#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1eej h ASP 2 N 0.00 0.35 -0.40 -1.12 5.19 -2.00 -2.59 116.42 115.85 1eej h ASP 2 Ca 0.00 0.08 0.03 0.00 -0.62 0.00 0.00 57.03 56.52 1eej h ASP 2 Cb 0.00 0.03 -0.03 0.00 0.18 0.00 0.00 39.33 39.51 1eej h ASP 2 CO 0.00 0.19 0.20 0.00 -3.12 0.00 0.00 179.24 176.50 1eej h ALA 3 N 1.45 0.49 -0.40 3.45 0.00 -1.98 0.70 119.26 122.97 1eej h ALA 3 Ca 0.35 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.26 1eej h ALA 3 Cb 0.43 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 1eej h ALA 3 CO -0.31 -0.17 0.17 0.00 0.00 0.00 0.00 179.25 178.94 1eej h ALA 4 N 1.21 0.52 -0.68 0.00 0.00 -1.77 -0.64 119.26 117.90 1eej h ALA 4 Ca 0.17 -0.13 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 1eej h ALA 4 Cb 0.08 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 1eej h ALA 4 CO -0.12 0.11 0.17 0.82 0.00 0.00 0.00 179.25 180.23 1eej h ILE 5 N 0.50 1.26 -0.38 0.00 2.04 -1.21 -2.05 117.51 117.67 1eej h ILE 5 Ca 0.13 -0.94 -0.09 0.00 1.00 0.00 0.00 64.86 64.96 1eej h ILE 5 Cb 0.17 0.57 -0.02 0.00 -0.74 0.00 0.00 36.82 36.80 1eej h ILE 5 CO -0.01 0.36 -0.15 1.56 0.00 0.00 0.00 178.15 179.91 1eej h GLN 6 N 1.02 0.70 -0.27 2.37 4.20 -0.64 -1.70 115.11 120.77 1eej h GLN 6 Ca 0.22 -0.24 -0.14 0.00 0.06 0.00 0.00 58.65 58.54 1eej h GLN 6 Cb 0.36 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.07 1eej h GLN 6 CO 0.00 0.82 -0.42 1.96 -0.67 0.00 0.00 178.83 180.52 1eej h GLN 7 N 0.63 0.66 -0.31 1.46 4.20 -0.91 -0.96 115.11 119.88 1eej h GLN 7 Ca 0.10 -0.35 -0.07 0.00 0.06 0.00 0.00 58.65 58.39 1eej h GLN 7 Cb 0.62 0.01 -0.01 0.00 0.30 0.00 0.00 27.48 28.40 1eej h GLN 7 CO 0.04 0.96 -0.07 1.15 -0.67 0.00 0.00 178.83 180.24 1eej h THR 8 N 0.54 1.28 -0.51 -0.54 2.02 -1.20 -1.64 112.91 112.86 1eej h THR 8 Ca 0.04 -1.12 -0.04 0.00 0.77 0.00 0.00 66.41 66.07 1eej h THR 8 Cb 0.95 1.36 -0.02 0.00 -1.74 0.00 0.00 68.15 68.70 1eej h THR 8 CO 0.09 0.36 0.16 -0.07 0.37 0.00 0.00 175.52 176.42 1eej h LEU 9 N 0.38 0.69 -0.79 2.58 3.38 -1.23 -2.13 115.31 118.18 1eej h LEU 9 Ca 0.08 -0.10 -0.06 0.00 0.09 0.00 0.00 57.88 57.89 1eej h LEU 9 Cb 0.56 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.10 1eej h LEU 9 CO 0.03 0.66 0.20 0.00 0.09 0.00 0.00 178.44 179.42 1eej h ALA 10 N 1.44 1.01 -0.14 1.53 0.00 -0.91 0.11 119.26 122.31 1eej h ALA 10 Ca 0.17 -0.23 0.04 0.00 0.00 0.00 0.00 54.91 54.89 1eej h ALA 10 Cb 0.22 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.73 1eej h ALA 10 CO -0.01 0.65 0.10 0.87 0.00 0.00 0.00 179.25 180.87 1eej h LYS 11 N 1.06 0.00 -0.50 0.00 1.57 -0.62 0.69 116.57 118.77 1eej h LYS 11 Ca 0.23 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.01 1eej h