#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2aj2 n ASP 7 N 0.00 -0.56 -4.38 -3.46 5.68 -1.26 -5.04 116.55 107.53 2aj2 n ASP 7 Ca 0.00 -3.22 -0.45 0.00 -0.50 0.00 0.00 54.79 50.63 2aj2 n ASP 7 Cb 0.00 0.39 -0.05 0.00 -1.14 0.00 0.00 41.12 40.32 2aj2 n ASP 7 CO 0.00 0.00 0.00 -0.63 -1.33 0.00 0.00 177.20 175.24 2aj2 s ILE 8 N -1.17 4.82 -1.36 2.12 1.09 -1.26 -4.96 121.20 120.49 2aj2 s ILE 8 Ca 0.33 -0.93 -0.15 0.00 -1.10 0.00 0.00 60.65 58.81 2aj2 s ILE 8 Cb 0.30 -4.47 0.08 0.00 -1.06 0.00 0.00 42.46 37.31 2aj2 s ILE 8 CO -0.09 -1.09 1.94 1.21 -0.10 0.00 0.00 174.94 176.82 2aj2 n GLU 9 N 6.32 3.12 -3.09 2.79 4.07 -1.26 -4.95 120.64 127.64 2aj2 n GLU 9 Ca -0.09 -3.07 -0.39 0.00 -0.06 0.00 0.00 57.16 53.54 2aj2 n GLU 9 Cb 0.43 -3.29 -0.05 0.00 -0.06 0.00 0.00 31.44 28.46 2aj2 n GLU 9 CO 0.00 0.00 0.00 0.08 -0.06 0.00 0.00 177.13 177.15 2aj2 s VAL 10 N 3.02 4.76 0.00 6.31 1.01 -1.26 -5.01 120.40 129.23 2aj2 s VAL 10 Ca 0.48 1.46 0.00 0.00 0.00 0.00 0.00 61.98 63.92 2aj2 s VAL 10 Cb 0.08 -4.03 0.00 0.00 0.00 0.00 0.00 36.38 32.43 2aj2 s VAL 10 CO -0.01 0.42 0.00 0.61 0.00 0.00 0.00 175.10 176.11 2aj2 n GLY 11 N 2.28 2.55 1.32 4.51 0.00 -1.26 -5.10 105.19 109.48 2aj2 n GLY 11 Ca -0.05 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.80 2aj2 n GLY 11 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2aj2 n HIS 12 N 0.00 -0.87 -0.95 1.61 8.25 -1.26 -5.27 115.22 116.73 2aj2 n HIS 12 Ca 0.00 0.00 0.11 0.00 -0.26 0.00 0.00 57.72 57.57 2aj2 n HIS 12 Cb 0.00 0.33 -0.03 0.00 1.12 0.00 0.00 29.99 31.40 2aj2 n HIS 12 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 2aj2 n SER 13 N -2.16 -4.87 0.00 0.41 7.64 -1.26 -5.19 113.62 108.20 2aj2 n SER 13 Ca 0.00 0.49 0.00 0.00 1.01 0.00 0.00 58.87 60.37 2aj2 n SER 13 Cb 0.00 -3.07 0.00 0.00 -1.01 0.00 0.00 64.21 60.13 2aj2 n SER 13 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 2aj2 n ASN 15 N -4.27 0.00 -1.35 6.43 5.15 -1.26 -5.15 115.26 114.80 2aj2 n ASN 15 Ca -0.01 0.00 0.11 0.00 -0.60 0.00 0.00 54.58 54.08 2aj2 n ASN 15 Cb 0.60 0.00 0.32 0.00 -0.53 0.00 0.00 39.78 40.17 2aj2 n ASN 15 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 2aj2 n LEU 16 N 0.00 3.94 -4.69 1.20 4.77 -1.26 -4.95 117.00 116.02 2aj2 n LEU 16 Ca 0.00 -1.97 -0.34 0.00 -0.03 0.00 0.00 56.01 53.67 2aj2 n LEU 16 Cb 0.00 -0.49 0.12 0.00 -2.33 0.00 0.00 43.42 40.72 2aj2 n LEU 16 CO 0.00 0.90 0.75 0.35 -1.33 0.00 0.00 177.39 178.06 2aj2 n THR 17 N 1.45 2.36 -1.06 -5.08 -2.24 -1.26 -1.02 114.28 107.42 2aj2 n THR 17 Ca 0.24 -0.25 -0.03 0.00 -2.27 0.00 0.00 64.05 61.74 2aj2 n THR 17 Cb 0.65 -1.22 -0.01 0.00 -2.10 0.00 0.00 70.33 67.65 2aj2 n THR 17 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2aj2 n ASN 18 N -3.01 -5.71 -4.74 3.42 4.05 -0.46 -4.93 115.26 103.89 2aj2 n ASN 18 Ca 0.14 0.08 -0.22 0.00 0.45 0.00 0.00 54.58 55.02 2aj2 n ASN 18 Cb 0.50 -3.60 -0.06 0.00 1.23 0.00 0.00 39.78 37.86 2aj2 n ASN 18 CO 0.00 0.00 0.00 -1.00 -3.05 0.00 0.00 177.26 173.21 2aj2 s HIS 19 N -1.24 2.90 -0.04 1.20 3.76 -0.19 -2.21 115.29 119.48 2aj2 s HIS 19 Ca 0.00 -0.17 -0.03 0.00 -0.15 0.00 0.00 55.06 54.71 2aj2 s HIS 19 Cb 0.00 -1.30 -0.04 0.00 1.11 0.00 0.00 32.58 32.35 2aj2 s HIS 19 CO 0.00 0.57 0.14 -0.06 -0.85 0.00 0.00 174.74 174.54 2aj2 s PHE 20 N -2.23 3.49 -0.29 1.40 0.08 -0.81 -1.09 117.98 118.53 2aj2 s PHE 20 Ca 0.32 0.37 -0.07 0.00 0.12 0.00 0.00 56.93 57.67 2aj2 s PHE 20 Cb -0.07 -1.84 0.00 0.00 -0.57 0.00 0.00 43.02 40.54 2aj2 s PHE 20 CO 0.22 0.65 0.08 -0.51 -0.10 0.00 0.00 175.22 175.56 2aj2 s LEU 21 N -1.61 3.80 -0.24 -0.37 1.43 0.47 -3.65 118.68 118.52 2aj2 s LEU 21 Ca 0.22 -0.64 -0.07 0.00 -1.03 0.00 0.00 54.13 52.62 2aj2 s LEU 21 Cb -0.12 -1.89 -0.03 0.00 0.03 0.00 0.00 46.19 44.18 2aj2 s LEU 21 CO 0.13 -0.17 0.05 -0.69 0.23 0.00 0.00 176.35 175.90 2aj2 s VAL 22 N 1.52 4.17 0.00 -1.59 1.01 -0.46 -0.74 120.40 124.31 2aj2 s VAL 22 Ca 0.03 -0.22 0.00 0.00 0.00 0.00 0.00 61.98 61.79 2aj2 s VAL 22 Cb -0.17 -2.94 0.00 0.00 0.00 0.00 0.00 36.38 33.27 2aj2 s VAL 22 CO 0.03 0.36 0.00 0.00 0.00 0.00 0.00 175.10 175.48 2aj2 n ALA 23 N 4.85 0.00 0.48 5.51 0.00 -0.49 -1.96 120.51 128.89 2aj2 n ALA 23 Ca -0.16 0.00 0.08 0.00 0.00 0.00 0.00 53.44 53.35 2aj2 n ALA 23 Cb 0.51 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 19.86 2aj2 n ALA 23 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 2aj2 n PRO 25 N 0.00 1.34 -3.49 0.00 -0.02 -1.26 -4.86 135.00 126.71 2aj2 n PRO 25 Ca 0.00 -0.05 -0.42 0.00 -2.02 0.00 0.00 63.50 61.01 2aj2 n PRO 25 Cb 0.00 -1.29 -0.10 0.00 -0.02 0.00 0.00 33.50 32.08 2aj2 n PRO 25 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2aj2 s SER 26 N -2.97 6.05 0.26 2.55 1.04 -1.26 -5.01 113.70 114.35 2aj2 s SER 26 Ca 0.02 -0.83 0.00 0.00 0.48 0.00 0.00 55.95 55.62 2aj2 s SER 26 Cb 0.11 -2.14 0.00 0.00 0.10 0.00 0.00 66.02 64.10 2aj2 s SER 26 CO 0.66 -0.40 0.00 0.29 0.98 0.00 0.00 173.24 174.76 2aj2 n LYS 28 N 5.13 0.00 -1.59 4.02 4.01 -1.26 -4.78 118.16 123.68 2aj2 n LYS 28 Ca -0.11 0.00 -0.51 0.00 -0.51 0.00 0.00 58.31 57.18 2aj2 n LYS 28 Cb 0.47 -0.02 -0.06 0.00 -0.51 0.00 0.00 35.03 34.91 2aj2 n LYS 28 CO 0.00 0.00 0.00 -3.47 -1.11 0.00 0.00 177.40 172.82 2aj2 n ASP 29 N -3.39 2.73 0.26 4.39 4.64 -1.26 -4.85 116.55 119.07 2aj2 n ASP 29 Ca 0.00 0.72 0.17 0.00 -1.38 0.00 0.00 54.79 54.30 2aj2 n ASP 29 Cb 0.00 -1.30 0.78 0.00 -1.04 0.00 0.00 41.12 39.57 2aj2 n ASP 29 CO 0.00 0.00 0.00 1.55 -0.82 0.00 0.00 177.20 177.93 2aj2 h PRO 30 N 10.50 0.00 0.00 -0.67 0.13 -2.04 -2.26 132.00 137.66 2aj2 h PRO 30 Ca -0.39 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.74 2aj2 h PRO 30 Cb 1.30 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.43 2aj2 h PRO 30 CO 0.98 0.00 0.00 -0.92 -0.23 0.00 0.00 178.00 177.83 2aj2 h TYR 31 N 0.00 0.00 0.00 1.56 3.20 -2.06 -3.11 116.97 116.56 2aj2 h TYR 31 Ca 0.00 0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.87 2aj2 h TYR 31 Cb 0.30 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.57 