -0.91 -0.53 -0.50 0.82 -2.65 0.00 0.00 178.83 175.07 1sa1 h ILE 234 N -0.82 0.05 -0.99 2.39 5.03 -0.23 0.13 117.51 123.06 1sa1 h ILE 234 Ca -0.03 0.00 0.26 0.00 -0.12 0.00 0.00 64.86 64.97 1sa1 h ILE 234 Cb 0.75 0.05 -0.13 0.00 -3.03 0.00 0.00 36.82 34.46 1sa1 h ILE 234 CO -0.11 0.00 0.56 0.58 -0.68 0.00 0.00 178.15 178.51 1sa1 h VAL 235 N -0.39 0.48 0.56 1.67 2.07 -0.66 0.37 116.25 120.35 1sa1 h VAL 235 Ca 0.10 -0.18 -0.02 0.00 0.82 0.00 0.00 66.70 67.42 1sa1 h VAL 235 Cb 0.60 -0.07 -0.01 0.00 -1.52 0.00 0.00 31.29 30.29 1sa1 h VAL 235 CO -0.57 0.09 -0.40 -1.28 0.02 0.00 0.00 177.57 175.44 1sa1 h SER 236 N 0.51 -1.03 -0.63 0.57 0.87 0.59 -0.94 113.55 113.50 1sa1 h SER 236 Ca 0.65 0.07 0.00 0.00 -1.23 0.00 0.00 61.79 61.28 1sa1 h SER 236 Cb 1.29 0.32 -0.03 0.00 -0.44 0.00 0.00 62.40 63.53 1sa1 h SER 236 CO -0.51 -0.60 0.41 0.28 -0.53 0.00 0.00 176.83 175.88 1sa1 h SER 237 N -0.93 0.73 0.52 6.23 0.02 0.50 -2.77 113.55 117.86 1sa1 h SER 237 Ca -0.06 -0.02 -0.02 0.00 -0.84 0.00 0.00 61.79 60.85 1sa1 h SER 237 Cb 0.77 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 63.12 1sa1 h SER 237 CO 0.03 0.54 -0.41 0.40 -1.14 0.00 0.00 176.83 176.25 1sa1 h ILE 238 N 0.86 0.18 0.00 3.27 1.08 -0.27 -3.41 117.51 119.22 1sa1 h ILE 238 Ca 0.23 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.70 1sa1 h ILE 238 Cb -0.08 0.18 0.00 0.00 -3.07 0.00 0.00 36.82 33.85 1sa1 h ILE 238 CO -0.05 0.00 0.00 0.35 -0.69 0.00 0.00 178.15 177.76 1sa1 n THR 239 N -5.52 0.00 0.00 -0.27 -2.24 -0.37 -4.45 114.28 101.43 1sa1 n THR 239 Ca -0.12 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.66 1sa1 n THR 239 Cb 0.41 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.64 1sa1 n THR 239 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1sa1 n ALA 240 N -3.00 0.00 -0.28 6.98 0.00 -1.25 -4.26 120.51 118.71 1sa1 n ALA 240 Ca 0.00 0.00 0.16 0.00 0.00 0.00 0.00 53.44 53.60 1sa1 n ALA 240 Cb 0.00 0.00 0.44 0.00 0.00 0.00 0.00 19.45 19.89 1sa1 n ALA 240 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1sa1 h SER 241 N 0.00 0.55 -0.16 0.00 4.64 -1.79 -2.54 113.55 114.25 1sa1 h SER 241 Ca 0.00 0.05 0.00 0.00 -0.47 0.00 0.00 61.79 61.37 1sa1 h SER 241 Cb 0.00 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.04 1sa1 h SER 241 CO 0.00 0.22 0.00 0.00 -0.87 0.00 0.00 176.83 176.18 1sa1 n LEU 242 N -4.58 2.57 -0.08 5.97 -0.00 -1.26 -3.68 117.00 115.93 1sa1 n LEU 242 Ca 0.20 -1.32 -0.10 0.00 -0.00 0.00 0.00 56.01 54.79 1sa1 n LEU 242 Cb 0.62 -0.10 -0.10 0.00 -0.00 0.00 0.00 43.42 43.85 1sa1 n LEU 242 CO 0.28 0.54 -1.03 -2.11 -0.00 0.00 0.00 177.39 175.06 1sa1 n ARG 243 N 0.85 1.04 -0.10 1.47 1.85 -1.18 -4.56 116.66 116.02 1sa1 n ARG 243 Ca 0.11 0.05 -0.19 0.00 -1.00 0.00 0.00 57.85 56.82 1sa1 n ARG 243 Cb 0.41 -1.37 -0.06 0.00 -1.05 0.00 0.00 32.46 30.39 1sa1 n ARG 243 CO 0.00 0.00 0.00 1.19 -0.01 0.00 0.00 177.63 178.81 1sa1 n PHE 244 N -2.79 0.00 0.79 2.89 3.01 -0.97 -3.87 117.46 116.52 1sa1 n PHE 244 Ca -0.28 0.00 0.10 0.00 1.01 0.00 0.00 57.45 58.28 1sa1 n PHE 244 Cb 0.90 -0.71 0.47 0.00 -0.01 0.00 0.00 39.48 40.12 1sa1 n PHE 244 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 1sa1 n ASP 245 N -4.18 0.00 -2.48 4.37 -0.08 -1.24 -3.78 116.55 109.15 1sa1 n ASP 245 Ca -0.35 0.36 -0.05 0.00 -1.51 0.00 0.00 54.79 53.24 1sa1 n ASP 245 Cb 0.70 -0.44 -0.04 0.00 2.34 0.00 0.00 41.12 43.67 1sa1 n ASP 245 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1sa1 n GLY 246 N 0.60 1.76 0.11 0.27 0.00 -1.25 -3.85 105.19 102.83 1sa1 n GLY 246 Ca 0.06 -0.38 0.13 0.00 0.00 0.00 0.00 46.02 45.82 1sa1 n GLY 246 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sa1 n ALA 247 N 3.16 2.00 -2.00 4.61 0.00 -1.25 -3.96 120.51 123.06 1sa1 n ALA 247 Ca 0.15 0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.62 1sa1 n ALA 247 Cb 0.24 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.26 1sa1 n ALA 247 CO 0.00 0.00 0.00 1.47 0.00 0.00 0.00 177.50 178.97 1sa1 n LEU 248 N -2.24 0.00 -3.47 0.00 -0.00 -1.25 -4.94 117.00 105.10 1sa1 n LEU 248 Ca 0.04 0.00 -0.40 0.00 -0.00 0.00 0.00 56.01 55.65 1sa1 n LEU 248 Cb 0.34 0.00 -0.01 0.00 -0.00 0.00 0.00 43.42 43.75 1sa1 n LEU 248 CO 0.25 0.00 2.49 0.59 -0.00 0.00 0.00 177.39 180.73 1sa1 n ASN 249 N 0.00 8.07 -4.89 1.45 3.02 -1.26 -4.96 115.26 116.69 1sa1 n ASN 249 Ca 0.00 -3.09 -0.22 0.00 -0.03 0.00 0.00 54.58 51.24 1sa1 n ASN 249 Cb 0.00 -1.38 -0.03 0.00 -0.61 0.00 0.00 39.78 37.76 1sa1 n ASN 249 CO 0.00 0.00 0.00 0.68 -2.62 0.00 0.00 177.26 175.32 1sa1 s VAL 250 N -0.82 4.86 -0.20 2.41 -7.23 -1.26 -5.07 120.40 113.08 1sa1 s VAL 250 Ca 0.55 -1.17 0.05 0.00 -1.81 0.00 0.00 61.98 59.60 1sa1 s VAL 250 Cb 0.18 -3.62 0.16 0.00 0.56 0.00 0.00 36.38 33.66 1sa1 s VAL 250 CO -0.09 -0.32 0.99 -0.90 -0.31 0.00 0.00 175.10 174.47 1sa1 n ASP 251 N -1.22 -0.84 0.00 4.85 5.75 -1.26 -4.48 116.55 119.35 1sa1 n ASP 251 Ca -0.08 -1.62 0.00 0.00 -0.01 0.00 0.00 54.79 53.08 1sa1 n ASP 251 Cb 0.57 0.51 0.00 0.00 -1.03 0.00 0.00 41.12 41.18 1sa1 n ASP 251 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1sa1 n LEU 252 N -0.59 0.00 -0.05 -2.12 4.77 -1.26 -4.57 117.00 113.17 1sa1 n LEU 252 Ca -0.11 0.00 -0.00 0.00 -0.03 0.00 0.00 56.01 55.86 1sa1 n LEU 252 Cb 0.67 0.00 -0.00 0.00 -2.33 0.00 0.00 43.42 41.76 1sa1 n LEU 252 CO -0.08 -0.06 -0.00 0.41 -1.33 0.00 0.00 177.39 176.33 1sa1 n THR 253 N 0.00 0.00 0.00 -5.08 -1.04 -1.26 -3.93 114.28 102.97 1sa1 n THR 253 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1sa1 n THR 253 Cb 0.00 -0.38 0.00 0.00 -1.82 0.00 0.00 70.33 68.13 1sa1 n THR 253 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1sa1 n GLU 254 N 0.29 1.40 -0.03 -2.82 1.02 -1.26 -3.29 120.64 115.95 1sa1 n GLU 254 Ca -0.00 0.00 -0.11 0.00 -0.02 0.00 0.00 57.16 57.03 1sa1 n GLU 254 Cb 0.19 -0.17 -0.05 0.00 -0.02 0.00 0.00 31.44 31.39 1sa1 n GLU 254 CO 0.00 0.00 0.00 0.27 1.18 0.00 0.00 177.13 178.58 1sa1 h PHE 255 N 0.00 0.19 0.00 -0.32 -0.00 -1.93 -3.28 116.94 111.60 1sa1 h PHE 255 Ca 0.00 -0.01 0.00 0.00 -0.00 0.00 0.00 57.97 57.96 1sa1 h PHE 255 Cb 0.00 -0.06 0.00 0.00 -0.00 0.00 0.00 35.95 35.89 1sa1 h PHE 255 CO 0.00 0.21 0.00 0.94 -0.00 0.00 0.00 178.31 179.46 1sa1 n GLN 256 N -4.93 0.00 0.00 6.09 -0.06 -1.26 -2.97 117.38 114.24 1sa1 n GLN 256 Ca -0.05 0.00 0.00 0.00 -2.00 0.00 0.00 57.00 54.95 1sa1 n GLN 256 Cb 0.08 -0.24 0.00 0.00 -4.06 0.00 0.00 30.24 26.02 1sa1 n GLN 256 CO 0.00 0.00 0.00 2.41 -0.20 0.00 0.00 177.06 179.27 1sa1 n THR 257 N 0.00 0.00 1.70 1.69 -1.04 -1.21 0.27 114.28 115.69 1sa1 n THR 257 Ca 0.00 0.00 0.15 0.00 -2.04 0.00 0.00 64.05 62.16 1sa1 n THR 257 Cb 0.00 0.00 0.71 0.00 -1.82 0.00 0.00 70.33 69.22 1sa1 n THR 257 CO 0.00 0.00 0.00 0.59 -0.64 0.00 0.00 175.07 175.02 1sa1 n ASN 258 N -2.02 0.78 0.00 8.00 5.03 -1.16 -4.60 115.26 121.29 1sa1 n ASN 258 Ca 0.00 -1.20 0.00 0.00 0.87 0.00 0.00 