LYS 11 Cb 0.33 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.64 1eej h LYS 11 CO -0.00 0.00 0.00 -1.33 -0.57 0.00 0.00 179.45 177.55 1eej n MET 12 N -4.48 2.29 -1.38 3.15 2.81 -0.83 -4.90 117.12 113.78 1eej n MET 12 Ca 0.00 -1.99 -0.13 0.00 -1.81 0.00 0.00 57.70 53.78 1eej n MET 12 Cb 0.22 -1.45 -0.06 0.00 -0.71 0.00 0.00 33.22 31.23 1eej n MET 12 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1eej n GLY 13 N 1.39 1.36 3.85 3.03 0.00 0.23 -4.97 105.19 110.08 1eej n GLY 13 Ca 0.19 -0.23 -0.37 0.00 0.00 0.00 0.00 46.02 45.60 1eej n GLY 13 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1eej s ILE 14 N -2.37 5.17 -0.18 -0.61 1.01 0.33 -4.99 121.20 119.55 1eej s ILE 14 Ca 0.00 0.63 -0.05 0.00 0.00 0.00 0.00 60.65 61.23 1eej s ILE 14 Cb 0.00 -3.62 -0.03 0.00 0.01 0.00 0.00 42.46 38.82 1eej s ILE 14 CO 0.00 0.57 0.01 -1.59 0.00 0.00 0.00 174.94 173.93 1eej s LYS 15 N -1.13 3.75 0.12 2.79 -2.85 -1.26 -3.80 119.74 117.35 1eej s LYS 15 Ca 0.22 -0.47 -0.25 0.00 -1.00 0.00 0.00 55.97 54.47 1eej s LYS 15 Cb -0.15 -3.07 -0.07 0.00 -2.06 0.00 0.00 37.83 32.48 1eej s LYS 15 CO 0.11 0.16 0.78 0.45 0.10 0.00 0.00 175.35 176.96 1eej s SER 16 N 0.62 7.33 -0.08 0.03 0.15 -1.26 -3.03 113.70 117.46 1eej s SER 16 Ca 0.00 1.58 0.20 0.00 0.70 0.00 0.00 55.95 58.44 1eej s SER 16 Cb -0.14 -2.49 -0.29 0.00 -1.71 0.00 0.00 66.02 61.39 1eej s SER 16 CO 0.02 0.12 0.38 -0.24 1.20 0.00 0.00 173.24 174.71 1eej n SER 17 N 2.13 0.06 -3.53 5.45 2.88 0.11 -4.98 113.62 115.75 1eej n SER 17 Ca -0.04 0.02 0.03 0.00 -1.33 0.00 0.00 58.87 57.56 1eej n SER 17 Cb 0.49 1.55 -0.06 0.00 -0.75 0.00 0.00 64.21 65.45 1eej n SER 17 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1eej s ASP 18 N -4.91 -0.04 -0.34 -3.46 2.15 -1.09 -4.99 116.67 104.00 1eej s ASP 18 Ca -0.08 0.06 -0.11 0.00 0.43 0.00 0.00 52.55 52.85 1eej s ASP 18 Cb 0.11 1.02 -0.00 0.00 -0.30 0.00 0.00 42.92 43.75 1eej s ASP 18 CO 0.88 -0.01 0.19 -0.63 -0.17 0.00 0.00 175.17 175.43 1eej s ILE 19 N 1.28 4.78 0.36 4.11 1.01 -1.26 -1.58 121.20 129.90 1eej s ILE 19 Ca -0.06 -0.48 0.09 0.00 0.00 0.00 0.00 60.65 60.20 1eej s ILE 19 Cb -0.02 -3.50 -0.06 0.00 0.01 0.00 0.00 42.46 38.89 1eej s ILE 19 CO -0.11 -0.03 -0.03 -1.10 0.00 0.00 0.00 174.94 173.67 1eej s GLN 20 N 1.63 1.94 0.89 2.79 -1.52 0.95 -4.97 119.66 121.37 1eej s GLN 20 Ca 0.04 -1.90 -0.11 0.00 -1.95 0.00 0.00 55.36 51.44 1eej s GLN 20 Cb -0.18 -1.78 0.13 0.00 -0.22 0.00 0.00 33.01 30.96 1eej s GLN 20 CO 0.07 0.10 1.09 -2.14 -0.25 0.00 0.00 175.29 174.16 1eej s PRO 21 N -3.67 1.29 0.07 2.91 0.02 -1.26 0.09 135.00 134.45 1eej s PRO 21 Ca 0.34 1.01 0.06 0.00 0.02 0.00 0.00 61.00 62.43 1eej s PRO 21 Cb 0.03 -1.80 -0.03 0.00 0.02 