2aj2 h TYR 31 CO 0.00 0.00 -0.10 1.19 -1.64 0.00 0.00 178.16 177.61 2aj2 n PHE 32 N -2.54 0.00 -0.22 -3.82 3.72 -0.89 -4.89 117.46 108.82 2aj2 n PHE 32 Ca 0.03 -0.47 0.19 0.00 -0.05 0.00 0.00 57.45 57.16 2aj2 n PHE 32 Cb 0.34 -0.07 0.36 0.00 -0.94 0.00 0.00 39.48 39.16 2aj2 n PHE 32 CO 0.00 0.00 0.00 1.17 -0.05 0.00 0.00 176.76 177.88 2aj2 n LYS 33 N -0.60 -0.04 -2.72 -1.08 3.00 -0.97 -1.95 118.16 113.79 2aj2 n LYS 33 Ca 0.05 0.96 -0.09 0.00 -0.00 0.00 0.00 58.31 59.23 2aj2 n LYS 33 Cb 0.51 -1.68 0.07 0.00 0.00 0.00 0.00 35.03 33.92 2aj2 n LYS 33 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 2aj2 n ARG 34 N -4.63 1.14 -3.41 1.64 1.74 -1.26 -4.84 116.66 107.03 2aj2 n ARG 34 Ca 0.24 -2.59 -0.26 0.00 -0.77 0.00 0.00 57.85 54.46 2aj2 n ARG 34 Cb 0.80 -0.78 -0.02 0.00 -1.02 0.00 0.00 32.46 31.44 2aj2 n ARG 34 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 2aj2 s SER 35 N -2.16 6.36 -0.25 0.55 1.04 -0.82 -4.80 113.70 113.62 2aj2 s SER 35 Ca 0.26 0.53 -0.02 0.00 0.48 0.00 0.00 55.95 57.20 2aj2 s SER 35 Cb 0.41 -2.07 0.08 0.00 0.10 0.00 0.00 66.02 64.55 2aj2 s SER 35 CO -0.03 -0.22 0.06 -0.69 0.98 0.00 0.00 173.24 173.35 2aj2 s VAL 36 N -2.16 0.67 -0.11 5.02 1.01 -1.25 -1.40 120.40 122.17 2aj2 s VAL 36 Ca 0.41 -0.95 -0.05 0.00 0.00 0.00 0.00 61.98 61.39 2aj2 s VAL 36 Cb -0.10 -1.32 -0.04 0.00 0.00 0.00 0.00 36.38 34.92 2aj2 s VAL 36 CO 0.33 -0.44 0.06 -0.63 0.00 0.00 0.00 175.10 174.42 2aj2 s ILE 37 N 1.76 4.79 -0.31 2.22 1.01 0.08 -0.70 121.20 130.06 2aj2 s ILE 37 Ca 0.04 -0.06 -0.11 0.00 0.00 0.00 0.00 60.65 60.52 2aj2 s ILE 37 Cb -0.17 -3.07 -0.03 0.00 0.01 0.00 0.00 42.46 39.20 2aj2 s ILE 37 CO -0.17 0.59 0.19 -0.47 0.00 0.00 0.00 174.94 175.07 2aj2 s TYR 38 N -0.72 3.20 -0.24 3.97 6.14 -0.25 0.18 117.35 129.63 2aj2 s TYR 38 Ca 0.12 -0.21 -0.29 0.00 0.64 0.00 0.00 57.07 57.33 2aj2 s TYR 38 Cb -0.12 -2.40 -0.01 0.00 0.42 0.00 0.00 41.96 39.85 2aj2 s TYR 38 CO 0.03 -0.32 1.42 0.42 0.64 0.00 0.00 175.55 177.74 2aj2 s ILE 39 N 1.70 3.98 -0.60 3.14 -1.09 -0.25 -2.10 121.20 125.98 2aj2 s ILE 39 Ca 0.06 1.13 0.24 0.00 -2.23 0.00 0.00 60.65 59.85 2aj2 s ILE 39 Cb -0.17 -3.94 0.02 0.00 -1.58 0.00 0.00 42.46 36.79 2aj2 s ILE 39 CO 0.09 -0.34 1.25 0.00 -1.23 0.00 0.00 174.94 174.71 2aj2 s GLU 41 N -3.19 0.40 -0.09 0.00 2.12 -1.26 -4.86 118.70 111.82 2aj2 s GLU 41 Ca 0.05 0.70 -0.03 0.00 0.36 0.00 0.00 54.97 56.05 2aj2 s GLU 41 Cb 0.13 0.10 0.05 0.00 0.26 0.00 0.00 34.13 34.67 2aj2 s GLU 41 CO 0.74 -0.09 0.10 -1.58 -0.54 0.00 0.00 175.26 173.90 2aj2 s HIS 42 N 1.42 0.01 0.27 5.30 2.46 -1.26 -4.38 115.29 119.11 2aj2 s HIS 42 Ca -0.09 0.22 -0.06 0.00 0.47 0.00 0.00 55.06 55.60 2aj2 s HIS 42 Cb -0.04 -0.46 0.02 0.00 -0.13 0.00 0.00 32.58 31.97 2aj2 s HIS 42 CO -0.15 -0.31 0.46 0.27 -2.47 0.00 0.00 174.74 172.53 2aj2 n ASN 43 N 5.30 -1.32 0.07 9.88 0.23 0.09 -4.81 115.26 124.70 2aj2 n ASN 43 Ca -0.04 -2.28 0.21 0.00 -0.53 0.00 0.00 54.58 51.93 2aj2 n ASN 43 Cb 0.50 2.30 0.69 0.00 -2.08 0.00 0.00 39.78 41.20 2aj2 n ASN 43 CO 0.00 0.00 0.00 1.56 -0.93 0.00 0.00 177.26 177.89 2aj2 h GLN 44 N 0.00 0.00 0.00 -3.83 4.20 -2.01 0.50 115.11 113.98 2aj2 h GLN 44 Ca -0.22 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.48 2aj2 h GLN 44 Cb 0.89 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.67 2aj2 h GLN 44 CO 0.29 0.00 -0.08 -0.44 -0.67 0.00 0.00 178.83 177.93 2aj2 h ASP 45 N 0.00 0.00 0.00 1.46 3.45 -1.96 -3.38 116.42 116.00 2aj2 h ASP 45 Ca 0.22 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.68 2aj2 h ASP 45 Cb 1.36 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 40.13 2aj2 h ASP 45 CO -0.00 0.02 0.00 0.61 -1.57 0.00 0.00 179.24 178.30 2aj2 n GLY 46 N 1.11 0.83 0.00 2.75 0.00 0.18 -1.68 105.19 108.37 2aj2 n GLY 46 Ca 0.04 -1.72 0.00 0.00 0.00 0.00 0.00 46.02 44.33 2aj2 n GLY 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2aj2 n ALA 47 N -1.00 0.00 0.00 4.61 0.00 -1.01 -0.73 120.51 122.37 2aj2 n ALA 47 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2aj2 n ALA 47 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2aj2 n ALA 47 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2aj2 n GLY 49 N 0.00 1.03 0.00 0.00 0.00 0.14 -1.20 105.19 105.16 2aj2 n GLY 49 Ca 0.00 -1.08 0.00 0.00 0.00 0.00 0.00 46.02 44.94 2aj2 n GLY 49 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2aj2 n LEU 50 N 0.00 0.00 0.00 0.99 4.77 -0.89 0.56 117.00 122.43 2aj2 n LEU 50 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 2aj2 n LEU 50 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 2aj2 n LEU 50 CO 0.00 0.00 0.00 -0.38 -1.33 0.00 0.00 177.39 175.68 2aj2 n ILE 52 N 0.00 0.00 -2.15 -0.08 -0.00 0.12 -1.09 119.36 116.16 2aj2 n ILE 52 Ca 0.00 0.00 -0.03 0.00 -0.00 0.00 0.00 62.75 62.72 2aj2 n ILE 52 Cb 0.00 0.14 0.09 0.00 -0.00 0.00 0.00 39.64 39.87 2aj2 n ILE 52 CO 0.00 0.00 0.00 -0.46 -0.00 0.00 0.00 176.55 176.09 2aj2 n ASN 53 N 0.00 2.31 -3.79 4.38 6.94 -1.26 -4.90 115.26 118.94 2aj2 n ASN 53 Ca 0.00 -3.06 -0.32 0.00 -0.02 0.00 0.00 54.58 51.18 2aj2 n ASN 53 Cb 0.00 -0.42 -0.07 0.00 -2.36 0.00 0.00 39.78 36.94 2aj2 n ASN 53 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2aj2 n ALA 54 N -0.53 4.10 -1.90 -2.53 0.00 -1.26 -4.98 120.51 113.41 2aj2 n ALA 54 Ca 0.20 -4.70 -0.42 0.00 0.00 0.00 0.00 53.44 48.52 2aj2 n ALA 54 Cb 0.89 -1.40 -0.03 0.00 0.00 0.00 0.00 19.45 18.92 2aj2 n ALA 54 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2aj2 s PRO 55 N -2.08 4.24 0.55 0.00 0.04 -1.26 0.14 135.00 136.62 2aj2 s PRO 55 Ca 0.33 2.34 0.00 0.00 0.04 0.00 0.00 61.00 63.71 2aj2 s PRO 55 Cb 0.04 -3.12 0.11 0.00 0.04 0.00 0.00 34.50 31.57 2aj2 s PRO 55 CO -0.05 -0.51 0.76 1.51 0.04 0.00 0.00 177.00 178.75 2aj2 n ILE 56 N 2.97 0.00 0.04 0.56 0.13 0.23 -4.81 119.36 118.49 2aj2 n ILE 56 Ca 0.10 -1.22 -0.02 0.00 -1.10 0.00 0.00 62.75 60.51 2aj2 n ILE 56 Cb 0.39 -0.99 -0.01 0.00 -0.84 0.00 0.00 39.64 38.20 2aj2 n ILE 56 CO 0.00 0.00 0.00 -0.78 2.80 0.00 0.00 176.55 178.57 2aj2 