54.58 54.25 1sa1 n ASN 258 Cb 0.00 -0.00 0.00 0.00 -1.02 0.00 0.00 39.78 38.76 1sa1 n ASN 258 CO 0.00 0.00 0.00 0.18 -1.83 0.00 0.00 177.26 175.61 1sa1 n LEU 259 N -0.43 0.73 -4.50 3.41 4.77 0.78 -4.77 117.00 116.99 1sa1 n LEU 259 Ca 0.21 0.00 -0.37 0.00 -0.03 0.00 0.00 56.01 55.82 1sa1 n LEU 259 Cb 0.25 0.00 -0.12 0.00 -2.33 0.00 0.00 43.42 41.22 1sa1 n LEU 259 CO 0.18 0.04 -0.24 0.68 -1.33 0.00 0.00 177.39 176.72 1sa1 s VAL 260 N -1.48 4.65 -0.94 4.08 -7.23 -1.12 -4.67 120.40 113.70 1sa1 s VAL 260 Ca 0.00 -0.06 0.25 0.00 -1.81 0.00 0.00 61.98 60.36 1sa1 s VAL 260 Cb 0.00 -3.18 0.02 0.00 0.56 0.00 0.00 36.38 33.78 1sa1 s VAL 260 CO 0.00 0.32 1.42 -0.81 -0.31 0.00 0.00 175.10 175.72 1sa1 n PRO 261 N 4.87 0.05 -3.95 4.82 -0.04 -1.26 -4.74 135.00 134.74 1sa1 n PRO 261 Ca -0.16 0.01 -0.09 0.00 -0.04 0.00 0.00 63.50 63.23 1sa1 n PRO 261 Cb 0.52 -1.53 -0.10 0.00 -0.04 0.00 0.00 33.50 32.35 1sa1 n PRO 261 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 1sa1 s TYR 262 N -3.03 0.24 0.25 0.54 1.51 -1.26 -5.03 117.35 110.57 1sa1 s TYR 262 Ca 0.10 -0.56 -0.05 0.00 -1.01 0.00 0.00 57.07 55.56 1sa1 s TYR 262 Cb 0.17 -0.17 0.48 0.00 -0.11 0.00 0.00 41.96 42.32 1sa1 s TYR 262 CO 0.70 -0.34 1.68 -1.00 -1.11 0.00 0.00 175.55 175.47 1sa1 h PRO 263 N 3.75 0.24 -4.90 -1.71 0.13 -2.00 -3.32 132.00 124.19 1sa1 h PRO 263 Ca -0.33 -0.01 -0.55 0.00 -0.87 0.00 0.00 66.00 64.24 1sa1 h PRO 263 Cb 1.18 -0.05 0.11 0.00 0.13 0.00 0.00 31.00 32.37 1sa1 h PRO 263 CO 0.51 0.16 1.46 0.54 -0.23 0.00 0.00 178.00 180.43 1sa1 n ARG 264 N -5.18 0.39 0.00 0.86 5.12 -1.26 -4.54 116.66 112.05 1sa1 n ARG 264 Ca 0.15 -1.29 0.00 0.00 -1.93 0.00 0.00 57.85 54.78 1sa1 n ARG 264 Cb 0.48 -2.75 0.00 0.00 -1.16 0.00 0.00 32.46 29.03 1sa1 n ARG 264 CO 0.00 0.00 0.00 1.51 -1.93 0.00 0.00 177.63 177.21 1sa1 n ILE 265 N 6.98 0.00 -1.06 0.55 3.06 -1.25 -4.72 119.36 122.92 1sa1 n ILE 265 Ca 0.47 0.00 -0.41 0.00 -2.50 0.00 0.00 62.75 60.31 1sa1 n ILE 265 Cb 0.42 0.00 -0.05 0.00 0.54 0.00 0.00 39.64 40.55 1sa1 n ILE 265 CO 0.00 0.00 0.00 1.41 -2.50 0.00 0.00 176.55 175.46 1sa1 n HIS 266 N 0.24 0.29 -3.20 9.51 8.25 -1.26 -2.61 115.22 126.43 1sa1 n HIS 266 Ca 0.00 0.75 -0.44 0.00 -0.26 0.00 0.00 57.72 57.77 1sa1 n HIS 266 Cb 0.00 -1.48 -0.07 0.00 1.12 0.00 0.00 29.99 29.56 1sa1 n HIS 266 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 1sa1 s PHE 267 N -0.15 3.09 0.90 4.41 0.40 -1.26 -3.83 117.98 121.54 1sa1 s PHE 267 Ca 0.61 -0.52 -0.10 0.00 -0.60 0.00 0.00 56.93 56.32 1sa1 s PHE 267 Cb -0.86 -3.39 0.14 0.00 0.51 0.00 0.00 43.02 39.41 1sa1 s PHE 267 CO 0.41 -0.95 1.13 -2.14 0.70 0.00 0.00 175.22 174.37 1sa1 s PRO 268 N 2.47 1.15 -0.17 0.24 0.02 -1.23 -4.80 135.00 132.67 1sa1 s PRO 268 Ca 0.14 1.44 -0.09 0.00 0.02 0.00 0.00 61.00 62.51 1sa1 s PRO 268 Cb -0.19 -1.75 -0.05 0.00 0.02 0.00 0.00 34.50 32.53 1sa1 s PRO 268 CO 0.12 -2.50 0.14 -1.17 -0.33 0.00 0.00 177.00 173.26 1sa1 s LEU 269 N -6.51 4.28 0.18 -5.54 1.98 0.97 -4.35 118.68 109.69 1sa1 s LEU 269 Ca 0.66 0.33 0.05 0.00 -2.89 0.00 0.00 54.13 52.27 1sa1 s LEU 269 Cb -0.22 -2.09 -0.04 0.00 0.66 0.00 0.00 46.19 44.51 1sa1 s LEU 269 CO 0.58 0.27 0.18 0.00 -1.89 0.00 0.00 176.35 175.49 1sa1 s ALA 270 N -0.17 3.66 -0.35 5.97 0.00 -1.26 -1.81 121.76 127.80 1sa1 s ALA 270 Ca 0.11 -1.20 0.04 0.00 0.00 0.00 0.00 51.96 50.90 1sa1 s ALA 270 Cb -0.11 -1.45 0.19 0.00 0.00 0.00 0.00 23.12 21.74 1sa1 s ALA 270 CO 0.00 0.47 0.69 0.99 0.00 0.00 0.00 175.76 177.91 1sa1 s THR 271 N -1.80 -0.86 0.64 0.00 2.01 -0.94 -3.26 115.64 111.43 1sa1 s THR 271 Ca 0.32 0.00 -0.15 0.00 0.31 0.00 0.00 61.69 62.17 1sa1 s THR 271 Cb -0.10 -0.40 -0.01 0.00 0.01 0.00 0.00 72.50 72.00 1sa1 s THR 271 CO 0.25 0.00 1.11 -0.47 -0.69 0.00 0.00 174.62 174.81 1sa1 s TYR 272 N 2.33 2.67 0.00 4.92 5.04 -1.26 -3.99 117.35 127.06 1sa1 s TYR 272 Ca 0.15 1.54 0.00 0.00 -2.44 0.00 0.00 57.07 56.32 1sa1 s TYR 272 Cb -0.05 -3.16 0.00 0.00 0.35 0.00 0.00 41.96 39.10 1sa1 s TYR 272 CO -0.16 -1.61 0.00 0.00 -1.34 0.00 0.00 175.55 172.44 1sa1 n ALA 273 N -2.29 0.00 -3.21 3.97 0.00 -0.59 -4.78 120.51 113.61 1sa1 n ALA 273 Ca 0.10 0.00 -0.46 0.00 0.00 0.00 0.00 53.44 53.09 1sa1 n ALA 273 Cb 0.52 0.00 -0.04 0.00 0.00 0.00 0.00 19.45 19.93 1sa1 n ALA 273 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1sa1 s PRO 274 N 0.01 3.13 -0.17 0.00 0.05 -1.26 -4.90 135.00 131.86 1sa1 s PRO 274 Ca 0.00 -1.67 -0.19 0.00 0.05 0.00 0.00 61.00 59.19 1sa1 s PRO 274 Cb 0.00 -4.34 -0.03 0.00 0.05 0.00 0.00 34.50 30.18 1sa1 s PRO 274 CO 0.00 -1.43 0.54 0.14 0.05 0.00 0.00 177.00 176.30 1sa1 s VAL 275 N 1.88 5.11 -0.28 -0.36 -7.23 -1.26 -5.02 120.40 113.23 1sa1 s VAL 275 Ca 0.10 1.03 -0.17 0.00 -1.81 0.00 0.00 61.98 61.14 1sa1 s VAL 275 Cb -0.23 -3.87 0.08 0.00 0.56 0.00 0.00 36.38 32.92 1sa1 s VAL 275 CO 0.02 0.21 0.70 -0.51 -0.31 0.00 0.00 175.10 175.20 1sa1 s ILE 276 N 1.37 0.00 0.75 -0.62 1.10 -1.26 -4.91 121.20 117.62 1sa1 s ILE 276 Ca 0.26 0.00 -0.15 0.00 -0.51 0.00 0.00 60.65 60.25 1sa1 s ILE 276 Cb -0.16 -1.00 0.05 0.00 0.15 0.00 0.00 42.46 41.50 1sa1 s ILE 276 CO 0.10 0.00 1.22 -1.54 -2.11 0.00 0.00 174.94 172.62 1sa1 n SER 277 N 4.19 1.37 -3.53 4.50 3.41 -1.26 -2.43 113.62 119.88 1sa1 n SER 277 Ca -0.20 0.68 -0.30 0.00 -0.26 0.00 0.00 58.87 58.79 1sa1 n SER 277 Cb 0.59 -1.52 0.26 0.00 -0.26 0.00 0.00 64.21 63.27 1sa1 n SER 277 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1sa1 n ALA 278 N -2.77 -3.67 0.00 7.33 0.00 0.15 -2.89 120.51 118.66 1sa1 n ALA 278 Ca 0.14 -1.64 0.00 0.00 0.00 0.00 0.00 53.44 51.95 1sa1 n ALA 278 Cb 0.49 -0.12 0.00 0.00 0.00 0.00 0.00 19.45 19.83 1sa1 n ALA 278 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 1sa1 n GLU 279 N -4.99 0.00 -0.41 0.00 -0.00 -1.26 -4.51 120.64 109.47 1sa1 n GLU 279 Ca 0.15 0.00 0.11 0.00 -0.00 0.00 0.00 57.16 57.42 1sa1 n GLU 279 Cb 0.60 -0.11 0.32 0.00 -0.00 0.00 0.00 31.44 32.25 1sa1 n GLU 279 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 1sa1 n LYS 280 N 0.00 2.86 0.00 3.44 5.02 -1.14 -4.69 118.16 123.65 1sa1 n LYS 280 Ca 0.00 -2.62 0.12 0.00 -2.02 0.00 0.00 58.31 53.79 1sa1 n LYS 280 Cb 0.00 -1.62 0.66 0.00 -0.02 0.00 0.00 35.03 34.05 1sa1 n LYS 280 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1sa1 n ALA 281 N 1.51 2.30 0.63 7.82 0.00 -1.19 -3.27 120.51 128.32 1sa1 n ALA 281 Ca 0.24 -0.13 0.07 0.00 0.00 0.00 0.00 53.44 53.62 1sa1 n ALA 281 Cb 0.66 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.71 1sa1 n ALA 281 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1sa1 n TYR 282 N -1.18 0.00 0.83 0.00 4.01 -1.26 -4.34 117.16 115.23 1sa1 n TYR 282 Ca 0.14 0.00 0.13 0.00 -0.16 0.00 0.00 57.90 58.01 1sa1 n TYR 282 Cb 0.15 0.00 0.53 0.00 -0.31 0.00 0.00 39.34 39.71 1sa1 n TYR 282 CO 0.00 0.00 0.00 0.72 -0.46 0.00 0.00 176.86 177.12 1sa1 n HIS 283 N -0.09 0.18 -0.50 -0.72 8.25 -1.20 -4.95 115.22 