0.00 0.00 34.50 32.72 1eej s PRO 21 CO 0.18 -2.27 -0.16 0.00 -0.33 0.00 0.00 177.00 174.42 1eej s ALA 22 N -2.85 1.30 -2.00 -1.55 0.00 -1.25 -3.86 121.76 111.55 1eej s ALA 22 Ca 0.64 -1.02 0.06 0.00 0.00 0.00 0.00 51.96 51.64 1eej s ALA 22 Cb -0.19 -0.14 0.38 0.00 0.00 0.00 0.00 23.12 23.17 1eej s ALA 22 CO 0.57 0.22 0.90 -0.35 0.00 0.00 0.00 175.76 177.10 1eej n PRO 23 N 1.35 0.59 -4.58 0.00 -0.04 -1.26 -4.56 135.00 126.49 1eej n PRO 23 Ca -0.20 0.00 -0.33 0.00 -0.04 0.00 0.00 63.50 62.93 1eej n PRO 23 Cb 0.54 -1.17 -0.16 0.00 -0.04 0.00 0.00 33.50 32.67 1eej n PRO 23 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1eej s VAL 24 N -2.00 2.23 0.52 0.52 1.01 -1.26 -5.11 120.40 116.31 1eej s VAL 24 Ca 0.10 -0.92 -0.23 0.00 0.00 0.00 0.00 61.98 60.93 1eej s VAL 24 Cb 0.04 -1.91 -0.06 0.00 0.00 0.00 0.00 36.38 34.46 1eej s VAL 24 CO 0.07 0.54 1.39 0.00 0.00 0.00 0.00 175.10 177.10 1eej s ALA 25 N 0.86 2.93 0.00 5.51 0.00 -1.26 -3.16 121.76 126.64 1eej s ALA 25 Ca -0.05 1.39 0.00 0.00 0.00 0.00 0.00 51.96 53.29 1eej s ALA 25 Cb -0.15 -3.58 0.00 0.00 0.00 0.00 0.00 23.12 19.39 1eej s ALA 25 CO -0.02 -1.36 0.00 0.41 0.00 0.00 0.00 175.76 174.79 1eej n GLY 26 N 0.69 0.78 3.38 0.00 0.00 -1.26 -5.03 105.19 103.75 1eej n GLY 26 Ca 0.09 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.01 1eej n GLY 26 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1eej s MET 27 N -0.29 1.25 0.13 1.61 0.00 -1.19 -0.33 119.30 120.48 1eej s MET 27 Ca 0.00 -1.22 0.05 0.00 0.00 0.00 0.00 55.69 54.52 1eej s MET 27 Cb 0.00 0.39 -0.04 0.00 0.00 0.00 0.00 34.83 35.18 1eej s MET 27 CO 0.00 -0.47 -0.13 0.15 0.00 0.00 0.00 175.02 174.57 1eej s LYS 28 N -3.99 1.02 -0.27 3.16 -0.14 0.23 -3.95 119.74 115.79 1eej s LYS 28 Ca 0.20 -1.28 -0.20 0.00 -1.36 0.00 0.00 55.97 53.33 1eej s LYS 28 Cb 0.03 -0.81 -0.02 0.00 -1.68 0.00 0.00 37.83 35.35 1eej s LYS 28 CO 0.03 0.14 0.60 0.99 -0.76 0.00 0.00 175.35 176.36 1eej s THR 29 N -2.43 4.99 -0.19 2.17 2.01 0.11 -1.82 115.64 120.47 1eej s THR 29 Ca 0.10 0.97 0.01 0.00 0.31 0.00 0.00 61.69 63.09 1eej s THR 29 Cb -0.03 -3.93 0.03 0.00 0.01 0.00 0.00 72.50 68.57 1eej s THR 29 CO 0.02 -0.02 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.07 1eej s VAL 30 N 2.50 2.01 -0.28 3.82 1.01 0.11 -0.03 120.40 129.53 1eej s VAL 30 Ca 0.25 -1.04 -0.17 0.00 0.00 0.00 0.00 61.98 61.02 1eej s VAL 30 Cb -0.15 -1.89 -0.03 0.00 0.00 0.00 0.00 36.38 34.31 1eej s VAL 30 CO 0.10 0.40 0.47 -0.22 0.00 0.00 0.00 175.10 175.85 1eej s LEU 31 N 1.28 4.10 0.47 3.92 2.96 -0.61 -0.26 118.68 130.54 1eej s LEU 31 Ca 0.02 0.34 0.02 0.00 -0.22 0.00 0.00 54.13 54.29 1eej s LEU 31 Cb -0.14 -2.57 -0.01 0.00 0.50 0.00 0.00 46.19 43.96 1eej s