h ASP 57 N -0.43 -0.10 -3.17 9.51 1.82 -1.95 -3.42 116.42 118.68 2aj2 h ASP 57 Ca -0.25 0.00 -0.57 0.00 -0.39 0.00 0.00 57.03 55.82 2aj2 h ASP 57 Cb 0.94 0.03 0.18 0.00 0.68 0.00 0.00 39.33 41.15 2aj2 h ASP 57 CO 0.27 -0.01 -0.30 2.30 -1.61 0.00 0.00 179.24 179.89 2aj2 n ILE 58 N -2.68 2.37 -2.79 2.25 -5.35 -1.26 -4.84 119.36 107.06 2aj2 n ILE 58 Ca -0.01 -0.46 -0.19 0.00 -0.27 0.00 0.00 62.75 61.81 2aj2 n ILE 58 Cb 0.05 -0.78 0.03 0.00 -1.74 0.00 0.00 39.64 37.19 2aj2 n ILE 58 CO 0.00 0.00 0.00 0.42 -1.76 0.00 0.00 176.55 175.21 2aj2 s THR 59 N -1.75 2.79 0.19 7.28 -4.23 -1.26 -2.73 115.64 115.92 2aj2 s THR 59 Ca 0.69 -0.80 -0.12 0.00 -1.18 0.00 0.00 61.69 60.28 2aj2 s THR 59 Cb -0.40 -2.99 0.10 0.00 1.34 0.00 0.00 72.50 70.55 2aj2 s THR 59 CO 0.54 0.00 1.82 1.62 -0.54 0.00 0.00 174.62 178.06 2aj2 h VAL 60 N 0.30 1.19 -0.47 2.29 3.04 -0.91 -2.34 116.25 119.34 2aj2 h VAL 60 Ca -0.41 -0.43 -0.04 0.00 -1.01 0.00 0.00 66.70 64.81 2aj2 h VAL 60 Cb 1.29 0.33 -0.02 0.00 -2.01 0.00 0.00 31.29 30.88 2aj2 h VAL 60 CO 0.49 0.20 0.14 1.23 -1.01 0.00 0.00 177.57 178.62 2aj2 h GLY 61 N 0.86 0.79 -1.35 3.17 0.00 -1.40 -2.47 103.07 102.66 2aj2 h GLY 61 Ca 0.23 -0.47 0.00 0.00 0.00 0.00 0.00 47.33 47.08 2aj2 h GLY 61 CO -0.04 0.44 0.00 0.61 0.00 0.00 0.00 176.54 177.55 2aj2 n GLY 62 N -0.67 0.00 2.33 4.60 0.00 -0.88 -1.17 105.19 109.39 2aj2 n GLY 62 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 2aj2 n GLY 62 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2aj2 n LEU 64 N 0.55 0.00 -0.24 0.99 4.77 -0.93 -0.57 117.00 121.57 2aj2 n LEU 64 Ca 0.00 0.00 0.05 0.00 -0.03 0.00 0.00 56.01 56.03 2aj2 n LEU 64 Cb 0.00 0.00 0.17 0.00 -2.33 0.00 0.00 43.42 41.26 2aj2 n LEU 64 CO 0.00 0.00 0.92 0.50 -1.33 0.00 0.00 177.39 177.48 2aj2 h LYS 65 N 0.00 0.25 -0.08 3.23 3.64 -1.43 0.65 116.57 122.83 2aj2 h LYS 65 Ca 0.00 -0.01 0.03 0.00 -1.27 0.00 0.00 60.65 59.39 2aj2 h LYS 65 Cb 0.00 -0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 31.73 2aj2 h LYS 65 CO 0.00 0.16 -0.11 0.37 -2.27 0.00 0.00 179.45 177.61 2aj2 h GLN 66 N 0.26 -0.15 0.00 1.90 5.75 -1.08 0.12 115.11 121.91 2aj2 h GLN 66 Ca 0.40 0.01 0.00 0.00 -0.15 0.00 0.00 58.65 58.91 2aj2 h GLN 66 Cb 0.67 0.03 0.00 0.00 1.07 0.00 0.00 27.48 29.25 2aj2 h GLN 66 CO -0.50 -0.10 0.00 0.28 -2.65 0.00 0.00 178.83 175.86 2aj2 n VAL 67 N -5.25 0.66 -3.18 2.39 0.31 0.34 -4.86 118.33 108.74 2aj2 n VAL 67 Ca -0.04 0.16 -0.23 0.00 -0.01 0.00 0.00 64.34 64.22 2aj2 n VAL 67 Cb 0.17 -0.90 0.04 0.00 -0.91 0.00 0.00 33.84 32.24 2aj2 n VAL 67 CO 0.00 0.00 0.00 -0.67 -1.32 0.00 0.00 176.83 174.84 2aj2 n ASP 68 N -1.35 -6.03 -4.67 4.52 -0.08 0.20 -4.92 116.55 104.22 2aj2 n ASP 68 Ca 0.06 -0.36 -0.43 0.00 -1.51 0.00 0.00 54.79 52.56 2aj2 n ASP 68 Cb 0.14 -4.85 -0.02 0.00 2.34 0.00 0.00 41.12 38.73 2aj2 n ASP 68 CO 0.00 0.00 0.00 -0.63 0.12 0.00 0.00 177.20 176.69 2aj2 s ILE 69 N -3.20 4.51 -0.28 5.18 -1.09 -0.86 -4.99 121.20 120.48 2aj2 s ILE 69 Ca 0.38 1.81 -0.27 0.00 -2.23 0.00 0.00 60.65 60.34 2aj2 s ILE 69 Cb -0.17 -4.17 0.01 0.00 -1.58 0.00 0.00 42.46 36.55 2aj2 s ILE 69 CO 0.47 -0.09 0.94 -0.70 -1.23 0.00 0.00 174.94 174.32 2aj2 s GLU 70 N 2.83 4.11 0.72 2.79 2.12 -1.26 -4.78 118.70 125.23 2aj2 s GLU 70 Ca 0.50 0.98 -0.15 0.00 0.36 0.00 0.00 54.97 56.66 2aj2 s GLU 70 Cb -0.19 -3.69 0.03 0.00 0.26 0.00 0.00 34.13 30.54 2aj2 s GLU 70 CO 0.14 -0.69 1.20 -1.25 -0.54 0.00 0.00 175.26 174.12 2aj2 s PRO 71 N 3.18 2.22 0.00 4.30 0.04 -1.26 -4.75 135.00 138.73 2aj2 s PRO 71 Ca 0.39 1.74 0.25 0.00 0.04 0.00 0.00 61.00 63.42 2aj2 s PRO 71 Cb -0.14 -1.85 0.43 0.00 0.04 0.00 0.00 34.50 32.98 2aj2 s PRO 71 CO 0.11 -1.77 1.39 0.00 0.04 0.00 0.00 177.00 176.77 2aj2 n ALA 72 N -2.64 2.55 -3.36 8.56 0.00 -0.71 -4.96 120.51 119.94 2aj2 n ALA 72 Ca 0.13 -0.62 -0.09 0.00 0.00 0.00 0.00 53.44 52.87 2aj2 n ALA 72 Cb 0.50 -0.91 -0.04 0.00 0.00 0.00 0.00 19.45 19.00 2aj2 n ALA 72 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.50 178.21 2aj2 s TYR 73 N -2.03 0.11 0.41 0.00 2.02 -1.26 -5.11 117.35 111.49 2aj2 s TYR 73 Ca 0.30 -0.49 -0.27 0.00 -0.37 0.00 0.00 57.07 56.25 2aj2 s TYR 73 Cb 0.20 0.36 -0.10 0.00 -0.40 0.00 0.00 41.96 42.02 2aj2 s TYR 73 CO 0.33 -1.03 1.43 -2.30 -1.57 0.00 0.00 175.55 172.41 2aj2 n PRO 74 N -0.39 2.39 -2.95 -1.71 -0.02 -1.26 -4.84 135.00 126.23 2aj2 n PRO 74 Ca -0.04 0.84 -0.44 0.00 -2.02 0.00 0.00 63.50 61.84 2aj2 n PRO 74 Cb 0.61 -2.59 -0.00 0.00 -0.02 0.00 0.00 33.50 31.50 2aj2 n PRO 74 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 2aj2 s GLN 75 N -2.22 4.08 0.04 -0.52 -0.21 -1.26 -4.37 119.66 115.19 2aj2 s GLN 75 Ca 0.57 -2.56 -0.18 0.00 0.02 0.00 0.00 55.36 53.20 2aj2 s GLN 75 Cb -0.48 -5.05 -0.19 0.00 1.00 0.00 0.00 33.01 28.29 2aj2 s GLN 75 CO 0.61 -1.76 1.22 0.77 -2.12 0.00 0.00 175.29 174.00 2aj2 h SER 76 N 7.20 0.59 0.00 5.90 0.02 -1.75 -3.30 113.55 122.21 2aj2 h SER 76 Ca 0.31 -0.65 -0.01 0.00 -0.84 0.00 0.00 61.79 60.60 2aj2 h SER 76 Cb 0.88 -0.17 -0.00 0.00 0.14 0.00 0.00 62.40 63.24 2aj2 h SER 76 CO 1.24 1.14 0.03 1.41 -1.14 0.00 0.00 176.83 179.51 2aj2 n HIS 77 N -4.25 0.00 -0.17 3.45 8.25 -0.57 -4.53 115.22 117.40 2aj2 n HIS 77 Ca -0.08 -0.39 0.29 0.00 -0.26 0.00 0.00 57.72 57.27 2aj2 n HIS 77 Cb 0.59 -0.41 0.60 0.00 1.12 0.00 0.00 29.99 31.88 2aj2 n HIS 77 CO 0.00 0.00 0.00 0.37 0.64 0.00 0.00 176.34 177.35 2aj2 h GLN 78 N 3.21 0.00 0.20 -0.41 5.75 -1.77 -1.48 115.11 120.60 2aj2 h GLN 78 Ca 0.01 0.00 -0.34 0.00 -0.15 0.00 0.00 58.65 58.17 2aj2 h GLN 78 Cb 0.39 0.00 0.02 0.00 1.07 0.00 0.00 27.48 28.96 2aj2 h GLN 78 CO 0.06 0.00 -1.63 0.93 -2.65 0.00 0.00 178.83 175.54 2aj2 h GLU 79 N 0.00 0.42 0.00 1.69 4.39 -1.94 -3.21 114.58 115.94 2aj2 h GLU 79 Ca 0.45 -0.72 0.00 0.00 0.34 0.00 0.00 59.36 59.42 2aj2 h GLU 79 Cb 2.38 0.27 0.00 0.00 -0.10 0.00 0.00 28.75 31.29 2aj2 h GLU 79 CO -0.00 1.33 0.00 0.09 -1.16 0.00 0.00 179.01 179.27 2aj2 n ASN 80 N -3.61 0.19 0.01 1.42 4.13 -0.57 -1.51 115.26 115.31 2aj2 n ASN 80 Ca -0.21 0.55 