116.19 1sa1 n HIS 283 Ca 0.06 0.06 -0.14 0.00 -0.26 0.00 0.00 57.72 57.44 1sa1 n HIS 283 Cb 0.30 -0.59 0.14 0.00 1.12 0.00 0.00 29.99 30.96 1sa1 n HIS 283 CO 0.00 0.00 0.00 -1.91 0.64 0.00 0.00 176.34 175.07 1sa1 n GLU 284 N -1.65 -1.22 -0.60 -0.41 0.00 -1.26 -4.91 120.64 110.59 1sa1 n GLU 284 Ca 0.06 -0.68 0.00 0.00 0.00 0.00 0.00 57.16 56.54 1sa1 n GLU 284 Cb 0.32 -1.41 0.00 0.00 0.00 0.00 0.00 31.44 30.35 1sa1 n GLU 284 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.13 178.17 1sa1 n GLN 285 N -1.13 0.00 -3.95 5.31 1.13 -1.26 -5.11 117.38 112.38 1sa1 n GLN 285 Ca 0.06 0.20 -0.35 0.00 -1.94 0.00 0.00 57.00 54.97 1sa1 n GLN 285 Cb 0.28 -0.55 -0.11 0.00 0.11 0.00 0.00 30.24 29.97 1sa1 n GLN 285 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 1sa1 s LEU 286 N -0.30 3.59 -0.19 1.08 1.02 -1.26 -5.03 118.68 117.59 1sa1 s LEU 286 Ca 0.00 -0.07 -0.39 0.00 0.02 0.00 0.00 54.13 53.69 1sa1 s LEU 286 Cb 0.00 -1.93 -0.15 0.00 0.02 0.00 0.00 46.19 44.13 1sa1 s LEU 286 CO 0.00 0.08 1.70 -1.20 0.02 0.00 0.00 176.35 176.95 1sa1 n SER 287 N 4.17 2.45 0.20 2.29 7.64 -1.26 -4.73 113.62 124.38 1sa1 n SER 287 Ca -0.16 1.07 0.08 0.00 1.01 0.00 0.00 58.87 60.87 1sa1 n SER 287 Cb 0.52 -1.19 0.45 0.00 -1.01 0.00 0.00 64.21 62.98 1sa1 n SER 287 CO 0.00 0.00 0.00 0.58 -3.01 0.00 0.00 175.04 172.61 1sa1 h VAL 288 N 4.96 0.00 0.16 0.44 2.07 -1.99 1.25 116.25 123.13 1sa1 h VAL 288 Ca -0.47 0.00 -0.32 0.00 0.82 0.00 0.00 66.70 66.73 1sa1 h VAL 288 Cb 1.31 0.36 0.00 0.00 -1.52 0.00 0.00 31.29 31.45 1sa1 h VAL 288 CO 0.93 0.00 -1.59 0.00 0.02 0.00 0.00 177.57 176.93 1sa1 h ALA 289 N 1.22 0.18 0.05 1.67 0.00 -1.94 -3.36 119.26 117.08 1sa1 h ALA 289 Ca 0.00 -1.09 -0.00 0.00 0.00 0.00 0.00 54.91 53.82 1sa1 h ALA 289 Cb 0.62 0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.73 1sa1 h ALA 289 CO 0.00 1.05 -0.03 0.93 0.00 0.00 0.00 179.25 181.20 1sa1 h GLU 290 N 0.09 -0.07 -1.15 0.00 4.39 0.12 0.65 114.58 118.62 1sa1 h GLU 290 Ca -0.28 0.00 0.33 0.00 0.34 0.00 0.00 59.36 59.76 1sa1 h GLU 290 Cb 2.06 0.02 -0.05 0.00 -0.10 0.00 0.00 28.75 30.67 1sa1 h GLU 290 CO 0.18 0.43 0.82 -0.84 -1.16 0.00 0.00 179.01 178.44 1sa1 h ILE 291 N -0.61 0.43 0.03 3.13 3.07 -1.59 1.40 117.51 123.36 1sa1 h ILE 291 Ca -0.01 -0.01 -0.04 0.00 1.55 0.00 0.00 64.86 66.35 1sa1 h ILE 291 Cb 0.53 0.38 0.00 0.00 -0.27 0.00 0.00 36.82 37.47 1sa1 h ILE 291 CO 0.01 0.01 -0.19 0.74 -1.05 0.00 0.00 178.15 177.67 1sa1 h THR 292 N 0.04 1.70 -0.90 0.16 2.02 -1.66 -2.92 112.91 111.34 1sa1 h THR 292 Ca 0.56 -2.29 -0.02 0.00 0.77 0.00 0.00 66.41 65.43 1sa1 h THR 292 Cb 2.15 3.24 -0.04 0.00 -1.74 0.00 0.00 68.15 71.76 1sa1 h THR 292 CO -0.04 0.61 0.49 0.78 0.37 0.00 0.00 175.52 177.73 1sa1 h ASN 293 N -0.80 1.12 0.84 4.18 2.35 0.19 -0.28 115.58 123.18 1sa1 h ASN 293 Ca -0.03 -0.10 0.00 0.00 -0.55 0.00 0.00 56.30 55.62 1sa1 h ASN 293 Cb 1.10 -0.29 0.00 0.00 0.05 0.00 0.00 38.32 39.19 1sa1 h ASN 293 CO 0.04 0.90 0.00 0.00 -1.65 0.00 0.00 177.43 176.72 1sa1 n ALA 294 N -2.41 1.91 0.01 -0.83 0.00 0.44 -2.57 120.51 117.06 1sa1 n ALA 294 Ca 0.10 -0.02 -0.07 0.00 0.00 0.00 0.00 53.44 53.45 1sa1 n ALA 294 Cb 0.10 -1.37 0.11 0.00 0.00 0.00 0.00 19.45 18.29 1sa1 n ALA 294 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1sa1 n PHE 296 N -4.02 2.48 -3.70 0.00 3.01 -1.06 -4.91 117.46 109.26 1sa1 n PHE 296 Ca -0.02 -2.60 -0.28 0.00 1.01 0.00 0.00 57.45 55.57 1sa1 n PHE 296 Cb 0.52 -1.34 -0.16 0.00 -0.01 0.00 0.00 39.48 38.49 1sa1 n PHE 296 CO 0.00 0.00 0.00 -2.00 1.01 0.00 0.00 176.76 175.77 1sa1 s GLU 297 N -2.90 0.53 0.32 -1.08 2.56 -1.23 -5.02 118.70 111.87 1sa1 s GLU 297 Ca 0.36 -0.41 0.10 0.00 0.00 0.00 0.00 54.97 55.02 1sa1 s GLU 297 Cb 0.11 -2.01 0.94 0.00 2.00 0.00 0.00 34.13 35.17 1sa1 s GLU 297 CO 0.01 -0.69 1.67 -1.00 -0.56 0.00 0.00 175.26 174.69 1sa1 h PRO 298 N 8.27 0.31 0.00 4.30 0.13 -1.90 0.68 132.00 143.79 1sa1 h PRO 298 Ca -0.16 -0.02 -0.09 0.00 -0.87 0.00 0.00 66.00 64.87 1sa1 h PRO 298 Cb 1.11 -0.07 -0.01 0.00 0.13 0.00 0.00 31.00 32.16 1sa1 h PRO 298 CO 0.34 0.20 -0.41 0.00 -0.23 0.00 0.00 178.00 177.90 1sa1 h ALA 299 N 1.81 0.99 -0.53 -0.56 0.00 -1.95 -3.25 119.26 115.78 1sa1 h ALA 299 Ca 0.67 -0.38 -0.09 0.00 0.00 0.00 0.00 54.91 55.11 1sa1 h ALA 299 Cb 1.44 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 19.11 1sa1 h ALA 299 CO -0.61 0.52 0.11 -1.71 0.00 0.00 0.00 179.25 177.56 1sa1 n ASN 300 N -3.57 4.51 -0.04 0.00 2.85 0.24 -4.82 115.26 114.43 1sa1 n ASN 300 Ca -0.00 -2.86 0.00 0.00 -0.11 0.00 0.00 54.58 51.61 1sa1 n ASN 300 Cb 0.53 -0.68 0.00 0.00 1.24 0.00 0.00 39.78 40.87 1sa1 n ASN 300 CO 0.00 0.00 0.00 0.00 -2.11 0.00 0.00 177.26 175.15 1sa1 n GLN 301 N 0.21 3.85 0.00 1.20 6.02 -1.19 -4.40 117.38 123.07 1sa1 n GLN 301 Ca 0.28 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 57.27 1sa1 n GLN 301 Cb 1.10 0.00 0.00 0.00 1.02 0.00 0.00 30.24 32.36 1sa1 n GLN 301 CO 0.00 0.00 0.00 -0.12 -1.01 0.00 0.00 177.06 175.93 1sa1 n MET 302 N 0.00 0.00 -4.07 -1.09 0.00 -1.20 -4.68 117.12 106.08 1sa1 n MET 302 Ca 0.00 0.00 -0.33 0.00 -0.00 0.00 0.00 57.70 57.37 1sa1 n MET 302 Cb 0.00 -0.11 -0.15 0.00 0.00 0.00 0.00 33.22 32.96 1sa1 n MET 302 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 175.97 176.05 1sa1 s VAL 303 N -1.00 2.32 -0.21 1.12 1.01 -1.26 -1.65 120.40 120.72 1sa1 s VAL 303 Ca 0.00 -1.08 -0.31 0.00 0.00 0.00 0.00 61.98 60.59 1sa1 s VAL 303 Cb 0.00 -2.11 -0.08 0.00 0.00 0.00 0.00 36.38 34.19 1sa1 s VAL 303 CO 0.00 0.34 2.14 1.17 0.00 0.00 0.00 175.10 178.76 1sa1 n LYS 304 N 4.60 1.83 -3.26 2.72 3.00 -1.26 -4.76 118.16 121.03 1sa1 n LYS 304 Ca -0.18 0.55 0.00 0.00 -0.00 0.00 0.00 58.31 58.68 1sa1 n LYS 304 Cb 0.48 -2.92 0.00 0.00 0.00 0.00 0.00 35.03 32.59 1sa1 n LYS 304 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1sa1 s ASP 306 N -4.00 -0.88 -0.06 0.00 3.84 -1.26 -4.88 116.67 109.42 1sa1 s ASP 306 Ca 0.00 1.44 0.07 0.00 -0.00 0.00 0.00 52.55 54.06 1sa1 s ASP 306 Cb 0.00 1.38 0.31 0.00 -1.38 0.00 0.00 42.92 43.23 1sa1 s ASP 306 CO 0.00 -0.23 1.09 -0.81 -0.00 0.00 0.00 175.17 175.22 1sa1 n PRO 307 N 4.04 2.25 -0.08 2.11 -0.05 -1.26 -2.91 135.00 139.10 1sa1 n PRO 307 Ca -0.19 -1.20 -0.13 0.00 -0.05 0.00 0.00 63.50 61.93 1sa1 n PRO 307 Cb 0.58 -1.60 -0.05 0.00 -0.05 0.00 0.00 33.50 32.39 1sa1 n PRO 307 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 175.50 175.45 1sa1 h ARG 308 N 1.67 0.51 -0.10 0.54 3.08 -1.96 -3.34 114.38 114.77 1sa1 h ARG 308 Ca 0.00 -0.24 -0.01 0.00 0.07 0.00 0.00 59.98 59.80 1sa1 h ARG 308 Cb 0.84 -0.01 -0.00 0.00 0.08 0.00 0.00 29.97 30.88 1sa1 h ARG 308 CO 0.13 0.80 0.02 1.12 -1.07 0.00 0.00 179.97 180.96 1sa1 h HIS 309 N 0.21 0.18 -2.58 3.04 2.07 -1.95 -3.46 115.15 112.66 1sa1 h HIS 309 Ca 0.05 -0.03 -0.46 0.00 -2.85 0.00 0.00 60.37 57.08 1sa1 h HIS 309 Cb 0.67 -0.05 0.02 0.00 2.57 0.00 0.00 27.41 30.62 