0.13 0.00 1.68 0.00 0.00 54.58 56.74 2aj2 n ASN 80 Cb 1.08 -0.59 0.51 0.00 -1.54 0.00 0.00 39.78 39.24 2aj2 n ASN 80 CO 0.00 0.00 0.00 -0.11 0.28 0.00 0.00 177.26 177.43 2aj2 n LEU 81 N -1.71 0.19 0.00 3.41 7.94 -1.12 -3.09 117.00 122.62 2aj2 n LEU 81 Ca 0.03 0.38 0.11 0.00 -1.11 0.00 0.00 56.01 55.42 2aj2 n LEU 81 Cb 0.18 -0.42 -0.05 0.00 0.53 0.00 0.00 43.42 43.66 2aj2 n LEU 81 CO 0.15 0.01 -0.01 0.29 -1.11 0.00 0.00 177.39 176.72 2aj2 n LYS 82 N -1.57 0.08 -1.65 1.96 5.02 -0.57 -1.22 118.16 120.21 2aj2 n LYS 82 Ca 0.06 -0.02 -0.36 0.00 -2.02 0.00 0.00 58.31 55.98 2aj2 n LYS 82 Cb 0.35 -1.51 0.07 0.00 -0.02 0.00 0.00 35.03 33.92 2aj2 n LYS 82 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2aj2 s LYS 83 N -3.06 2.42 0.67 1.97 1.02 -1.18 -4.68 119.74 116.91 2aj2 s LYS 83 Ca 0.07 1.93 -0.08 0.00 0.02 0.00 0.00 55.97 57.91 2aj2 s LYS 83 Cb 0.16 -1.85 0.03 0.00 -0.52 0.00 0.00 37.83 35.65 2aj2 s LYS 83 CO 0.84 -1.66 1.00 -1.25 -0.92 0.00 0.00 175.35 173.36 2aj2 s PRO 84 N -3.57 2.63 0.13 -1.68 0.04 -1.26 -0.53 135.00 130.75 2aj2 s PRO 84 Ca 0.79 0.05 0.03 0.00 0.04 0.00 0.00 61.00 61.91 2aj2 s PRO 84 Cb -0.34 -2.16 -0.04 0.00 0.04 0.00 0.00 34.50 32.01 2aj2 s PRO 84 CO 0.41 -1.00 0.19 0.14 0.04 0.00 0.00 177.00 176.78 2aj2 s VAL 85 N -3.19 4.91 0.50 -0.36 -7.23 -1.11 -4.55 120.40 109.36 2aj2 s VAL 85 Ca 0.57 -0.79 0.08 0.00 -1.81 0.00 0.00 61.98 60.03 2aj2 s VAL 85 Cb -0.11 -3.47 0.04 0.00 0.56 0.00 0.00 36.38 33.39 2aj2 s VAL 85 CO 0.47 -0.03 0.57 -0.36 -0.31 0.00 0.00 175.10 175.44 2aj2 s PHE 86 N -1.65 2.05 -0.53 2.82 0.40 0.14 0.78 117.98 121.99 2aj2 s PHE 86 Ca 0.32 -0.63 -0.16 0.00 -0.60 0.00 0.00 56.93 55.87 2aj2 s PHE 86 Cb -0.11 -2.17 0.12 0.00 0.51 0.00 0.00 43.02 41.37 2aj2 s PHE 86 CO 0.26 -0.62 0.48 1.21 0.70 0.00 0.00 175.22 177.25 2aj2 s ASN 87 N -4.39 6.16 0.17 1.36 3.84 0.37 -1.77 114.94 120.67 2aj2 s ASN 87 Ca 0.51 -1.74 -0.13 0.00 0.21 0.00 0.00 52.86 51.71 2aj2 s ASN 87 Cb -0.05 -2.20 0.06 0.00 -0.55 0.00 0.00 41.25 38.51 2aj2 s ASN 87 CO 0.31 -0.83 1.76 1.23 -2.79 0.00 0.00 177.10 176.79 2aj2 h GLY 88 N 8.85 0.83 0.00 1.21 0.00 -1.30 -3.42 103.07 109.24 2aj2 h GLY 88 Ca -0.29 -0.40 0.00 0.00 0.00 0.00 0.00 47.33 46.64 2aj2 h GLY 88 CO 1.01 0.38 0.00 0.61 0.00 0.00 0.00 176.54 178.54 2aj2 n GLY 89 N -0.96 -1.41 0.17 4.60 0.00 -1.07 -3.50 105.19 103.02 2aj2 n GLY 89 Ca 0.03 -1.01 0.07 0.00 0.00 0.00 0.00 46.02 45.11 2aj2 n GLY 89 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2aj2 h PRO 90 N 0.00 0.00 -6.61 1.61 0.13 -1.81 -3.31 132.00 122.02 2aj2 h PRO 90 Ca 0.00 0.00 -0.51 0.00 -0.87 0.00 0.00 66.00 64.62 2aj2 h PRO 90 Cb 0.00 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.11 2aj2 h PRO 90 CO 0.00 0.24 0.36 0.08 -0.23 0.00 0.00 178.00 178.45 2aj2 s VAL 91 N -3.09 4.39 -1.25 1.56 1.01 -0.70 -4.05 120.40 118.27 2aj2 s VAL 91 Ca 0.05 2.06 -0.20 0.00 0.00 0.00 0.00 61.98 63.90 2aj2 s VAL 91 Cb 0.07 -4.32 0.01 0.00 0.00 0.00 0.00 36.38 32.14 2aj2 s VAL 91 CO 0.72 0.35 0.61 -1.20 0.00 0.00 0.00 175.10 175.58 2aj2 n SER 92 N 2.51 -3.40 0.00 3.32 7.64 -1.26 -1.15 113.62 121.27 2aj2 n SER 92 Ca 0.01 -1.13 0.03 0.00 1.01 0.00 0.00 58.87 58.79 2aj2 n SER 92 Cb 0.49 -2.59 0.14 0.00 -1.01 0.00 0.00 64.21 61.23 2aj2 n SER 92 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2aj2 n GLU 93 N -4.55 0.09 -0.35 1.43 1.02 -1.26 -1.48 120.64 115.53 2aj2 n GLU 93 Ca -0.16 0.22 0.10 0.00 -0.02 0.00 0.00 57.16 57.29 2aj2 n GLU 93 Cb 0.61 -1.50 0.28 0.00 -0.02 0.00 0.00 31.44 30.81 2aj2 n GLU 93 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 2aj2 n ASP 94 N -1.27 3.78 -4.55 1.62 3.85 -1.26 -4.21 116.55 114.51 2aj2 n ASP 94 Ca 0.03 -2.09 -0.32 0.00 -0.71 0.00 0.00 54.79 51.69 2aj2 n ASP 94 Cb 0.04 -0.43 -0.11 0.00 -1.35 0.00 0.00 41.12 39.27 2aj2 n ASP 94 CO 0.00 0.00 0.00 -0.13 -1.01 0.00 0.00 177.20 176.06 2aj2 s ARG 95 N -1.17 2.48 0.25 0.11 0.52 -0.55 -4.97 118.95 115.62 2aj2 s ARG 95 Ca 0.42 -0.74 -0.08 0.00 -0.52 0.00 0.00 55.73 54.80 2aj2 s ARG 95 Cb 0.23 -2.43 -0.06 0.00 0.52 0.00 0.00 34.95 33.20 2aj2 s ARG 95 CO 0.26 0.60 0.55 0.20 0.02 0.00 0.00 175.30 176.93 2aj2 s GLY 96 N -1.22 2.15 -0.27 -3.53 0.00 -1.26 -0.93 107.32 102.25 2aj2 s GLY 96 Ca 0.15 -0.37 -0.00 0.00 0.00 0.00 0.00 44.72 44.50 2aj2 s GLY 96 CO 0.05 -0.24 0.36 -1.36 0.00 0.00 0.00 173.10 171.91 2aj2 s PHE 97 N -1.90 -0.78 -0.27 1.90 0.08 -0.11 -4.76 117.98 112.14 2aj2 s PHE 97 Ca 0.46 0.31 -0.20 0.00 0.12 0.00 0.00 56.93 57.62 2aj2 s PHE 97 Cb -0.11 -0.21 -0.02 0.00 -0.57 0.00 0.00 43.02 42.11 2aj2 s PHE 97 CO 0.24 -0.88 0.60 0.42 -0.10 0.00 0.00 175.22 175.50 2aj2 s ILE 98 N 2.48 4.99 -0.29 0.64 1.09 -0.35 -1.22 121.20 128.56 2aj2 s ILE 98 Ca 0.10 1.00 -0.09 0.00 -1.10 0.00 0.00 60.65 60.55 2aj2 s ILE 98 Cb -0.14 -3.92 -0.03 0.00 -1.06 0.00 0.00 42.46 37.31 2aj2 s ILE 98 CO -0.27 0.00 0.14 -0.22 -0.10 0.00 0.00 174.94 174.50 2aj2 s LEU 99 N 2.48 3.90 0.00 2.97 2.96 -0.48 -0.72 118.68 129.80 2aj2 s LEU 99 Ca 0.25 -0.29 -0.01 0.00 -0.22 0.00 0.00 54.13 53.86 2aj2 s LEU 99 Cb -0.15 -2.02 0.00 0.00 0.50 0.00 0.00 46.19 44.52 2aj2 s LEU 99 CO 0.09 -0.11 0.31 0.00 -1.32 0.00 0.00 176.35 175.32 2aj2 n HIS 100 N 4.99 -1.06 -3.37 5.38 1.44 -0.18 -0.81 115.22 121.60 2aj2 n HIS 100 Ca -0.15 -1.52 -0.39 0.00 -2.01 0.00 0.00 57.72 53.65 2aj2 n HIS 100 Cb 0.51 0.35 -0.09 0.00 0.12 0.00 0.00 29.99 30.88 2aj2 n HIS 100 CO 0.00 0.00 0.00 1.03 -2.81 0.00 0.00 176.34 174.56 2aj2 s ARG 101 N -2.53 4.04 0.02 -1.40 0.52 -0.08 -0.55 118.95 118.97 2aj2 s ARG 101 Ca 0.19 0.09 -0.33 0.00 -0.52 0.00 0.00 55.73 55.16 2aj2 s ARG 101 Cb -0.01 -3.65 -0.17 0.00 0.52 0.00 0.00 34.95 31.65 2aj2 s ARG 101 CO 0.14 -0.27 0.85 -2.30 0.02 0.00 0.00 175.30 173.74 2aj2 n PRO 102 N 5.29 0.00 0.00 3.54 -0.02 -1.26 -4.55 135.00 138.00 2aj2 n PRO 102 Ca -0.08 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.40 2aj2 n PRO 102 Cb 0.51 -1.22 0.00 0.00 -0.02 0.00 0.00 33.50 32.77 2aj2 n PRO 102 CO 0.00 0.00 0.00 -2.13 1.98 