1sa1 h HIS 309 CO 0.07 0.37 -0.16 0.20 -3.07 0.00 0.00 177.93 175.35 1sa1 s GLY 310 N -2.84 1.54 0.54 6.13 0.00 -1.25 -4.99 107.32 106.45 1sa1 s GLY 310 Ca -0.14 -1.11 -0.04 0.00 0.00 0.00 0.00 44.72 43.43 1sa1 s GLY 310 CO 0.70 -0.98 0.82 -1.59 0.00 0.00 0.00 173.10 172.05 1sa1 s LYS 311 N -4.45 2.96 -0.12 2.90 0.00 -1.26 -4.78 119.74 114.99 1sa1 s LYS 311 Ca 0.46 -0.19 -0.05 0.00 0.00 0.00 0.00 55.97 56.19 1sa1 s LYS 311 Cb -0.10 -2.37 -0.04 0.00 0.00 0.00 0.00 37.83 35.32 1sa1 s LYS 311 CO 0.36 -0.56 0.07 0.71 0.00 0.00 0.00 175.35 175.93 1sa1 s TYR 312 N -2.84 3.34 -0.02 1.78 1.51 0.41 -1.94 117.35 119.61 1sa1 s TYR 312 Ca 0.52 0.29 0.02 0.00 -1.01 0.00 0.00 57.07 56.89 1sa1 s TYR 312 Cb -0.10 -1.91 0.03 0.00 -0.11 0.00 0.00 41.96 39.87 1sa1 s TYR 312 CO 0.42 0.49 0.91 0.00 -1.11 0.00 0.00 175.55 176.27 1sa1 n MET 313 N 2.42 2.07 0.00 -0.62 0.00 -0.26 0.62 117.12 121.34 1sa1 n MET 313 Ca -0.19 -1.40 0.00 0.00 0.00 0.00 0.00 57.70 56.11 1sa1 n MET 313 Cb 0.54 -0.94 0.00 0.00 0.00 0.00 0.00 33.22 32.82 1sa1 n MET 313 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1sa1 n ALA 314 N -0.49 0.00 -2.83 3.17 0.00 -1.11 -4.90 120.51 114.36 1sa1 n ALA 314 Ca 0.02 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.32 1sa1 n ALA 314 Cb 0.36 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.69 1sa1 n ALA 314 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1sa1 s LEU 317 N 2.89 3.14 -0.62 0.00 1.43 -0.70 0.01 118.68 124.83 1sa1 s LEU 317 Ca -0.02 -0.32 -0.07 0.00 -1.03 0.00 0.00 54.13 52.70 1sa1 s LEU 317 Cb -0.12 -1.82 0.16 0.00 0.03 0.00 0.00 46.19 44.44 1sa1 s LEU 317 CO -0.19 -0.03 0.47 -0.76 0.23 0.00 0.00 176.35 176.07 1sa1 s LEU 318 N 1.54 5.66 0.89 1.79 1.02 -1.26 -0.22 118.68 128.10 1sa1 s LEU 318 Ca 0.06 -2.55 -0.12 0.00 0.02 0.00 0.00 54.13 51.54 1sa1 s LEU 318 Cb -0.15 -1.96 0.13 0.00 0.02 0.00 0.00 46.19 44.23 1sa1 s LEU 318 CO -0.00 -0.50 1.12 -0.31 0.02 0.00 0.00 176.35 176.68 1sa1 s TYR 319 N 0.39 2.54 -0.29 0.29 1.51 -0.85 -2.23 117.35 118.71 1sa1 s TYR 319 Ca 0.14 0.97 0.00 0.00 -1.01 0.00 0.00 57.07 57.17 1sa1 s TYR 319 Cb -0.20 -3.29 0.19 0.00 -0.11 0.00 0.00 41.96 38.56 1sa1 s TYR 319 CO -0.04 -2.27 0.71 1.03 -1.11 0.00 0.00 175.55 173.87 1sa1 s ARG 320 N -5.19 0.45 0.00 -0.62 0.52 -0.10 -3.13 118.95 110.87 1sa1 s ARG 320 Ca 0.63 0.52 0.00 0.00 -0.52 0.00 0.00 55.73 56.36 1sa1 s ARG 320 Cb -0.15 0.25 0.00 0.00 0.52 0.00 0.00 34.95 35.57 1sa1 s ARG 320 CO 0.54 -0.77 0.00 0.41 0.02 0.00 0.00 175.30 175.50 1sa1 n GLY 321 N 5.36 -0.11 3.55 -3.53 0.00 -1.24 -1.90 105.19 107.32 1sa1 n GLY 321 Ca 0.04 -1.61 -0.36 0.00 0.00 0.00 0.00 46.02 44.10 1sa1 n GLY 321 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1sa1 s ASP 322 N -3.78 5.01 -0.25 1.61 -1.08 -1.11 -4.08 116.67 113.00 1sa1 s ASP 322 Ca 0.00 0.37 -0.04 0.00 -0.52 0.00 0.00 52.55 52.37 1sa1 s ASP 322 Cb 0.00 -2.53 0.13 0.00 -1.46 0.00 0.00 42.92 39.07 1sa1 s ASP 322 CO 0.00 -2.60 0.44 -0.69 0.52 0.00 0.00 175.17 172.84 1sa1 s VAL 323 N 10.15 -0.71 -0.05 1.11 1.01 -1.26 -4.93 120.40 125.71 1sa1 s VAL 323 Ca 0.75 -0.00 -0.20 0.00 0.00 0.00 0.00 61.98 62.53 1sa1 s VAL 323 Cb -0.13 -0.83 -0.05 0.00 0.00 0.00 0.00 36.38 35.38 1sa1 s VAL 323 CO 0.19 -0.05 0.56 -0.69 0.00 0.00 0.00 175.10 175.11 1sa1 s VAL 324 N 2.64 5.03 0.35 2.92 1.01 -1.26 -4.93 120.40 126.15 1sa1 s VAL 324 Ca 0.10 1.15 0.12 0.00 0.00 0.00 0.00 61.98 63.36 1sa1 s VAL 324 Cb -0.14 -3.90 0.34 0.00 0.00 0.00 0.00 36.38 32.68 1sa1 s VAL 324 CO -0.16 0.38 1.77 1.55 0.00 0.00 0.00 175.10 178.63 1sa1 h PRO 325 N 6.08 0.53 -1.27 2.72 0.13 -2.00 -2.68 132.00 135.52 1sa1 h PRO 325 Ca -0.44 -0.03 0.42 0.00 -0.87 0.00 0.00 66.00 65.08 1sa1 h PRO 325 Cb 1.19 -0.12 -0.11 0.00 0.13 0.00 0.00 31.00 32.09 1sa1 h PRO 325 CO 0.72 0.35 0.84 1.63 -0.23 0.00 0.00 178.00 181.31 1sa1 n LYS 326 N -4.73 -0.03 0.03 0.86 4.01 -1.26 0.02 118.16 117.06 1sa1 n LYS 326 Ca 0.25 1.04 -0.02 0.00 -0.51 0.00 0.00 58.31 59.08 1sa1 n LYS 326 Cb 0.74 -2.12 -0.01 0.00 -0.51 0.00 0.00 35.03 33.14 1sa1 n LYS 326 CO 0.00 0.00 0.00 -0.44 -1.11 0.00 0.00 177.40 175.85 1sa1 h ASP 327 N 0.00 -0.09 -0.78 4.39 3.32 -1.90 -3.02 116.42 118.34 1sa1 h ASP 327 Ca 0.76 0.00 0.21 0.00 0.02 0.00 0.00 57.03 58.03 1sa1 h ASP 327 Cb 2.57 0.02 -0.15 0.00 0.22 0.00 0.00 39.33 42.00 1sa1 h ASP 327 CO -0.33 0.03 0.01 0.52 -1.72 0.00 0.00 179.24 177.75 1sa1 n VAL 328 N -2.79 -0.33 0.36 -1.35 0.31 0.10 0.35 118.33 114.98 1sa1 n VAL 328 Ca -0.01 1.71 -0.18 0.00 -0.01 0.00 0.00 64.34 65.85 1sa1 n VAL 328 Cb 0.04 -2.50 -0.09 0.00 -0.91 0.00 0.00 33.84 30.38 1sa1 n VAL 328 CO 0.00 0.00 0.00 0.78 -1.32 0.00 0.00 176.83 176.29 1sa1 h ASN 329 N 0.00 -0.74 -0.47 4.52 -0.26 -1.30 0.48 115.58 117.81 1sa1 h ASN 329 Ca 0.47 0.02 0.14 0.00 -0.56 0.00 0.00 56.30 56.36 1sa1 h ASN 329 Cb 0.96 0.19 -0.02 0.00 -1.06 0.00 0.00 38.32 38.40 1sa1 h ASN 329 CO -0.73 -0.52 0.38 0.00 -1.06 0.00 0.00 177.43 175.50 1sa1 h ALA 330 N -0.55 2.33 0.00 -0.83 0.00 0.03 -0.42 119.26 119.82 1sa1 h ALA 330 Ca -0.09 -0.02 -0.08 0.00 0.00 0.00 0.00 54.91 54.73 1sa1 h ALA 330 Cb 0.68 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 1sa1 h ALA 330 CO 0.15 -0.62 -0.71 0.00 0.00 0.00 0.00 179.25 178.07 1sa1 h ALA 331 N 1.68 0.70 0.12 0.00 0.00 0.54 -2.87 119.26 119.44 1sa1 h ALA 331 Ca 0.22 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 1sa1 h ALA 331 Cb 0.98 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.81 1sa1 h ALA 331 CO -0.00 0.44 -0.06 0.82 0.00 0.00 0.00 179.25 180.45 1sa1 h ILE 332 N 0.00 1.06 -0.54 0.00 2.04 0.13 -2.65 117.51 117.55 1sa1 h ILE 332 Ca -0.04 -1.05 0.09 0.00 1.00 0.00 0.00 64.86 64.86 1sa1 h ILE 332 Cb 1.27 1.68 -0.10 0.00 -0.74 0.00 0.00 36.82 38.93 1sa1 h ILE 332 CO 0.03 0.24 -0.39 0.00 0.00 0.00 0.00 178.15 178.03 1sa1 h ALA 333 N 0.06 -0.23 0.00 1.87 0.00 -1.15 0.49 119.26 120.30 1sa1 h ALA 333 Ca -0.02 0.12 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 1sa1 h ALA 333 Cb 0.52 0.86 -0.00 0.00 0.00 0.00 0.00 17.79 19.17 1sa1 h ALA 333 CO 0.03 -0.77 -0.08 1.79 0.00 0.00 0.00 179.25 180.22 1sa1 h THR 334 N -0.22 0.22 -0.13 0.00 1.35 -1.62 -0.80 112.91 111.71 1sa1 h THR 334 Ca 0.19 -0.69 -0.10 0.00 -0.55 0.00 0.00 66.41 65.26 1sa1 h THR 334 Cb 0.56 1.56 -0.01 0.00 -1.73 0.00 0.00 68.15 68.53 1sa1 h THR 334 CO -0.65 0.08 -0.36 0.40 -0.25 0.00 0.00 175.52 174.74 1sa1 h ILE 335 N 0.00 1.29 -0.60 6.82 2.04 0.28 -3.26 117.51 124.08 1sa1 h ILE 335 Ca -0.00 -1.41 -0.04 0.00 1.00 0.00 0.00 64.86 64.41 1sa1 h ILE 335 Cb 0.55 1.59 -0.03 0.00 -0.74 0.00 0.00 36.82 38.20 1sa1 h ILE 335 CO 0.01 0.43 0.21 0.11 0.00 0.00 0.00 178.15 178.91 1sa1 h LYS 336 N 0.23 0.91 0.00 2.37 1.79 0.44 -3.33 116.57 118.98 1sa1 h LYS 336 Ca 0.03 -0.18 -0.26 0.00 -2.18 0.00 0.00 60.65 58.05 1sa1 h LYS 336 Cb 0.75 -0.14 -0.05 0.00 -1.58 0.00 0.00 32.23 31.22 