0.00 0.00 175.50 175.35 2aj2 n ARG 103 N 1.22 0.00 -0.99 -0.52 3.00 -1.26 -4.89 116.66 113.22 2aj2 n ARG 103 Ca 0.17 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 58.02 2aj2 n ARG 103 Cb 0.08 -0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.54 2aj2 n ARG 103 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 2aj2 n ASP 104 N -2.50 1.16 -4.65 6.15 10.43 -1.26 -5.12 116.55 120.76 2aj2 n ASP 104 Ca 0.00 -0.49 -0.36 0.00 2.57 0.00 0.00 54.79 56.51 2aj2 n ASP 104 Cb 0.00 0.00 -0.09 0.00 1.84 0.00 0.00 41.12 42.87 2aj2 n ASP 104 CO 0.00 0.00 0.00 -2.28 -1.07 0.00 0.00 177.20 173.85 2aj2 s HIS 105 N -0.62 3.30 0.12 1.24 5.65 -1.26 -5.08 115.29 118.65 2aj2 s HIS 105 Ca 0.00 0.15 0.10 0.00 0.25 0.00 0.00 55.06 55.56 2aj2 s HIS 105 Cb 0.00 -2.18 -0.04 0.00 -1.18 0.00 0.00 32.58 29.18 2aj2 s HIS 105 CO 0.00 0.11 -0.21 0.71 -0.65 0.00 0.00 174.74 174.70 2aj2 s TYR 106 N 0.74 2.46 0.21 3.88 4.12 -1.26 -5.04 117.35 122.46 2aj2 s TYR 106 Ca 0.06 -0.30 -0.13 0.00 0.02 0.00 0.00 57.07 56.72 2aj2 s TYR 106 Cb -0.13 -1.31 0.25 0.00 -1.52 0.00 0.00 41.96 39.25 2aj2 s TYR 106 CO 0.02 0.38 1.64 0.93 0.02 0.00 0.00 175.55 178.53 2aj2 h GLU 107 N 3.75 0.03 -3.25 -0.62 5.08 -1.98 -3.32 114.58 114.26 2aj2 h GLU 107 Ca -0.50 -0.00 -0.63 0.00 -1.00 0.00 0.00 59.36 57.23 2aj2 h GLU 107 Cb 1.17 -0.01 -0.40 0.00 0.50 0.00 0.00 28.75 30.01 2aj2 h GLU 107 CO 0.44 0.02 -0.69 0.45 -1.00 0.00 0.00 179.01 178.23 2aj2 s SER 108 N -5.23 4.01 0.00 1.42 0.15 -1.26 -5.04 113.70 107.75 2aj2 s SER 108 Ca -0.14 -2.76 0.00 0.00 0.70 0.00 0.00 55.95 53.74 2aj2 s SER 108 Cb 0.19 -1.34 0.00 0.00 -1.71 0.00 0.00 66.02 63.16 2aj2 s SER 108 CO 0.73 -0.26 0.00 -0.24 1.20 0.00 0.00 173.24 174.68 2aj2 n SER 109 N 3.40 0.41 -3.98 5.45 2.88 -1.25 -1.16 113.62 119.37 2aj2 n SER 109 Ca 0.06 0.00 -0.09 0.00 -1.33 0.00 0.00 58.87 57.51 2aj2 n SER 109 Cb 0.34 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.74 2aj2 n SER 109 CO 0.00 0.00 0.00 -0.54 -1.23 0.00 0.00 175.04 173.27 2aj2 s LYS 111 N 1.15 1.48 0.00 -1.46 1.02 -1.26 -4.96 119.74 115.70 2aj2 s LYS 111 Ca 0.00 -1.22 0.00 0.00 0.02 0.00 0.00 55.97 54.77 2aj2 s LYS 111 Cb 0.00 0.46 0.00 0.00 -0.52 0.00 0.00 37.83 37.77 2aj2 s LYS 111 CO 0.00 -0.61 0.00 0.25 -0.92 0.00 0.00 175.35 174.07 2aj2 n THR 113 N -0.36 0.00 0.54 2.17 -2.24 0.10 -4.97 114.28 109.53 2aj2 n THR 113 Ca -0.03 0.00 0.12 0.00 -2.27 0.00 0.00 64.05 61.87 2aj2 n THR 113 Cb 0.62 -0.02 0.09 0.00 -2.10 0.00 0.00 70.33 68.92 2aj2 n THR 113 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 2aj2 n ASP 114 N 0.00 0.65 -0.00 3.42 10.43 -1.26 -4.20 116.55 125.60 2aj2 n ASP 114 Ca 0.00 -0.03 0.01 0.00 2.57 0.00 0.00 54.79 57.34 2aj2 n ASP 114 Cb 0.00 0.50 -0.02 0.00 1.84 0.00 0.00 41.12 43.44 2aj2 n ASP 114 CO 0.00 0.00 0.00 0.47 -1.07 0.00 0.00 177.20 176.60 2aj2 n ASP 115 N -2.07 1.21 -4.05 -2.24 8.00 -1.26 -4.32 116.55 111.82 2aj2 n ASP 115 Ca 0.02 -0.42 -0.21 0.00 0.71 0.00 0.00 54.79 54.89 2aj2 n ASP 115 Cb 0.44 1.03 -0.15 0.00 -0.02 0.00 0.00 41.12 42.42 2aj2 n ASP 115 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2aj2 s ILE 116 N -1.50 0.95 0.14 0.53 1.09 -1.26 -3.58 121.20 117.57 2aj2 s ILE 116 Ca 0.01 -0.47 -0.19 0.00 -1.10 0.00 0.00 60.65 58.89 2aj2 s ILE 116 Cb 0.02 -0.82 0.05 0.00 -1.06 0.00 0.00 42.46 40.65 2aj2 s ILE 116 CO 0.12 0.28 0.50 0.00 -0.10 0.00 0.00 174.94 175.74 2aj2 s ALA 117 N 0.01 -1.25 -0.12 9.38 0.00 0.28 -0.72 121.76 129.33 2aj2 s ALA 117 Ca -0.01 0.21 0.01 0.00 0.00 0.00 0.00 51.96 52.18 2aj2 s ALA 117 Cb -0.08 0.79 0.02 0.00 0.00 0.00 0.00 23.12 23.85 2aj2 s ALA 117 CO 0.00 -0.71 -0.15 0.08 0.00 0.00 0.00 175.76 174.98 2aj2 s VAL 118 N -3.78 1.55 -0.12 0.00 1.01 -1.26 -1.01 120.40 116.79 2aj2 s VAL 118 Ca 0.02 -0.66 -0.01 0.00 0.00 0.00 0.00 61.98 61.34 2aj2 s VAL 118 Cb 0.00 -1.42 -0.02 0.00 0.00 0.00 0.00 36.38 34.94 2aj2 s VAL 118 CO -0.12 0.45 -0.09 -0.89 0.00 0.00 0.00 175.10 174.45 2aj2 s THR 119 N 1.13 3.48 -0.04 3.92 2.01 0.11 -4.39 115.64 121.86 2aj2 s THR 119 Ca -0.03 -0.52 0.06 0.00 0.31 0.00 0.00 61.69 61.51 2aj2 s THR 119 Cb -0.14 -2.47 0.09 0.00 0.01 0.00 0.00 72.50 69.99 2aj2 s THR 119 CO -0.04 0.54 1.01 0.35 -0.69 0.00 0.00 174.62 175.78 2aj2 n THR 120 N 3.13 1.17 -3.94 -0.82 -2.24 -0.31 -1.21 114.28 110.07 2aj2 n THR 120 Ca -0.18 -1.29 -0.37 0.00 -2.27 0.00 0.00 64.05 59.94 2aj2 n THR 120 Cb 0.53 0.30 -0.06 0.00 -2.10 0.00 0.00 70.33 68.99 2aj2 n THR 120 CO 0.00 0.00 0.00 -0.94 -0.57 0.00 0.00 175.07 173.56 2aj2 s SER 121 N -1.52 6.25 0.41 3.42 1.04 -1.23 -4.94 113.70 117.13 2aj2 s SER 121 Ca 0.10 0.43 0.15 0.00 0.48 0.00 0.00 55.95 57.11 2aj2 s SER 121 Cb 0.09 -2.00 1.02 0.00 0.10 0.00 0.00 66.02 65.23 2aj2 s SER 121 CO 0.01 0.40 1.89 0.07 0.98 0.00 0.00 173.24 176.59 2aj2 h LYS 122 N 4.97 0.45 -0.95 4.02 5.09 -1.96 -2.87 116.57 125.32 2aj2 h LYS 122 Ca -0.54 -0.03 0.17 0.00 0.09 0.00 0.00 60.65 60.34 2aj2 h LYS 122 Cb 1.22 -0.10 -0.17 0.00 0.10 0.00 0.00 32.23 33.28 2aj2 h LYS 122 CO 0.58 0.30 -0.29 -0.40 -2.09 0.00 0.00 179.45 177.55 2aj2 n ASP 123 N -4.50 -0.44 0.03 7.07 5.75 -1.26 0.45 116.55 123.64 2aj2 n ASP 123 Ca 0.17 1.64 0.21 0.00 -0.01 0.00 0.00 54.79 56.79 2aj2 n ASP 123 Cb 0.58 -0.45 0.73 0.00 -1.03 0.00 0.00 41.12 40.94 2aj2 n ASP 123 CO 0.00 0.00 0.00 -0.29 -0.11 0.00 0.00 177.20 176.80 2aj2 h ILE 124 N 0.00 0.58 0.00 2.12 2.10 -1.92 -1.48 117.51 118.91 2aj2 h ILE 124 Ca 0.41 0.00 -0.02 0.00 1.08 0.00 0.00 64.86 66.33 2aj2 h ILE 124 Cb 0.65 0.70 -0.00 0.00 -1.09 0.00 0.00 36.82 37.07 2aj2 h ILE 124 CO -0.96 0.00 -0.08 -0.07 -1.08 0.00 0.00 178.15 175.96 2aj2 h LEU 125 N 0.00 0.00 -0.66 2.19 3.38 -0.20 -2.66 115.31 117.36 2aj2 h LEU 125 Ca 0.24 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.21 2aj2 h LEU 125 Cb 1.05 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.80 2aj2 h LEU 125 CO -0.00 0.08 0.00 0.71 0.09 0.00 0.00 178.44 179.32 2aj2 h THR 126 N 0.00 0.00 0.00 0.22 1.35 -1.37 -3.16 112.91 109.94 2aj2 h THR 126 Ca -0.00 -0.41 0.00 0.00 -0.55 0.00 0.00 66.41 65.45 2aj2 h THR 126 Cb 0.15 1.28 0.00 0.00 -1.73 0.00 0.00 68.15 67.85 2aj2 h THR 126 CO 0.01 0.00 -1.32 1.33 -0.25 0.00 0.00 175.52 175.29 2aj2 n VAL 127 N -2.50 0.12 -1.73 6.82 0.24 -1.00 -1.74 118.33 118.54 2aj2 n VAL 127 Ca 0.03 -0.30 -0.42 0.00 -2.04 0.00 0.00 64.34 61.60 2aj2 n VAL 127 Cb 0.31 0.25 -0.01 0.00 -1.47 0.00 0.00 33.84 32.92 2aj2 n VAL 127 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87 2aj2 n LEU 128 N -2.03 4.07 0.00 1.34 4.77 -1.20 -1.19 117.00 122.77 2aj2 n LEU 128 Ca 0.00 1.19 0.00 0.00 -0.03 0.00 0.00 56.01 57.17 2aj2 n LEU 128 Cb 0.47 -1.55 0.00 0.00 -2.33 0.00 0.00 43.42 40.01 2aj2 n LEU 128 CO 0.42 -0.13 0.00 0.61 -1.33 0.00 0.00 177.39 176.97 2aj2 n GLY 129 N 1.21 2.73 3.81 -0.72 0.00 -1.26 -4.96 105.19 106.01 2aj2 n GLY 129 Ca 0.06 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.82 2aj2 n GLY 129 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2aj2 s THR 130 N -2.24 4.57 0.63 2.61 -4.23 -0.33 -1.51 115.64 115.13 2aj2 s THR 130 Ca 0.00 -1.06 0.30 0.00 -1.18 0.00 0.00 61.69 59.74 2aj2 s THR 130 Cb 0.00 -3.34 0.34 0.00 1.34 0.00 0.00 72.50 70.84 2aj2 s THR 130 CO 0.00 -0.12 1.94 -0.08 -0.54 0.00 0.00 174.62 175.82 2aj2 h GLU 131 N 2.33 0.00 0.00 3.99 4.57 -1.80 0.26 114.58 123.92 2aj2 h GLU 131 Ca -0.48 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.70 2aj2 h GLU 131 Cb 1.20 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.79 2aj2 h GLU 131 CO 0.63 0.00 0.00 0.00 -1.18 0.00 0.00 179.01 178.46 2aj2 n ALA 132 N -2.12 2.31 -1.80 2.92 0.00 -1.26 -4.84 120.51 115.71 2aj2 n ALA 132 Ca 0.02 -0.13 -0.34 0.00 0.00 0.00 0.00 53.44 52.99 2aj2 n ALA 132 Cb 0.47 -1.40 -0.06 0.00 0.00 0.00 0.00 19.45 18.46 2aj2 n ALA 132 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 2aj2 s GLU 133 N -2.39 4.19 0.27 0.00 -1.05 0.91 -4.90 118.70 115.73 2aj2 s GLU 133 Ca 0.28 1.27 -0.30 0.00 -0.15 0.00 0.00 54.97 56.07 2aj2 s GLU 133 Cb 0.17 -2.32 -0.13 0.00 -0.44 0.00 0.00 34.13 31.40 2aj2 s GLU 133 CO 0.35 -0.08 1.29 -0.35 0.95 0.00 0.00 175.26 177.42 2aj2 n PRO 134 N -0.42 1.88 0.08 -4.83 -0.04 -1.26 -4.83 135.00 125.58 2aj2 n PRO 134 Ca 0.06 0.66 0.05 0.00 -0.04 0.00 0.00 63.50 64.23 2aj2 n PRO 134 Cb 0.52 -2.24 0.25 0.00 -0.04 0.00 0.00 33.50 31.99 2aj2 n PRO 134 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2aj2 n GLU 135 N 1.35 0.06 -3.65 0.54 4.07 -1.26 -4.40 120.64 117.35 2aj2 n GLU 135 Ca 0.09 0.52 -0.06 0.00 -0.06 0.00 0.00 57.16 57.65 2aj2 n GLU 135 Cb 0.32 -1.79 -0.07 0.00 -0.06 0.00 0.00 31.44 29.85 2aj2 n GLU 135 CO 0.00 0.00 0.00 0.20 -0.06 0.00 0.00 177.13 177.27 2aj2 s GLY 136 N -3.11 -0.59 -0.13 8.31 0.00 -1.26 -5.02 107.32 105.50 2aj2 s GLY 136 Ca -0.01 2.21 -0.30 0.00 0.00 0.00 0.00 44.72 46.61 2aj2 s GLY 136 CO 0.08 2.45 0.94 -2.52 0.00 0.00 0.00 173.10 174.05 2aj2 s TYR 137 N 1.96 -0.41 -0.02 1.90 1.13 -1.26 -0.90 117.35 119.75 2aj2 s TYR 137 Ca -0.08 0.68 0.01 0.00 -1.41 0.00 0.00 57.07 56.27 2aj2 s TYR 137 Cb -0.08 0.45 0.01 0.00 -1.10 0.00 0.00 41.96 41.24 2aj2 s TYR 137 CO -0.18 -0.39 -0.04 0.96 -2.51 0.00 0.00 175.55 173.38 2aj2 s ILE 138 N -1.25 0.43 -0.22 -3.49 -4.36 0.00 -5.00 121.20 107.32 2aj2 s ILE 138 Ca -0.03 -0.13 -0.14 0.00 -0.26 0.00 0.00 60.65 60.09 2aj2 s ILE 138 Cb -0.00 -0.43 -0.04 0.00 1.25 0.00 0.00 42.46 43.24 2aj2 s ILE 138 CO 0.02 0.17 0.30 0.54 0.24 0.00 0.00 174.94 176.20 2aj2 s VAL 139 N 0.48 5.27 0.07 8.37 0.11 -1.26 -1.38 120.40 132.06 2aj2 s VAL 139 Ca -0.06 0.48 0.07 0.00 -2.93 0.00 0.00 61.98 59.55 2aj2 s VAL 139 Cb -0.09 -3.63 -0.04 0.00 -1.53 0.00 0.00 36.38 31.09 2aj2 s VAL 139 CO -0.00 0.29 -0.15 0.00 -3.33 0.00 0.00 175.10 171.91 2aj2 s ALA 140 N 1.19 2.75 -0.22 1.54 0.00 -0.35 0.26 121.76 126.92 2aj2 s ALA 140 Ca 0.14 -1.23 -0.01 0.00 0.00 0.00 0.00 51.96 50.87 2aj2 s ALA 140 Cb -0.14 -0.80 0.02 0.00 0.00 0.00 0.00 23.12 22.20 2aj2 s ALA 140 CO 0.06 0.60 -0.11 -0.51 0.00 0.00 0.00 175.76 175.81 2aj2 s LEU 141 N -1.80 2.84 0.00 0.00 1.43 -0.73 -0.93 118.68 119.48 2aj2 s LEU 141 Ca 0.17 -0.78 0.00 0.00 -1.03 0.00 0.00 54.13 52.49 2aj2 s LEU 141 Cb -0.11 -1.61 0.00 0.00 0.03 0.00 0.00 46.19 44.51 2aj2 s LEU 141 CO 0.09 -0.08 0.00 0.61 0.23 0.00 0.00 176.35 177.20 2aj2 n GLY 142 N 4.65 -1.57 3.27 -3.19 0.00 -0.10 -1.69 105.19 106.55 2aj2 n GLY 142 Ca -0.18 -1.56 -0.17 0.00 0.00 0.00 0.00 46.02 44.11 2aj2 n GLY 142 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2aj2 s TYR 143 N -2.47 1.54 -0.24 1.61 1.13 -0.30 -2.61 117.35 116.01 2aj2 s TYR 143 Ca 0.00 -1.56 -0.09 0.00 -1.41 0.00 0.00 57.07 54.01 2aj2 s TYR 143 Cb 0.00 -0.64 -0.04 0.00 -1.10 0.00 0.00 41.96 40.18 2aj2 s TYR 143 CO 0.00 -0.81 0.12 -1.12 -2.51 0.00 0.00 175.55 171.23 2aj2 s SER 144 N -3.30 5.71 0.16 -0.18 0.01 0.19 -1.72 113.70 114.57 2aj2 s SER 144 Ca 0.40 -0.01 0.11 0.00 1.31 0.00 0.00 55.95 57.76 2aj2 s SER 144 Cb 0.04 -2.02 -0.04 0.00 0.21 0.00 0.00 66.02 64.20 2aj2 s SER 144 CO 0.23 0.04 -0.25 -0.83 0.41 0.00 0.00 173.24 172.83 2aj2 s GLY 145 N 1.20 1.61 0.04 3.44 0.00 -1.26 0.29 107.32 112.63 2aj2 s GLY 145 Ca 0.06 -1.53 0.03 0.00 0.00 0.00 0.00 44.72 43.28 2aj2 s GLY 145 CO 0.05 -1.53 -0.10 -0.98 0.00 0.00 0.00 173.10 170.53 2aj2 s TRP 146 N -1.34 0.89 0.92 1.90 0.51 -0.34 -4.99 118.94 116.48 2aj2 s TRP 146 Ca 0.16 -0.37 -0.13 0.00 -2.12 0.00 0.00 56.10 53.65 2aj2 s TRP 146 Cb -0.09 -0.53 0.19 0.00 -0.81 0.00 0.00 33.47 32.23 2aj2 s TRP 146 CO 0.07 -0.01 1.26 -1.12 -0.51 0.00 0.00 176.95 176.64 2aj2 s SER 147 N -1.18 3.28 -0.07 2.95 0.01 -1.26 -2.41 113.70 115.02 2aj2 s SER 147 Ca -0.03 0.05 -0.36 0.00 1.31 0.00 0.00 55.95 56.92 2aj2 s SER 147 Cb -0.08 -0.13 -0.14 0.00 0.21 0.00 0.00 66.02 65.89 2aj2 s SER 147 CO 0.01 -2.60 1.72 0.00 0.41 0.00 0.00 173.24 172.77 2aj2 n ALA 148 N -3.58 0.45 0.00 1.44 0.00 -0.68 -1.54 120.51 116.60 2aj2 n ALA 148 Ca 0.16 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.97 2aj2 n ALA 148 Cb 0.60 -2.34 0.00 0.00 0.00 0.00 0.00 