1sa1 h LYS 336 CO 0.06 0.80 -1.64 2.41 -1.08 0.00 0.00 179.45 179.99 1sa1 n THR 337 N -4.43 1.50 -1.95 -0.16 -1.04 -1.21 -3.77 114.28 103.21 1sa1 n THR 337 Ca 0.03 -0.77 -0.37 0.00 -2.04 0.00 0.00 64.05 60.91 1sa1 n THR 337 Cb 0.19 -0.96 0.01 0.00 -1.82 0.00 0.00 70.33 67.75 1sa1 n THR 337 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 1sa1 n LYS 338 N -3.00 3.36 -3.70 -2.82 4.01 -1.23 -4.94 118.16 109.84 1sa1 n LYS 338 Ca -0.15 -3.43 -0.11 0.00 -0.51 0.00 0.00 58.31 54.11 1sa1 n LYS 338 Cb 1.00 -2.31 -0.12 0.00 -0.51 0.00 0.00 35.03 33.09 1sa1 n LYS 338 CO 0.00 0.00 0.00 -0.98 -1.11 0.00 0.00 177.40 175.31 1sa1 s ARG 339 N -3.22 0.27 -0.90 1.97 1.70 -1.25 -4.97 118.95 112.56 1sa1 s ARG 339 Ca 0.52 0.73 -0.24 0.00 -0.47 0.00 0.00 55.73 56.27 1sa1 s ARG 339 Cb 0.35 -0.01 -0.16 0.00 -0.57 0.00 0.00 34.95 34.56 1sa1 s ARG 339 CO -0.28 -0.20 1.91 2.41 -1.08 0.00 0.00 175.30 178.06 1sa1 n THR 340 N 4.61 1.53 0.02 4.99 -1.04 -1.26 -4.79 114.28 118.33 1sa1 n THR 340 Ca -0.19 -1.48 -0.18 0.00 -2.04 0.00 0.00 64.05 60.16 1sa1 n THR 340 Cb 0.53 -2.20 -0.11 0.00 -1.82 0.00 0.00 70.33 66.73 1sa1 n THR 340 CO 0.00 0.00 0.00 0.16 -0.64 0.00 0.00 175.07 174.59 1sa1 h ILE 341 N 5.44 1.41 -4.97 12.58 3.07 -1.92 -3.46 117.51 129.65 1sa1 h ILE 341 Ca 0.28 -2.15 -0.21 0.00 1.55 0.00 0.00 64.86 64.33 1sa1 h ILE 341 Cb 0.82 2.61 0.16 0.00 -0.27 0.00 0.00 36.82 40.14 1sa1 h ILE 341 CO 1.57 0.63 -0.69 0.00 -1.05 0.00 0.00 178.15 178.62 1sa1 n GLN 342 N -4.14 -2.10 -3.27 0.16 0.00 -1.26 -4.72 117.38 102.05 1sa1 n GLN 342 Ca -0.11 0.70 -0.40 0.00 0.00 0.00 0.00 57.00 57.19 1sa1 n GLN 342 Cb 0.73 -5.02 -0.08 0.00 0.00 0.00 0.00 30.24 25.87 1sa1 n GLN 342 CO 0.00 0.00 0.00 0.12 0.00 0.00 0.00 177.06 177.18 1sa1 s PHE 343 N -3.31 3.22 -0.17 2.61 5.36 -1.26 0.16 117.98 124.58 1sa1 s PHE 343 Ca 0.34 0.35 -0.29 0.00 -0.96 0.00 0.00 56.93 56.37 1sa1 s PHE 343 Cb -0.04 -2.80 -0.04 0.00 -0.34 0.00 0.00 43.02 39.80 1sa1 s PHE 343 CO 0.60 -0.41 1.66 0.54 -1.46 0.00 0.00 175.22 176.15 1sa1 s VAL 344 N 2.31 3.63 0.00 3.12 0.11 0.20 -4.83 120.40 124.94 1sa1 s VAL 344 Ca 0.19 0.72 0.00 0.00 -2.93 0.00 0.00 61.98 59.96 1sa1 s VAL 344 Cb -0.16 -3.60 0.00 0.00 -1.53 0.00 0.00 36.38 31.09 1sa1 s VAL 344 CO 0.11 -0.21 0.00 -0.67 -3.33 0.00 0.00 175.10 171.00 1sa1 n ASP 345 N 8.23 0.00 -0.40 3.54 -0.08 -1.26 -2.90 116.55 123.68 1sa1 n ASP 345 Ca 0.19 0.00 0.07 0.00 -1.51 0.00 0.00 54.79 53.54 1sa1 n ASP 345 Cb 0.44 0.00 0.14 0.00 2.34 0.00 0.00 41.12 44.05 1sa1 n ASP 345 CO 0.00 0.00 0.00 -2.67 0.12 0.00 0.00 177.20 174.65 1sa1 n TRP 346 N 0.00 0.00 -3.35 -0.67 4.27 -1.26 -4.86 117.44 111.57 1sa1 n TRP 346 Ca 0.00 -1.03 -0.25 0.00 -3.89 0.00 0.00 57.50 52.33 1sa1 n TRP 346 Cb 0.00 -0.17 -0.09 0.00 -1.36 0.00 0.00 31.31 29.68 1sa1 n TRP 346 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1sa1 n PRO 348 N 3.13 -0.28 -1.90 0.00 -0.02 -1.26 -4.37 135.00 130.30 1sa1 n PRO 348 Ca 0.25 -0.07 -0.35 0.00 -2.02 0.00 0.00 63.50 61.31 1sa1 n PRO 348 Cb 0.47 -1.38 -0.03 0.00 -0.02 0.00 0.00 33.50 32.53 1sa1 n PRO 348 CO 0.00 0.00 0.00 0.95 1.98 0.00 0.00 175.50 178.43 1sa1 s THR 349 N -2.16 3.26 0.34 3.45 -4.23 -1.26 -4.96 115.64 110.08 1sa1 s THR 349 Ca 0.47 0.07 -0.25 0.00 -1.18 0.00 0.00 61.69 60.80 1sa1 s THR 349 Cb -0.15 -3.68 -0.14 0.00 1.34 0.00 0.00 72.50 69.87 1sa1 s THR 349 CO 0.74 -0.65 0.63 0.61 -0.54 0.00 0.00 174.62 175.41 1sa1 n GLY 350 N 5.97 -1.30 0.00 3.99 0.00 -1.26 -4.89 105.19 107.69 1sa1 n GLY 350 Ca 0.28 0.18 0.00 0.00 0.00 0.00 0.00 46.02 46.48 1sa1 n GLY 350 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1sa1 n PHE 351 N -0.40 0.00 -1.77 1.61 0.99 -1.17 -4.52 117.46 112.20 1sa1 n PHE 351 Ca 0.12 0.00 -0.42 0.00 -0.00 0.00 0.00 57.45 57.15 1sa1 n PHE 351 Cb 0.34 0.00 -0.03 0.00 -1.00 0.00 0.00 39.48 38.79 1sa1 n PHE 351 CO 0.00 0.00 0.00 -1.59 -0.00 0.00 0.00 176.76 175.17 1sa1 s LYS 352 N 0.00 4.04 -0.21 -1.08 0.00 -1.23 -4.90 119.74 116.37 1sa1 s LYS 352 Ca 0.00 2.41 -0.04 0.00 0.00 0.00 0.00 55.97 58.33 1sa1 s LYS 352 Cb 0.00 -4.13 -0.02 0.00 0.00 0.00 0.00 37.83 33.68 1sa1 s LYS 352 CO 0.00 -1.05 -0.03 0.08 0.00 0.00 0.00 175.35 174.36 1sa1 s VAL 353 N 4.74 3.64 -0.66 1.79 1.01 -1.26 -1.72 120.40 127.93 1sa1 s VAL 353 Ca 0.85 -0.41 0.05 0.00 0.00 0.00 0.00 61.98 62.47 1sa1 s VAL 353 Cb -0.39 -2.65 0.18 0.00 0.00 0.00 0.00 36.38 33.53 1sa1 s VAL 353 CO 0.37 0.43 0.53 0.61 0.00 0.00 0.00 175.10 177.04 1sa1 n GLY 354 N 4.48 3.96 3.75 4.51 0.00 0.69 -5.00 105.19 117.58 1sa1 n GLY 354 Ca -0.18 -2.48 -0.41 0.00 0.00 0.00 0.00 46.02 42.95 1sa1 n GLY 354 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1sa1 s ILE 355 N -1.50 2.76 -0.06 -0.61 -5.25 -1.26 -2.00 121.20 113.28 1sa1 s ILE 355 Ca 0.28 0.69 0.08 0.00 -0.99 0.00 0.00 60.65 60.71 1sa1 s ILE 355 Cb 0.00 -3.44 0.13 0.00 2.95 0.00 0.00 42.46 42.10 1sa1 s ILE 355 CO -0.15 0.13 1.01 -3.20 -1.79 0.00 0.00 174.94 170.95 1sa1 n ASN 356 N 1.74 1.27 0.00 4.36 5.15 -1.18 -4.95 115.26 121.64 1sa1 n ASN 356 Ca 0.04 -2.37 0.00 0.00 -0.60 0.00 0.00 54.58 51.65 1sa1 n ASN 356 Cb 0.41 -0.25 0.00 0.00 -0.53 0.00 0.00 39.78 39.41 1sa1 n ASN 356 CO 0.00 0.00 0.00 -1.22 1.40 0.00 0.00 177.26 177.44 1sa1 n TYR 357 N -0.68 0.00 -1.78 1.20 0.53 -1.26 -4.74 117.16 110.42 1sa1 n TYR 357 Ca 0.07 0.00 -0.43 0.00 -1.02 0.00 0.00 57.90 56.52 1sa1 n TYR 357 Cb 0.60 0.00 -0.03 0.00 -1.03 0.00 0.00 39.34 38.88 1sa1 n TYR 357 CO 0.00 0.00 0.00 -2.00 -1.02 0.00 0.00 176.86 173.84 1sa1 s GLU 358 N 0.00 3.72 0.56 -0.72 2.56 -1.26 -3.95 118.70 119.62 1sa1 s GLU 358 Ca 0.00 2.15 -0.19 0.00 0.00 0.00 0.00 54.97 56.93 1sa1 s GLU 358 Cb 0.00 -4.19 -0.05 0.00 2.00 0.00 0.00 34.13 31.89 1sa1 s GLU 358 CO 0.00 -1.41 1.17 -2.14 -0.56 0.00 0.00 175.26 172.32 1sa1 s PRO 359 N 5.11 3.20 -1.17 4.30 0.02 -1.26 -3.71 135.00 141.48 1sa1 s PRO 359 Ca 0.87 1.74 -0.09 0.00 0.02 0.00 0.00 61.00 63.54 1sa1 s PRO 359 Cb -0.34 -2.00 0.23 0.00 0.02 0.00 0.00 34.50 32.41 1sa1 s PRO 359 CO 0.36 -1.01 1.45 -0.35 -0.33 0.00 0.00 177.00 177.12 1sa1 n PRO 360 N -1.38 3.72 -1.65 5.54 -0.04 -1.26 -4.98 135.00 134.95 1sa1 n PRO 360 Ca 0.12 -4.12 -0.47 0.00 -0.04 0.00 0.00 63.50 58.99 1sa1 n PRO 360 Cb 0.50 -2.76 -0.05 0.00 -0.04 0.00 0.00 33.50 31.16 1sa1 n PRO 360 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 1sa1 n THR 361 N 3.04 0.01 -4.18 0.52 -1.04 -1.26 -4.69 114.28 106.68 1sa1 n THR 361 Ca 0.31 -0.00 -0.24 0.00 -2.04 0.00 0.00 64.05 62.08 1sa1 n THR 361 Cb 0.38 -1.40 -0.06 0.00 -1.82 0.00 0.00 70.33 67.43 1sa1 n THR 361 CO 0.00 0.00 0.00 0.68 -0.64 0.00 0.00 175.07 175.11 1sa1 s VAL 362 N 0.86 3.98 0.27 12.58 -7.23 -1.26 -4.84 120.40 124.76 1sa1 s VAL 362 Ca 0.80 -1.48 -0.31 0.00 -1.81 0.00 0.00 61.98 59.18 1sa1 s VAL 362 Cb -0.73 -3.08 -0.12 0.00 0.56 0.00 0.00 36.38 33.01 1sa1 s VAL 362 CO 0.40 -0.24 1.55 0.52 -0.31 0.00 0.00 