19.45 17.70 2aj2 n ALA 148 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2aj2 n GLY 149 N 3.91 0.95 0.43 0.00 0.00 -1.26 -4.74 105.19 104.48 2aj2 n GLY 149 Ca 0.22 0.00 0.31 0.00 0.00 0.00 0.00 46.02 46.55 2aj2 n GLY 149 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 2aj2 h GLN 150 N 0.12 0.19 -0.23 1.61 1.08 -1.63 0.39 115.11 116.64 2aj2 h GLN 150 Ca 0.00 -0.01 -0.14 0.00 -1.45 0.00 0.00 58.65 57.05 2aj2 h GLN 150 Cb 0.00 -0.04 -0.00 0.00 -0.05 0.00 0.00 27.48 27.39 2aj2 h GLN 150 CO 0.00 0.13 -0.38 1.25 -0.95 0.00 0.00 178.83 178.87 2aj2 h LEU 151 N 0.20 0.74 -1.51 1.46 5.85 -1.85 -2.91 115.31 117.28 2aj2 h LEU 151 Ca 0.74 -0.53 0.23 0.00 0.84 0.00 0.00 57.88 59.17 2aj2 h LEU 151 Cb 2.15 -0.21 -0.07 0.00 0.37 0.00 0.00 40.66 42.89 2aj2 h LEU 151 CO -0.41 1.12 0.63 -0.33 -0.34 0.00 0.00 178.44 179.12 2aj2 h GLU 152 N 0.37 0.36 0.00 1.25 3.07 -0.58 0.41 114.58 119.46 2aj2 h GLU 152 Ca 0.02 -0.02 -0.17 0.00 -0.50 0.00 0.00 59.36 58.68 2aj2 h GLU 152 Cb 0.98 -0.08 -0.03 0.00 -0.84 0.00 0.00 28.75 28.78 2aj2 h GLU 152 CO 0.09 0.24 -0.86 -0.24 -1.40 0.00 0.00 179.01 176.84 2aj2 h VAL 153 N 0.37 1.29 -0.11 3.13 3.04 -1.32 -3.27 116.25 119.38 2aj2 h VAL 153 Ca 0.51 -2.86 -0.05 0.00 -1.01 0.00 0.00 66.70 63.29 2aj2 h VAL 153 Cb 1.34 2.63 -0.01 0.00 -2.01 0.00 0.00 31.29 33.24 2aj2 h VAL 153 CO -0.20 0.73 -0.16 -0.33 -1.01 0.00 0.00 177.57 176.60 2aj2 h GLU 154 N 0.00 0.18 -0.40 4.17 5.08 -0.73 -2.89 114.58 119.98 2aj2 h GLU 154 Ca -0.03 -0.04 -0.04 0.00 -1.00 0.00 0.00 59.36 58.25 2aj2 h GLU 154 Cb 1.62 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 30.83 2aj2 h GLU 154 CO 0.10 0.35 0.10 -0.07 -1.00 0.00 0.00 179.01 178.48 2aj2 h LEU 155 N 0.17 0.61 0.00 1.33 3.38 -1.54 -1.93 115.31 117.32 2aj2 h LEU 155 Ca 0.03 -0.23 0.00 0.00 0.09 0.00 0.00 57.88 57.77 2aj2 h LEU 155 Cb 0.40 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.98 2aj2 h LEU 155 CO 0.03 0.69 0.00 0.35 0.09 0.00 0.00 178.44 179.59 2aj2 n THR 156 N -4.56 0.38 -3.30 0.22 -2.24 -1.09 -4.63 114.28 99.06 2aj2 n THR 156 Ca -0.00 0.10 -0.18 0.00 -2.27 0.00 0.00 64.05 61.69 2aj2 n THR 156 Cb 0.21 -0.96 0.00 0.00 -2.10 0.00 0.00 70.33 67.47 2aj2 n THR 156 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2aj2 s GLU 157 N -2.26 3.01 -0.43 -0.78 2.02 -0.73 -5.00 118.70 114.53 2aj2 s GLU 157 Ca 0.10 -1.10 -0.05 0.00 0.02 0.00 0.00 54.97 53.94 2aj2 s GLU 157 Cb 0.06 -2.79 -0.05 0.00 0.10 0.00 0.00 34.13 31.45 2aj2 s GLU 157 CO 0.11 -0.06 3.03 0.09 0.02 0.00 0.00 175.26 178.45 2aj2 n ASN 158 N -1.71 6.30 -0.07 -0.19 3.02 -1.26 -4.27 115.26 117.07 2aj2 n ASN 158 Ca 0.03 -2.94 -0.15 0.00 -0.03 0.00 0.00 54.58 51.49 2aj2 n ASN 158 Cb 0.58 -1.32 -0.05 0.00 -0.61 0.00 0.00 39.78 38.38 2aj2 n ASN 158 CO 0.00 0.00 0.00 -1.20 -2.62 0.00 0.00 177.26 173.44 2aj2 n SER 159 N 1.59 1.25 -4.51 6.41 7.64 -1.26 -4.66 113.62 120.08 2aj2 n SER 159 Ca 0.49 0.14 -0.24 0.00 1.01 0.00 0.00 58.87 60.28 2aj2 n SER 159 Cb 0.63 -0.39 -0.11 0.00 -1.01 0.00 0.00 64.21 63.33 2aj2 n SER 159 CO 0.00 0.00 0.00 0.26 -3.01 0.00 0.00 175.04 172.29 2aj2 s TRP 160 N -2.26 2.17 0.06 1.43 0.52 -1.26 -4.50 118.94 115.10 2aj2 s TRP 160 Ca -0.20 -0.82 -0.05 0.00 0.02 0.00 0.00 56.10 55.06 2aj2 s TRP 160 Cb 0.07 -1.44 -0.02 0.00 -1.15 0.00 0.00 33.47 30.93 2aj2 s TRP 160 CO 0.26 0.21 0.08 -0.51 0.02 0.00 0.00 176.95 177.00 2aj2 s LEU 161 N -3.56 1.97 0.04 2.99 1.43 -0.83 -4.94 118.68 115.77 2aj2 s LEU 161 Ca 0.35 -0.80 0.00 0.00 -1.03 0.00 0.00 54.13 52.66 2aj2 s LEU 161 Cb 0.09 0.59 -0.03 0.00 0.03 0.00 0.00 46.19 46.87 2aj2 s LEU 161 CO 0.16 -0.64 -0.04 0.42 0.23 0.00 0.00 176.35 176.48 2aj2 s THR 162 N -3.72 0.24 -0.04 5.49 -4.23 -1.26 -1.35 115.64 110.77 2aj2 s THR 162 Ca 0.05 -1.30 -0.24 0.00 -1.18 0.00 0.00 61.69 59.01 2aj2 s THR 162 Cb 0.05 -0.82 0.05 0.00 1.34 0.00 0.00 72.50 73.12 2aj2 s THR 162 CO -0.10 -0.68 0.53 -0.51 -0.54 0.00 0.00 174.62 173.32 2aj2 s ILE 163 N -2.42 0.02 0.67 2.99 1.10 -1.24 -5.02 121.20 117.30 2aj2 s ILE 163 Ca -0.06 -0.19 -0.17 0.00 -0.51 0.00 0.00 60.65 59.72 2aj2 s ILE 163 Cb -0.03 -0.84 -0.01 0.00 0.15 0.00 0.00 42.46 41.74 2aj2 s ILE 163 CO -0.04 -0.10 1.12 1.21 -2.11 0.00 0.00 174.94 175.01 2aj2 n GLU 164 N 1.14 0.81 -3.16 3.50 2.13 -1.26 -1.93 120.64 121.87 2aj2 n GLU 164 Ca -0.20 0.33 -0.28 0.00 0.66 0.00 0.00 57.16 57.67 2aj2 n GLU 164 Cb 0.57 -2.35 -0.02 0.00 0.27 0.00 0.00 31.44 29.90 2aj2 n GLU 164 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2aj2 s ALA 165 N -1.60 3.56 -0.03 4.31 0.00 -0.94 -4.69 121.76 122.38 2aj2 s ALA 165 Ca 0.78 -0.54 0.03 0.00 0.00 0.00 0.00 51.96 52.23 2aj2 s ALA 165 Cb -0.37 -2.38 -0.00 0.00 0.00 0.00 0.00 23.12 20.37 2aj2 s ALA 165 CO 0.45 0.08 -0.11 0.16 0.00 0.00 0.00 175.76 176.34 2aj2 s ASP 166 N -3.41 1.44 0.33 0.00 -4.77 -1.26 -5.02 116.67 103.98 2aj2 s ASP 166 Ca 0.45 -0.23 0.08 0.00 -3.30 0.00 0.00 52.55 49.56 2aj2 s ASP 166 Cb -0.10 -0.34 0.79 0.00 -1.09 0.00 0.00 42.92 42.18 2aj2 s ASP 166 CO 0.33 0.10 1.82 1.55 0.70 0.00 0.00 175.17 179.67 2aj2 h PRO 167 N 6.25 0.70 -0.99 2.11 0.13 -1.99 -2.64 132.00 135.57 2aj2 h PRO 167 Ca -0.33 -0.04 0.12 0.00 -0.87 0.00 0.00 66.00 64.88 2aj2 h PRO 167 Cb 1.17 -0.16 -0.09 0.00 0.13 0.00 0.00 31.00 32.06 2aj2 h PRO 167 CO 0.49 0.46 0.61 0.93 -0.23 0.00 0.00 178.00 180.26 2aj2 h GLU 168 N 0.72 0.93 0.00 0.86 3.07 -1.97 0.21 114.58 118.40 2aj2 h GLU 168 Ca 0.51 -0.06 -0.01 0.00 -0.50 0.00 0.00 59.36 59.31 2aj2 h GLU 168 Cb 0.84 -0.21 -0.00 0.00 -0.84 0.00 0.00 28.75 28.54 2aj2 h GLU 168 CO -0.28 0.61 -0.04 1.25 -1.40 0.00 0.00 179.01 179.15 2aj2 h LEU 169 N 0.96 0.00 0.03 1.33 7.12 -1.84 0.21 115.31 123.11 2aj2 h LEU 169 Ca 0.50 0.00 -0.37 0.00 0.13 0.00 0.00 57.88 58.13 2aj2 h LEU 169 Cb 0.51 0.00 -0.05 0.00 -0.53 0.00 0.00 40.66 40.59 2aj2 h LEU 169 CO -0.28 0.04 -2.11 -0.38 -0.13 0.00 0.00 178.44 175.59 2aj2 n ILE 170 N -3.46 1.58 -1.01 4.05 5.41 0.57 -4.60 119.36 121.90 2aj2 n ILE 170 Ca -0.02 -0.41 0.08 0.00 1.00 0.00 0.00 