175.10 177.02 1sa1 n VAL 363 N -0.64 0.90 -0.11 1.32 0.31 -1.26 -4.94 118.33 113.91 1sa1 n VAL 363 Ca -0.08 -0.22 -0.12 0.00 -0.01 0.00 0.00 64.34 63.91 1sa1 n VAL 363 Cb 0.57 -1.81 -0.03 0.00 -0.91 0.00 0.00 33.84 31.65 1sa1 n VAL 363 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 1sa1 h PRO 364 N 4.80 0.62 0.83 5.55 0.11 -1.98 -2.66 132.00 139.27 1sa1 h PRO 364 Ca -0.46 -0.24 -0.04 0.00 0.11 0.00 0.00 66.00 65.37 1sa1 h PRO 364 Cb 1.24 -0.03 0.01 0.00 0.11 0.00 0.00 31.00 32.32 1sa1 h PRO 364 CO 0.80 0.80 -0.40 0.78 -0.21 0.00 0.00 178.00 179.77 1sa1 h GLY 365 N 0.39 -1.17 0.00 -0.55 0.00 -1.97 -3.47 103.07 96.30 1sa1 h GLY 365 Ca 0.08 0.43 0.00 0.00 0.00 0.00 0.00 47.33 47.84 1sa1 h GLY 365 CO 0.03 -0.42 0.00 0.61 0.00 0.00 0.00 176.54 176.76 1sa1 n GLY 366 N -1.22 0.02 0.55 4.60 0.00 -1.00 -4.93 105.19 103.20 1sa1 n GLY 366 Ca -0.14 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.14 1sa1 n GLY 366 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1sa1 n ASP 367 N -3.35 0.00 -4.92 1.61 8.00 -1.26 -5.02 116.55 111.62 1sa1 n ASP 367 Ca 0.00 0.00 -0.27 0.00 0.71 0.00 0.00 54.79 55.23 1sa1 n ASP 367 Cb 0.00 0.02 0.03 0.00 -0.02 0.00 0.00 41.12 41.15 1sa1 n ASP 367 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1sa1 s LEU 368 N -3.55 3.24 0.00 0.64 1.02 -1.26 0.30 118.68 119.07 1sa1 s LEU 368 Ca 0.00 0.70 0.00 0.00 0.02 0.00 0.00 54.13 54.85 1sa1 s LEU 368 Cb 0.00 -3.53 0.00 0.00 0.02 0.00 0.00 46.19 42.68 1sa1 s LEU 368 CO 0.00 -1.05 0.00 0.00 0.02 0.00 0.00 176.35 175.32 1sa1 n ALA 369 N -2.57 0.00 -1.35 4.21 0.00 -1.02 -4.49 120.51 115.29 1sa1 n ALA 369 Ca 0.04 0.00 -0.52 0.00 0.00 0.00 0.00 53.44 52.96 1sa1 n ALA 369 Cb 0.58 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.90 1sa1 n ALA 369 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1sa1 n LYS 370 N 0.00 0.07 -3.93 0.00 4.81 -1.26 -4.80 118.16 113.05 1sa1 n LYS 370 Ca 0.00 0.02 -0.35 0.00 -0.87 0.00 0.00 58.31 57.10 1sa1 n LYS 370 Cb 0.00 -1.58 -0.13 0.00 0.02 0.00 0.00 35.03 33.33 1sa1 n LYS 370 CO 0.00 0.00 0.00 0.14 1.17 0.00 0.00 177.40 178.71 1sa1 s VAL 371 N 7.23 3.65 -0.71 3.15 -7.23 -1.26 -4.99 120.40 120.24 1sa1 s VAL 371 Ca 1.25 -0.40 0.26 0.00 -1.81 0.00 0.00 61.98 61.27 1sa1 s VAL 371 Cb -1.36 -2.67 0.23 0.00 0.56 0.00 0.00 36.38 33.14 1sa1 s VAL 371 CO 0.58 0.41 1.66 0.00 -0.31 0.00 0.00 175.10 177.45 1sa1 n GLN 372 N 4.69 0.27 -3.64 4.82 1.13 -1.26 -4.08 117.38 119.30 1sa1 n GLN 372 Ca -0.18 0.18 -0.07 0.00 -1.94 0.00 0.00 57.00 55.00 1sa1 n GLN 372 Cb 0.51 -1.77 -0.07 0.00 0.11 0.00 0.00 30.24 29.02 1sa1 n GLN 372 CO 0.00 0.00 0.00 -0.98 -1.44 0.00 0.00 177.06 174.64 1sa1 s ARG 373 N -3.12 0.69 0.05 -1.09 1.70 -1.26 -2.73 118.95 113.19 1sa1 s ARG 373 Ca 0.10 1.23 0.00 0.00 -0.47 0.00 0.00 55.73 56.59 1sa1 s ARG 373 Cb 0.13 0.19 -0.03 0.00 -0.57 0.00 0.00 34.95 34.66 1sa1 s ARG 373 CO 0.63 -0.15 -0.04 0.00 -1.08 0.00 0.00 175.30 174.65 1sa1 s ALA 374 N 1.72 0.48 0.39 7.88 0.00 -0.80 -4.71 121.76 126.73 1sa1 s ALA 374 Ca -0.10 -1.02 0.04 0.00 0.00 0.00 0.00 51.96 50.88 1sa1 s ALA 374 Cb -0.06 0.20 -0.03 0.00 0.00 0.00 0.00 23.12 23.23 1sa1 s ALA 374 CO -0.20 -0.26 0.11 0.08 0.00 0.00 0.00 175.76 175.49 1sa1 s VAL 375 N -2.95 0.74 0.00 0.00 1.01 -1.26 -0.93 120.40 117.01 1sa1 s VAL 375 Ca -0.00 -2.00 0.00 0.00 0.00 0.00 0.00 61.98 59.98 1sa1 s VAL 375 Cb 0.01 -2.44 0.00 0.00 0.00 0.00 0.00 36.38 33.95 1sa1 s VAL 375 CO -0.06 0.00 0.00 0.00 0.00 0.00 0.00 175.10 175.04 1sa1 n MET 377 N -1.63 -2.12 -3.81 0.00 0.00 -1.18 -2.22 117.12 106.17 1sa1 n MET 377 Ca 0.00 1.90 -0.36 0.00 0.00 0.00 0.00 57.70 59.24 1sa1 n MET 377 Cb 0.00 -3.04 -0.13 0.00 0.00 0.00 0.00 33.22 30.05 1sa1 n MET 377 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 175.97 175.46 1sa1 s LEU 378 N -1.04 3.31 -0.05 -0.89 1.43 0.10 -3.26 118.68 118.28 1sa1 s LEU 378 Ca -0.04 -0.34 0.02 0.00 -1.03 0.00 0.00 54.13 52.74 1sa1 s LEU 378 Cb 0.00 -1.85 0.02 0.00 0.03 0.00 0.00 46.19 44.39 1sa1 s LEU 378 CO 0.38 -0.05 -0.07 -0.94 0.23 0.00 0.00 176.35 175.90 1sa1 s SER 379 N 1.55 1.18 -0.34 2.29 1.04 -0.75 -1.89 113.70 116.79 1sa1 s SER 379 Ca 0.06 -0.18 -0.18 0.00 0.48 0.00 0.00 55.95 56.12 1sa1 s SER 379 Cb -0.15 -0.54 -0.00 0.00 0.10 0.00 0.00 66.02 65.42 1sa1 s SER 379 CO 0.01 -0.02 0.53 0.21 0.98 0.00 0.00 173.24 174.96 1sa1 s ASN 380 N 0.75 6.34 0.09 7.02 3.04 0.54 -0.02 114.94 132.70 1sa1 s ASN 380 Ca -0.12 0.04 0.07 0.00 0.04 0.00 0.00 52.86 52.89 1sa1 s ASN 380 Cb -0.14 -2.28 -0.03 0.00 -1.54 0.00 0.00 41.25 37.26 1sa1 s ASN 380 CO 0.01 -0.49 -0.18 0.28 -3.04 0.00 0.00 177.10 173.69 1sa1 s THR 381 N 2.44 1.48 0.42 -5.21 -1.32 -1.26 -1.11 115.64 111.07 1sa1 s THR 381 Ca 0.20 -1.42 0.11 0.00 -1.21 0.00 0.00 61.69 59.36 1sa1 s THR 381 Cb -0.15 -1.36 0.31 0.00 -1.51 0.00 0.00 72.50 69.79 1sa1 s THR 381 CO 0.13 -0.10 1.99 0.71 -2.21 0.00 0.00 174.62 175.14 1sa1 h THR 382 N 4.18 0.96 0.00 5.08 1.35 -1.72 -2.60 112.91 120.15 1sa1 h THR 382 Ca -0.44 -0.17 -0.00 0.00 -0.55 0.00 0.00 66.41 65.25 1sa1 h THR 382 Cb 1.18 0.41 -0.00 0.00 -1.73 0.00 0.00 68.15 68.02 1sa1 h THR 382 CO 0.40 0.09 -0.02 0.00 -0.25 0.00 0.00 175.52 175.74 1sa1 h ALA 383 N 1.69 1.51 0.00 6.62 0.00 -1.87 -0.86 119.26 126.35 1sa1 h ALA 383 Ca 0.26 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1sa1 h ALA 383 Cb 0.38 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1sa1 h ALA 383 CO -0.08 0.02 0.18 1.51 0.00 0.00 0.00 179.25 180.89 1sa1 n ILE 384 N -3.84 0.91 0.21 0.00 0.00 -0.98 -1.26 119.36 114.40 1sa1 n ILE 384 Ca -0.03 0.69 -0.15 0.00 0.00 0.00 0.00 62.75 63.26 1sa1 n ILE 384 Cb 0.11 -1.69 -0.08 0.00 0.00 0.00 0.00 39.64 37.97 1sa1 n ILE 384 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1sa1 h ALA 385 N 1.48 -0.50 -0.15 1.51 0.00 -1.38 -3.21 119.26 117.01 1sa1 h ALA 385 Ca 0.00 -0.14 0.05 0.00 0.00 0.00 0.00 54.91 54.82 1sa1 h ALA 385 Cb 0.36 0.19 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 1sa1 h ALA 385 CO 0.00 -0.73 0.03 0.39 0.00 0.00 0.00 179.25 178.94 1sa1 n GLU 386 N -5.26 -0.01 0.03 0.00 1.02 -0.39 0.34 120.64 116.38 1sa1 n GLU 386 Ca -0.11 0.21 -0.11 0.00 -0.02 0.00 0.00 57.16 57.14 1sa1 n GLU 386 Cb 0.24 -0.36 0.02 0.00 -0.02 0.00 0.00 31.44 31.33 1sa1 n GLU 386 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1sa1 h ALA 387 N 0.29 0.58 -0.42 0.62 0.00 -1.75 -2.73 119.26 115.85 1sa1 h ALA 387 Ca 0.10 -0.59 -0.00 0.00 0.00 0.00 0.00 54.91 54.42 1sa1 h ALA 387 Cb 0.24 -0.06 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 1sa1 h ALA 387 CO -0.13 0.74 0.25 -1.49 0.00 0.00 0.00 179.25 178.62 1sa1 h TRP 388 N 0.33 0.54 0.44 0.00 -0.00 0.56 -2.56 115.95 115.27 1sa1 h TRP 388 Ca -0.03 0.01 -0.02 0.00 -0.00 0.00 0.00 58.89 58.85 1sa1 h TRP 388 Cb 1.28 -0.18 0.00 0.00 -0.00 0.00 0.00 29.16 30.27 1sa1 h TRP 388 CO 0.05 0.36 -0.21 0.00 -0.00 0.00 