62.75 63.40 2aj2 n ILE 170 Cb 0.16 -1.77 0.26 0.00 -0.71 0.00 0.00 39.64 37.58 2aj2 n ILE 170 CO 0.00 0.00 0.00 0.49 0.00 0.00 0.00 176.55 177.04 2aj2 n PHE 171 N -3.88 0.96 0.15 1.39 3.72 -0.18 -4.88 117.46 114.75 2aj2 n PHE 171 Ca -0.42 -0.90 0.00 0.00 -0.05 0.00 0.00 57.45 56.08 2aj2 n PHE 171 Cb 0.90 -0.32 0.00 0.00 -0.94 0.00 0.00 39.48 39.12 2aj2 n PHE 171 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 2aj2 n ASN 172 N -0.52 -0.93 -4.75 4.37 4.13 -0.00 -4.90 115.26 112.66 2aj2 n ASN 172 Ca 0.22 0.53 -0.42 0.00 1.68 0.00 0.00 54.58 56.59 2aj2 n ASN 172 Cb 0.90 1.05 -0.02 0.00 -1.54 0.00 0.00 39.78 40.17 2aj2 n ASN 172 CO 0.00 0.00 0.00 0.28 0.28 0.00 0.00 177.26 177.82 2aj2 s THR 173 N -1.88 2.14 0.54 3.41 -1.32 -0.79 -4.91 115.64 112.84 2aj2 s THR 173 Ca 0.00 0.12 -0.19 0.00 -1.21 0.00 0.00 61.69 60.41 2aj2 s THR 173 Cb 0.00 -3.08 -0.09 0.00 -1.51 0.00 0.00 72.50 67.82 2aj2 s THR 173 CO 0.00 0.02 0.53 -2.65 -2.21 0.00 0.00 174.62 170.30 2aj2 n PRO 174 N 2.45 0.54 0.05 7.08 -0.02 -1.26 -4.71 135.00 139.13 2aj2 n PRO 174 Ca 0.09 0.21 -0.12 0.00 -2.02 0.00 0.00 63.50 61.66 2aj2 n PRO 174 Cb 0.37 -1.67 -0.05 0.00 -0.02 0.00 0.00 33.50 32.13 2aj2 n PRO 174 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 2aj2 h VAL 175 N 0.35 0.28 0.00 -1.45 2.07 -1.94 -1.36 116.25 114.20 2aj2 h VAL 175 Ca -0.45 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.07 2aj2 h VAL 175 Cb 1.40 0.28 0.00 0.00 -1.52 0.00 0.00 31.29 31.44 2aj2 h VAL 175 CO 0.48 0.00 0.24 1.41 0.02 0.00 0.00 177.57 179.71 2aj2 n HIS 176 N -5.42 0.30 0.32 1.57 8.25 -1.26 -1.24 115.22 117.73 2aj2 n HIS 176 Ca -0.05 0.15 0.04 0.00 -0.26 0.00 0.00 57.72 57.60 2aj2 n HIS 176 Cb 0.33 -0.57 -0.05 0.00 1.12 0.00 0.00 29.99 30.83 2aj2 n HIS 176 CO 0.00 0.00 0.00 0.39 0.64 0.00 0.00 176.34 177.37 2aj2 n GLU 177 N -1.79 3.75 -0.27 -0.41 1.02 -0.55 -4.61 120.64 117.78 2aj2 n GLU 177 Ca -0.01 -0.01 0.08 0.00 -0.02 0.00 0.00 57.16 57.21 2aj2 n GLU 177 Cb 0.25 -0.92 0.22 0.00 -0.02 0.00 0.00 31.44 30.97 2aj2 n GLU 177 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 2aj2 h LYS 178 N 0.00 0.30 0.02 3.49 1.57 -0.78 0.23 116.57 121.41 2aj2 h LYS 178 Ca 0.00 -0.02 -0.00 0.00 -1.87 0.00 0.00 60.65 58.76 2aj2 h LYS 178 Cb 0.22 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.46 2aj2 h LYS 178 CO 0.00 0.20 -0.01 2.35 -0.57 0.00 0.00 179.45 181.42 2aj2 h TRP 179 N 0.31 -0.02 -1.01 -1.35 7.01 -1.83 -2.74 115.95 116.33 2aj2 h TRP 179 Ca 0.47 -0.00 0.23 0.00 2.11 0.00 0.00 58.89 61.70 2aj2 h TRP 179 Cb 0.83 0.01 -0.11 0.00 -2.10 0.00 0.00 29.16 27.79 2aj2 h TRP 179 CO -0.23 0.76 0.62 0.37 -2.79 0.00 0.00 178.44 177.17 2aj2 h GLN 180 N -0.92 0.56 0.00 2.65 4.15 -1.73 0.29 115.11 120.12 2aj2 h GLN 180 Ca -0.00 -0.03 -0.11 0.00 0.77 0.00 0.00 58.65 59.28 2aj2 h GLN 180 Cb 0.78 -0.13 -0.02 0.00 0.21 0.00 0.00 27.48 28.33 2aj2 h GLN 180 CO 0.00 0.37 -0.67 -0.22 -1.93 0.00 0.00 178.83 176.39 2aj2 h LYS 181 N 0.57 0.00 0.54 1.69 3.64 -0.64 -3.03 116.57 119.34 2aj2 h LYS 181 Ca 0.60 0.00 -0.03 0.00 -1.27 0.00 0.00 60.65 59.95 2aj2 h LYS 181 Cb 1.20 0.00 0.01 0.00 -0.41 0.00 0.00 32.23 33.03 2aj2 h LYS 181 CO -0.37 0.40 -0.26 0.00 -2.27 0.00 0.00 179.45 176.95 2aj2 h ALA 182 N 1.54 -0.75 -0.93 5.00 0.00 -0.13 -1.18 119.26 122.82 2aj2 h ALA 182 Ca -0.03 -0.16 0.06 0.00 0.00 0.00 0.00 54.91 54.78 2aj2 h ALA 182 Cb 1.38 0.28 -0.06 0.00 0.00 0.00 0.00 17.79 19.39 2aj2 h ALA 182 CO 0.05 -0.70 0.59 -0.84 0.00 0.00 0.00 179.25 178.35 2aj2 h ILE 183 N -1.16 1.07 -0.59 0.00 3.07 -1.45 0.21 117.51 118.66 2aj2 h ILE 183 Ca -0.07 -0.37 0.09 0.00 1.55 0.00 0.00 64.86 66.06 2aj2 h ILE 183 Cb 0.56 -0.10 -0.04 0.00 -0.27 0.00 0.00 36.82 36.97 2aj2 h ILE 183 CO 0.12 0.20 0.40 1.56 -1.05 0.00 0.00 178.15 179.37 2aj2 h GLN 184 N 1.07 0.44 0.00 0.16 4.20 -1.45 1.02 115.11 120.55 2aj2 h GLN 184 Ca 0.40 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 59.08 2aj2 h GLN 184 Cb 0.16 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 27.84 2aj2 h GLN 184 CO -0.17 0.29 0.00 -0.22 -0.67 0.00 0.00 178.83 178.06 2aj2 h LYS 185 N 0.45 0.00 -0.77 1.46 3.64 0.70 -0.80 116.57 121.26 2aj2 h LYS 185 Ca 0.27 0.00 -0.19 0.00 -1.27 0.00 0.00 60.65 59.46 2aj2 h LYS 185 Cb 0.47 0.00 -0.11 0.00 -0.41 0.00 0.00 32.23 32.17 2aj2 h LYS 185 CO -0.08 0.00 0.24 1.28 -2.27 0.00 0.00 179.45 178.62 2aj2 n LEU 186 N -2.68 5.78 -3.04 5.20 4.77 0.35 -4.90 117.00 122.47 2aj2 n LEU 186 Ca 0.00 -3.00 -0.22 0.00 -0.03 0.00 0.00 56.01 52.76 2aj2 n LEU 186 Cb 0.20 -0.73 0.03 0.00 -2.33 0.00 0.00 43.42 40.59 2aj2 n LEU 186 CO 0.21 0.76 -0.02 0.61 -1.33 0.00 0.00 177.39 177.61 2aj2 n GLY 187 N -0.05 -0.52 3.12 -0.72 0.00 -0.31 -4.98 105.19 101.74 2aj2 n GLY 187 Ca 0.37 0.12 -0.08 0.00 0.00 0.00 0.00 46.02 46.42 2aj2 n GLY 187 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 2aj2 s ILE 188 N -3.12 0.25 -0.02 -0.61 -4.36 -1.01 -5.02 121.20 107.30 2aj2 s ILE 188 Ca 0.30 -1.85 -0.02 0.00 -0.26 0.00 0.00 60.65 58.82 2aj2 s ILE 188 Cb -0.14 -1.68 0.01 0.00 1.25 0.00 0.00 42.46 41.89 2aj2 s ILE 188 CO 0.37 -0.84 0.06 -0.44 0.24 0.00 0.00 174.94 174.34 2aj2 s SER 189 N -2.97 -0.06 0.97 4.36 0.01 -1.26 -3.07 113.70 111.68 2aj2 s SER 189 Ca 0.12 0.13 -0.17 0.00 1.31 0.00 0.00 55.95 57.34 2aj2 s SER 189 Cb 0.08 0.12 -0.13 0.00 0.21 0.00 0.00 66.02 66.30 2aj2 s SER 189 CO -0.06 -0.03 -0.62 -2.65 0.41 0.00 0.00 173.24 170.29 2aj2 n PRO 190 N 3.09 -0.03 0.00 12.44 -0.02 -1.26 -4.92 135.00 144.30 2aj2 n PRO 190 Ca -0.13 -0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.35 2aj2 n PRO 190 Cb 0.59 -1.11 0.00 0.00 -0.02 0.00 0.00 33.50 32.96 2aj2 n PRO 190 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2aj2 n ALA 191 N -2.59 0.00 0.00 3.55 0.00 -1.26 -5.17 120.51 115.03 2aj2 n ALA 191 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2aj2 n ALA 191 Cb 0.55 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.00 2aj2 n ALA 191 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54