0.00 178.44 178.64 1sa1 h ALA 389 N 1.71 -0.59 -0.77 1.49 0.00 -1.26 -1.53 119.26 118.31 1sa1 h ALA 389 Ca 0.15 -0.19 0.15 0.00 0.00 0.00 0.00 54.91 55.02 1sa1 h ALA 389 Cb -0.02 0.23 -0.05 0.00 0.00 0.00 0.00 17.79 17.95 1sa1 h ALA 389 CO -0.03 -0.69 0.51 0.07 0.00 0.00 0.00 179.25 179.11 1sa1 h ARG 390 N -0.88 0.43 0.39 0.00 0.11 -1.43 -0.75 114.38 112.26 1sa1 h ARG 390 Ca -0.06 -0.03 -0.02 0.00 0.10 0.00 0.00 59.98 59.97 1sa1 h ARG 390 Cb 0.57 -0.10 0.00 0.00 1.11 0.00 0.00 29.97 31.55 1sa1 h ARG 390 CO 0.10 0.29 -0.19 1.25 0.10 0.00 0.00 179.97 181.52 1sa1 h LEU 391 N 0.44 -0.45 -0.95 0.08 5.85 -1.48 -3.20 115.31 115.61 1sa1 h LEU 391 Ca 0.38 0.02 0.10 0.00 0.84 0.00 0.00 57.88 59.21 1sa1 h LEU 391 Cb 0.84 0.12 -0.12 0.00 0.37 0.00 0.00 40.66 41.86 1sa1 h LEU 391 CO -0.13 -0.21 -0.56 0.44 -0.34 0.00 0.00 178.44 177.64 1sa1 h ASP 392 N -0.74 -2.03 -0.83 1.25 3.45 -0.83 -0.50 116.42 116.21 1sa1 h ASP 392 Ca -0.05 0.32 0.18 0.00 0.43 0.00 0.00 57.03 57.91 1sa1 h ASP 392 Cb 0.40 0.91 -0.11 0.00 -0.56 0.00 0.00 39.33 39.97 1sa1 h ASP 392 CO 0.09 -0.25 0.33 -0.74 -1.57 0.00 0.00 179.24 177.10 1sa1 h HIS 393 N -0.03 0.55 0.08 4.55 2.76 -1.28 0.92 115.15 122.70 1sa1 h HIS 393 Ca 0.18 0.04 0.00 0.00 -2.20 0.00 0.00 60.37 58.39 1sa1 h HIS 393 Cb 0.45 -0.12 -0.02 0.00 1.55 0.00 0.00 27.41 29.28 1sa1 h HIS 393 CO -0.98 -0.00 -0.23 0.87 -1.30 0.00 0.00 177.93 176.29 1sa1 h LYS 394 N 0.41 -0.34 -0.45 5.26 6.56 -1.09 -2.40 116.57 124.52 1sa1 h LYS 394 Ca 0.48 0.02 0.05 0.00 -1.06 0.00 0.00 60.65 60.14 1sa1 h LYS 394 Cb 0.83 0.08 -0.07 0.00 -0.57 0.00 0.00 32.23 32.50 1sa1 h LYS 394 CO -0.48 -0.22 -0.41 0.35 -2.06 0.00 0.00 179.45 176.63 1sa1 h PHE 395 N -0.35 -1.29 -0.64 -1.35 3.57 -0.38 -1.50 116.94 115.01 1sa1 h PHE 395 Ca -0.01 0.07 0.20 0.00 3.53 0.00 0.00 57.97 61.77 1sa1 h PHE 395 Cb 0.34 0.62 -0.12 0.00 2.79 0.00 0.00 35.95 39.58 1sa1 h PHE 395 CO -0.33 -0.32 0.10 -0.25 -2.23 0.00 0.00 178.31 175.28 1sa1 n ASP 396 N -4.63 0.00 -0.01 0.41 9.92 0.29 -0.84 116.55 121.69 1sa1 n ASP 396 Ca -0.01 1.07 -0.02 0.00 -0.53 0.00 0.00 54.79 55.31 1sa1 n ASP 396 Cb 0.23 -0.43 -0.12 0.00 -0.64 0.00 0.00 41.12 40.16 1sa1 n ASP 396 CO 0.00 0.00 0.00 -0.11 0.13 0.00 0.00 177.20 177.22 1sa1 n LEU 397 N -4.73 0.50 0.11 0.64 0.00 -0.62 -2.24 117.00 110.67 1sa1 n LEU 397 Ca 0.17 0.22 -0.05 0.00 0.00 0.00 0.00 56.01 56.36 1sa1 n LEU 397 Cb 0.58 0.18 -0.02 0.00 0.00 0.00 0.00 43.42 44.16 1sa1 n LEU 397 CO -0.03 0.23 0.21 0.24 0.00 0.00 0.00 177.39 178.04 1sa1 h MET 398 N 0.00 -0.30 -1.48 1.96 2.86 -0.69 -3.32 114.93 113.96 1sa1 h MET 398 Ca -0.25 0.02 0.43 0.00 -2.06 0.00 0.00 59.70 57.84 1sa1 h MET 398 Cb 1.70 0.07 -0.06 0.00 0.06 0.00 0.00 31.60 33.37 1sa1 h MET 398 CO 0.04 -0.20 1.07 -0.92 1.06 0.00 0.00 176.91 177.95 1sa1 h TYR 399 N -0.65 0.00 0.00 -0.22 3.20 -1.08 0.51 116.97 118.74 1sa1 h TYR 399 Ca -0.03 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.84 1sa1 h TYR 399 Cb 0.24 -0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.51 1sa1 h TYR 399 CO 0.04 -0.00 0.22 0.00 -1.64 0.00 0.00 178.16 176.78 1sa1 n ALA 400 N -2.83 0.60 -2.50 1.82 0.00 -0.95 -0.81 120.51 115.84 1sa1 n ALA 400 Ca 0.33 0.02 0.04 0.00 0.00 0.00 0.00 53.44 53.83 1sa1 n ALA 400 Cb 1.53 -0.63 0.03 0.00 0.00 0.00 0.00 19.45 20.38 1sa1 n ALA 400 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1sa1 n LYS 401 N -1.45 0.19 -0.88 0.00 5.02 0.18 -4.97 118.16 116.26 1sa1 n LYS 401 Ca -0.00 -2.17 -0.05 0.00 -2.02 0.00 0.00 58.31 54.07 1sa1 n LYS 401 Cb 0.23 -0.18 -0.02 0.00 -0.02 0.00 0.00 35.03 35.03 1sa1 n LYS 401 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1sa1 n ARG 402 N 0.36 -1.67 0.00 1.97 5.12 0.01 -4.83 116.66 117.62 1sa1 n ARG 402 Ca 0.07 0.44 0.00 0.00 -1.93 0.00 0.00 57.85 56.42 1sa1 n ARG 402 Cb 1.11 -4.28 0.00 0.00 -1.16 0.00 0.00 32.46 28.13 1sa1 n ARG 402 CO 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 177.63 175.70 1sa1 n ALA 403 N 0.42 0.00 0.49 7.54 0.00 -1.22 -0.21 120.51 127.53 1sa1 n ALA 403 Ca -0.05 0.00 0.09 0.00 0.00 0.00 0.00 53.44 53.48 1sa1 n ALA 403 Cb 0.31 0.00 0.12 0.00 0.00 0.00 0.00 19.45 19.88 1sa1 n ALA 403 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1sa1 n PHE 404 N 0.00 0.19 -0.16 0.00 3.01 -1.26 -4.73 117.46 114.51 1sa1 n PHE 404 Ca 0.00 -0.13 -0.04 0.00 1.01 0.00 0.00 57.45 58.29 1sa1 n PHE 404 Cb 0.00 -0.00 -0.04 0.00 -0.01 0.00 0.00 39.48 39.43 1sa1 n PHE 404 CO 0.00 0.00 0.00 1.55 1.01 0.00 0.00 176.76 179.32 1sa1 n VAL 405 N 1.06 -0.27 0.00 -4.37 3.14 0.71 -0.56 118.33 118.04 1sa1 n VAL 405 Ca 0.13 0.95 0.00 0.00 -2.96 0.00 0.00 64.34 62.46 1sa1 n VAL 405 Cb 0.48 -1.17 0.00 0.00 -1.06 0.00 0.00 33.84 32.08 1sa1 n VAL 405 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1sa1 n HIS 406 N -4.49 0.00 0.05 1.45 1.44 -1.26 0.21 115.22 112.62 1sa1 n HIS 406 Ca 0.01 0.00 -0.03 0.00 -2.01 0.00 0.00 57.72 55.69 1sa1 n HIS 406 Cb 0.10 -0.03 -0.08 0.00 0.12 0.00 0.00 29.99 30.11 1sa1 n HIS 406 CO 0.00 0.00 0.00 -1.49 -2.81 0.00 0.00 176.34 172.04 1sa1 h TRP 407 N 0.00 0.00 0.06 -1.40 4.06 -1.22 -1.10 115.95 116.35 1sa1 h TRP 407 Ca 0.00 0.00 -0.18 0.00 2.06 0.00 0.00 58.89 60.77 1sa1 h TRP 407 Cb 0.00 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 28.15 1sa1 h TRP 407 CO 0.00 0.76 -0.90 1.88 -3.56 0.00 0.00 178.44 176.62 1sa1 h TYR 408 N 0.00 0.23 -0.85 0.49 -1.99 -0.43 -3.18 116.97 111.24 1sa1 h TYR 408 Ca -0.11 -0.17 0.13 0.00 2.00 0.00 0.00 58.73 60.58 1sa1 h TYR 408 Cb 1.67 -0.01 -0.06 0.00 2.00 0.00 0.00 36.73 40.33 1sa1 h TYR 408 CO 0.00 1.35 0.55 0.28 -0.00 0.00 0.00 178.16 180.34 1sa1 h VAL 409 N -0.67 0.86 -0.62 -2.88 2.07 -1.60 -1.14 116.25 112.26 1sa1 h VAL 409 Ca -0.21 -0.23 -0.01 0.00 0.82 0.00 0.00 66.70 67.07 1sa1 h VAL 409 Cb 1.42 0.13 -0.03 0.00 -1.52 0.00 0.00 31.29 31.29 1sa1 h VAL 409 CO -0.01 0.12 0.35 1.23 0.02 0.00 0.00 177.57 179.29 1sa1 h GLY 410 N 0.67 0.92 1.96 2.17 0.00 -1.28 -1.74 103.07 105.78 1sa1 h GLY 410 Ca 0.42 -0.41 0.00 0.00 0.00 0.00 0.00 47.33 47.34 1sa1 h GLY 410 CO -0.18 0.39 -0.02 1.18 0.00 0.00 0.00 176.54 177.91 1sa1 n GLU 411 N -4.57 0.07 0.00 4.80 -0.58 -0.54 -4.87 120.64 114.95 1sa1 n GLU 411 Ca 0.04 0.06 0.00 0.00 -0.42 0.00 0.00 57.16 56.84 1sa1 n GLU 411 Cb 0.08 -1.58 0.00 0.00 -0.57 0.00 0.00 31.44 29.37 1sa1 n GLU 411 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1sa1 n GLY 412 N 1.45 0.80 3.85 0.62 0.00 -0.55 -4.81 105.19 106.55 1sa1 n GLY 412 Ca 0.07 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.84 1sa1 n GLY 412 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1sa1 s MET 413 N 0.00 3.06 0.11 1.61 1.75 -1.04 -4.99 119.30 119.81 1sa1 s MET 413 Ca 0.00 -0.87 -0.24 0.00 -1.25 0.00 0.00 55.69 53.33 1sa1 s MET 413 Cb 0.00 -2.70 -0.07 0.00 2.84 0.00 0.00 34.83 34.90 1sa1 s MET 413 CO 0.00 0.46 0.73 -1.21 -0.65 0.00 0.00 175.02 174.35 1sa1 s GLU 414 N -3.47 4.48 0.37 4.11 2.02 -1.26 -4.37 118.70 120.58 1sa1 s GLU 414 Ca 0.32 1.05 0.12 0.00 0.02 0.00 0.00 54.97 56.49 1sa1 s GLU 414 Cb -0.09 -3.29 0.92 0.00 0.10 0.00 0.00 34.13 31.77 1sa1 s GLU 414 CO 0.25 0.50 1.83 0.93 0.02 0.00 0.00 175.26 178.79 1sa1 h GLU 415 N 4.74 0.56 0.00 1.61 5.08 -1.99 -1.58 114.58 123.01 1sa1 h GLU 415 Ca -0.47 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 57.86 1sa1 h GLU 415 Cb 1.21 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 30.33 1sa1 h GLU 415 CO 0.67 0.37 0.00 0.78 -1.00 0.00 0.00 179.01 179.83 1sa1 h GLY 416 N 0.58 0.00 1.60 -3.84 0.00 -2.00 0.31 103.07 99.71 1sa1 h GLY 416 Ca 0.51 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.81 1sa1 h GLY 416 CO -0.25 0.00 0.09 -2.09 0.00 0.00 0.00 176.54 174.28 1sa1 h GLU 417 N 0.00 0.52 0.10 4.80 4.81 -1.69 -1.85 114.58 121.27 1sa1 h GLU 417 Ca 0.00 -0.08 -0.00 0.00 -0.13 0.00 0.00 59.36 59.14 1sa1 h GLU 417 Cb 0.03 -0.09 0.00 0.00 0.63 0.00 0.00 28.75 29.32 1sa1 h GLU 417 CO 0.00 0.48 -0.05 0.74 -0.73 0.00 0.00 179.01 179.45 1sa1 h PHE 418 N 0.51 -0.12 -0.93 0.92 -1.00 -0.54 0.13 116.94 115.91 1sa1 h PHE 418 Ca 0.12 -0.00 0.22 0.00 2.81 0.00 0.00 57.97 61.12 1sa1 h PHE 418 Cb 0.20 0.04 -0.12 0.00 3.61 0.00 0.00 35.95 39.67 1sa1 h PHE 418 CO 0.01 -0.08 0.47 0.66 -1.61 0.00 0.00 178.31 177.76 1sa1 h SER 419 N -0.19 0.47 1.21 2.17 4.64 -1.65 0.24 113.55 120.43 1sa1 h SER 419 Ca -0.01 0.14 0.00 0.00 -0.47 0.00 0.00 61.79 61.45 1sa1 h SER 419 Cb 0.10 0.09 0.00 0.00 -0.31 0.00 0.00 62.40 62.28 1sa1 h SER 419 CO 0.02 0.06 0.00 -0.08 -0.87 0.00 0.00 176.83 175.96 1sa1 h GLU 420 N 0.48 0.00 0.00 4.77 4.22 -1.36 -1.68 114.58 121.01 1sa1 h GLU 420 Ca 0.58 0.00 -0.01 0.00 0.08 0.00 0.00 59.36 60.01 1sa1 h GLU 420 Cb 1.08 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.33 1sa1 h GLU 420 CO -0.49 0.00 -0.34 0.00 -2.18 0.00 0.00 179.01 176.00 1sa1 h ALA 421 N 2.23 0.01 -0.76 2.92 0.00 0.22 -3.32 119.26 120.56 1sa1 h ALA 421 Ca 0.00 -0.35 0.22 0.00 0.00 0.00 0.00 54.91 54.78 1sa1 h ALA 421 Cb 0.60 0.32 -0.03 0.00 0.00 0.00 0.00 17.79 18.68 1sa1 h ALA 421 CO 0.00 0.32 0.55 -0.09 0.00 0.00 0.00 179.25 180.03 1sa1 h ARG 422 N -1.00 0.01 0.00 0.00 9.65 -1.02 1.00 114.38 123.02 1sa1 h ARG 422 Ca -0.01 -0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.87 1sa1 h ARG 422 Cb 0.36 -0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.94 1sa1 h ARG 422 CO -0.01 0.00 0.00 0.39 2.80 0.00 0.00 179.97 183.16 1sa1 n GLU 423 N -4.31 0.38 0.01 0.20 1.02 -0.63 -1.75 120.64 115.55 1sa1 n GLU 423 Ca 0.15 0.05 -0.13 0.00 -0.02 0.00 0.00 57.16 57.21 1sa1 n GLU 423 Cb 0.83 -1.50 -0.14 0.00 -0.02 0.00 0.00 31.44 30.61 1sa1 n GLU 423 CO 0.00 0.00 0.00 0.22 1.18 0.00 0.00 177.13 178.53 1sa1 h ASP 424 N 0.00 0.17 -0.50 1.62 1.82 0.96 -3.20 116.42 117.29 1sa1 h ASP 424 Ca 0.00 -0.32 -0.07 0.00 -0.39 0.00 0.00 57.03 56.25 1sa1 h ASP 424 Cb 0.22 -0.05 -0.02 0.00 0.68 0.00 0.00 39.33 40.16 1sa1 h ASP 424 CO 0.00 1.28 0.02 0.24 -1.61 0.00 0.00 179.24 179.17 1sa1 h MET 425 N 0.03 0.86 -0.69 0.28 2.86 -1.25 0.17 114.93 117.19 1sa1 h MET 425 Ca -0.29 -0.26 0.15 0.00 -2.06 0.00 0.00 59.70 57.23 1sa1 h MET 425 Cb 2.00 -0.08 -0.12 0.00 0.06 0.00 0.00 31.60 33.46 1sa1 h MET 425 CO 0.10 0.89 0.01 0.00 1.06 0.00 0.00 176.91 178.97 1sa1 h ALA 426 N 0.94 0.70 0.54 6.32 0.00 -1.51 0.97 119.26 127.23 1sa1 h ALA 426 Ca 0.14 0.21 -0.03 0.00 0.00 0.00 0.00 54.91 55.24 1sa1 h ALA 426 Cb 0.49 0.37 0.01 0.00 0.00 0.00 0.00 17.79 18.65 1sa1 h ALA 426 CO 0.02 -0.40 -0.26 0.00 0.00 0.00 0.00 179.25 178.61 1sa1 h ALA 427 N 1.63 -0.73 -0.34 0.00 0.00 -1.37 -2.56 119.26 115.89 1sa1 h ALA 427 Ca 0.37 -0.16 0.01 0.00 0.00 0.00 0.00 54.91 55.13 1sa1 h ALA 427 Cb 0.62 0.28 -0.02 0.00 0.00 0.00 0.00 17.79 18.68 1sa1 h ALA 427 CO -0.59 -0.91 0.21 1.25 0.00 0.00 0.00 179.25 179.20 1sa1 h LEU 428 N -0.73 0.34 -1.72 0.00 5.85 0.14 0.43 115.31 119.61 1sa1 h LEU 428 Ca -0.07 -0.00 0.06 0.00 0.84 0.00 0.00 57.88 58.70 1sa1 h LEU 428 Cb 0.56 -0.08 -0.02 0.00 0.37 0.00 0.00 40.66 41.49 1sa1 h LEU 428 CO 0.12 0.25 0.29 -0.33 -0.34 0.00 0.00 178.44 178.43 1sa1 h GLU 429 N 0.42 0.33 0.02 1.25 5.08 0.92 0.53 114.58 123.14 1sa1 h GLU 429 Ca 0.13 -0.02 -0.07 0.00 -1.00 0.00 0.00 59.36 58.40 1sa1 h GLU 429 Cb -0.02 -0.08 0.01 0.00 0.50 0.00 0.00 28.75 29.16 1sa1 h GLU 429 CO -0.05 0.22 -0.28 -0.22 -1.00 0.00 0.00 179.01 177.68 1sa1 h LYS 430 N 0.34 0.15 -0.76 2.33 3.64 -1.00 -2.94 116.57 118.34 1sa1 h LYS 430 Ca 0.19 -0.19 0.12 0.00 -1.27 0.00 0.00 60.65 59.49 1sa1 h LYS 430 Cb 0.31 0.06 -0.13 0.00 -0.41 0.00 0.00 32.23 32.06 1sa1 h LYS 430 CO -0.04 0.99 -0.40 -0.44 -2.27 0.00 0.00 179.45 177.29 1sa1 h ASP 431 N -0.60 -1.43 0.00 4.20 3.32 0.86 0.76 116.42 123.53 1sa1 h ASP 431 Ca -0.04 0.27 0.00 0.00 0.02 0.00 0.00 57.03 57.28 1sa1 h ASP 431 Cb 1.11 0.70 0.00 0.00 0.22 0.00 0.00 39.33 41.36 1sa1 h ASP 431 CO 0.05 -0.30 0.00 -1.22 -1.72 0.00 0.00 179.24 176.05 1sa1 n TYR 432 N -5.43 0.00 -0.46 4.55 0.53 0.18 -1.48 117.16 115.06 1sa1 n TYR 432 Ca 0.05 0.00 0.38 0.00 -1.02 0.00 0.00 57.90 57.31 1sa1 n TYR 432 Cb 0.36 -0.31 0.67 0.00 -1.03 0.00 0.00 39.34 39.03 1sa1 n TYR 432 CO 0.00 0.00 0.00 1.49 -1.02 0.00 0.00 176.86 177.33 1sa1 h GLU 433 N 0.00 0.09 -1.00 -0.72 4.81 -1.39 -0.80 114.58 115.57 1sa1 h GLU 433 Ca 0.00 -0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.24 1sa1 h GLU 433 Cb 0.00 -0.02 -0.05 0.00 0.63 0.00 0.00 28.75 29.31 1sa1 h GLU 433 CO 0.00 0.06 0.66 0.93 -0.73 0.00 0.00 179.01 179.94 1sa1 h GLU 434 N 0.10 1.30 -1.00 1.92 5.08 0.17 -1.23 114.58 120.92 1sa1 h GLU 434 Ca 0.79 -0.08 0.07 0.00 -1.00 0.00 0.00 59.36 59.14 1sa1 h GLU 434 Cb 2.61 -0.29 -0.07 0.00 0.50 0.00 0.00 28.75 31.49 1sa1 h GLU 434 CO -0.32 0.86 0.65 0.28 -1.00 0.00 0.00 179.01 179.48 1sa1 h VAL 435 N 1.34 1.08 -0.86 3.13 2.07 -0.67 -3.45 116.25 118.89 1sa1 h VAL 435 Ca 0.38 -0.40 -0.58 0.00 0.82 0.00 0.00 66.70 66.91 1sa1 h VAL 435 Cb -0.12 -0.19 0.09 0.00 -1.52 0.00 0.00 31.29 29.55 1sa1 h VAL 435 CO -0.09 0.21 -0.43 0.61 0.02 0.00 0.00 177.57 177.89 1sa1 n GLY 436 N -1.36 -1.44 0.00 2.17 0.00 -0.47 -4.43 105.19 99.66 1sa1 n GLY 436 Ca 0.16 0.31 0.00 0.00 0.00 0.00 0.00 46.02 46.49 1sa1 n GLY 436 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1sa1 n VAL 437 N 0.07 0.00 -2.69 1.61 0.31 -1.26 -4.93 118.33 111.44 1sa1 n VAL 437 Ca 0.16 0.00 -0.22 0.00 -0.01 0.00 0.00 64.34 64.26 1sa1 n VAL 437 Cb 0.21 0.00 0.09 0.00 -0.91 0.00 0.00 33.84 33.23 1sa1 n VAL 437 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 1sa1 s ASP 438 N 0.00 4.62 0.00 4.52 1.11 -1.26 -5.08 116.67 120.58 1sa1 s ASP 438 Ca 0.00 -0.42 0.02 0.00 0.18 0.00 0.00 52.55 52.33 1sa1 s ASP 438 Cb 0.00 -0.07 0.01 0.00 1.07 0.00 0.00 42.92 43.94 1sa1 s ASP 438 CO 0.00 -1.66 0.55 -0.24 1.18 0.00 0.00 175.17 175.00