LEU 31 CO -0.11 -0.29 0.07 0.42 -1.32 0.00 0.00 176.35 175.12 1eej s THR 32 N 2.25 0.82 -2.00 3.68 -4.23 -0.33 0.09 115.64 115.92 1eej s THR 32 Ca 0.19 -2.00 0.15 0.00 -1.18 0.00 0.00 61.69 58.84 1eej s THR 32 Cb -0.16 -2.19 0.41 0.00 1.34 0.00 0.00 72.50 71.91 1eej s THR 32 CO 0.10 0.00 1.43 -0.46 -0.54 0.00 0.00 174.62 175.16 1eej n ASN 33 N -1.35 0.00 -0.11 3.99 6.94 -1.17 -1.89 115.26 121.68 1eej n ASN 33 Ca -0.14 -1.20 0.01 0.00 -0.02 0.00 0.00 54.58 53.23 1eej n ASN 33 Cb 0.66 0.00 0.03 0.00 -2.36 0.00 0.00 39.78 38.11 1eej n ASN 33 CO 0.00 0.00 0.00 -1.20 -1.03 0.00 0.00 177.26 175.03 1eej n SER 34 N -0.77 2.16 0.00 0.53 7.64 -1.26 -5.07 113.62 116.84 1eej n SER 34 Ca 0.11 -1.99 0.00 0.00 1.01 0.00 0.00 58.87 58.00 1eej n SER 34 Cb 0.05 -0.04 0.00 0.00 -1.01 0.00 0.00 64.21 63.21 1eej n SER 34 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1eej n GLY 35 N -0.32 -1.53 3.66 0.23 0.00 -0.79 -4.97 105.19 101.48 1eej n GLY 35 Ca 0.02 -2.17 -0.40 0.00 0.00 0.00 0.00 46.02 43.47 1eej n GLY 35 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1eej s VAL 36 N -0.35 5.00 0.13 1.61 1.01 -1.26 -1.19 120.40 125.35 1eej s VAL 36 Ca 0.00 1.25 0.10 0.00 0.00 0.00 0.00 61.98 63.33 1eej s VAL 36 Cb 0.00 -3.97 -0.04 0.00 0.00 0.00 0.00 36.38 32.37 1eej s VAL 36 CO 0.00 0.10 -0.23 -0.76 0.00 0.00 0.00 175.10 174.21 1eej s LEU 37 N 1.96 2.34 -0.23 3.92 1.43 0.64 -3.34 118.68 125.40 1eej s LEU 37 Ca 0.30 -0.76 -0.07 0.00 -1.03 0.00 0.00 54.13 52.58 1eej s LEU 37 Cb -0.16 -1.03 -0.03 0.00 0.03 0.00 0.00 46.19 45.00 1eej s LEU 37 CO 0.11 0.10 0.05 -0.31 0.23 0.00 0.00 176.35 176.52 1eej s TYR 38 N -1.31 3.07 -0.07 0.29 1.51 -0.48 0.06 117.35 120.42 1eej s TYR 38 Ca 0.12 -0.46 0.04 0.00 -1.01 0.00 0.00 57.07 55.76 1eej s TYR 38 Cb -0.09 -2.19 0.00 0.00 -0.11 0.00 0.00 41.96 39.57 1eej s TYR 38 CO 0.06 -0.33 -0.19 0.42 -1.11 0.00 0.00 175.55 174.39 1eej s ILE 39 N 1.44 1.64 0.69 2.71 1.01 -0.76 -0.29 121.20 127.64 1eej s ILE 39 Ca 0.05 -0.79 -0.16 0.00 0.00 0.00 0.00 60.65 59.75 1eej s ILE 39 Cb -0.15 -1.43 0.02 0.00 0.01 0.00 0.00 42.46 40.91 1eej s ILE 39 CO 0.02 0.47 1.22 0.42 0.00 0.00 0.00 174.94 177.07 1eej s THR 40 N 0.35 2.35 0.58 2.92 -4.23 -0.73 -0.60 115.64 116.28 1eej s THR 40 Ca -0.13 0.19 0.28 0.00 -1.18 0.00 0.00 61.69 60.84 1eej s THR 40 Cb -0.16 -2.85 0.37 0.00 1.34 0.00 0.00 72.50 71.20 1eej s THR 40 CO 0.06 -0.08 2.05 0.44 -0.54 0.00 0.00 174.62 176.55 1eej h ASP 41 N 0.03 0.00 0.13 3.99 3.32 -1.00 0.84 116.42 123.73 1eej h ASP 41 Ca -0.49 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.56 1eej h ASP 41 Cb 1.30 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.85 1eej h ASP 41 CO 0.51 0.00 -0.10 -0.90 -1.72 0.00 0.00 179.24 177.03 1eej n ASP 42 N -3.88 1.07 0.00 6.45 5.68 -1.26 0.91 116.55 125.52 1eej n ASP 42 Ca 0.04 -1.11 0.00 0.00 -0.50 0.00 0.00 54.79 53.22 1eej n ASP 42 Cb 0.42 0.03 0.00 0.00 -1.14 0.00 0.00 41.12 40.43 1eej n ASP 42 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1eej n GLY 43 N 1.24 0.27 0.15 6.12 0.00 0.29 -4.81 105.19 108.45 1eej n GLY 43 Ca 0.16 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.23 1eej n GLY 43 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1eej h LYS 44 N 0.60 0.00 -4.71 1.61 1.57 -1.92 -3.45 116.57 110.27 1eej h LYS 44 Ca 0.00 0.00 -0.37 0.00 -1.87 0.00 0.00 60.65 58.41 1eej h LYS 44 Cb 0.45 0.00 -0.27 0.00 0.08 0.00 0.00 32.23 32.49 1eej h LYS 44 CO 0.00 0.31 -0.77 -1.01 -0.57 0.00 0.00 179.45 177.41 1eej s HIS 45 N -3.05 0.78 -0.05 -1.35 3.76 -1.26 -5.04 115.29 109.08 1eej s HIS 45 Ca 0.03 -0.22 0.04 0.00 -0.15 0.00 0.00 55.06 54.76 1eej s HIS 45 Cb 0.07 -0.49 -0.00 0.00 1.11 0.00 0.00 32.58 33.27 1eej s HIS 45 CO 0.74 -0.01 -0.18 0.42 -0.85 0.00 0.00 174.74 174.86 1eej s ILE 46 N -0.45 1.49 -0.12 0.60 1.01 -1.26 -1.76 121.20 120.70 1eej s ILE 46 Ca 0.01 -0.74 0.01 0.00 0.00 0.00 0.00 60.65 59.93 1eej s ILE 46 Cb -0.05 -1.29 0.02 0.00 0.01 0.00 0.00 42.46 41.15 1eej s ILE 46 CO 0.00 0.43 -0.12 -0.63 0.00 0.00 0.00 174.94 174.62 1eej s ILE 47 N 0.11 1.35 0.34 2.92 1.01 0.60 -4.98 121.20 122.55 1eej s ILE 47 Ca -0.06 -0.52 -0.28 0.00 0.00 0.00 0.00 60.65 59.79 1eej s ILE 47 Cb -0.13 -1.28 -0.10 0.00 0.01 0.00 0.00 42.46 40.97 1eej s ILE 47 CO 0.03 0.42 1.26 -1.10 0.00 0.00 0.00 174.94 175.54 1eej s GLN 48 N 1.34 4.32 0.00 2.79 -0.21 -1.26 -1.38 119.66 125.26 1eej s GLN 48 Ca -0.00 2.10 0.00 0.00 0.02 0.00 0.00 55.36 57.48 1eej s GLN 48 Cb -0.14 -3.01 0.00 0.00 1.00 0.00 0.00 33.01 30.86 1eej s GLN 48 CO -0.06 -0.17 0.00 0.41 -2.12 0.00 0.00 175.29 173.35 1eej n GLY 49 N 0.83 -1.46 3.94 3.09 0.00 -1.21 -4.88 105.19 105.50 1eej n GLY 49 Ca 0.01 -1.61 -0.26 0.00 0.00 0.00 0.00 46.02 44.16 1eej n GLY 49 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1eej s PRO 50 N -2.97 1.91 -0.04 1.61 0.04 -1.26 -5.11 135.00 129.19 1eej s PRO 50 Ca 0.00 -0.43 0.01 0.00 0.04 0.00 0.00 61.00 60.62 1eej s PRO 50 Cb 0.00 -2.16 -0.03 0.00 0.04 0.00 0.00 34.50 32.35 1eej s PRO 50 CO 0.00 -1.42 -0.05 1.41 0.04 0.00 0.00 177.00 176.99 1eej s MET 51 N -5.30 2.72 0.04 4.56 1.75 -1.26 -5.00 119.30 116.81 1eej s MET 51 Ca 0.63 -0.60 0.08 0.00 -1.25 0.00 0.00 55.69 54.55 1eej s MET 51 Cb -0.09 -2.60 -0.03 0.00 2.84 0.00 0.00 34.83 34.95 1eej s MET 51 CO 0.46 0.64 -0.24 0.71 -0.65 0.00 0.00 175.02 175.94 1eej s TYR 52 N -0.93 2.06 -0.35 4.11 1.51 -1.26 -1.44 117.35 121.06 1eej s TYR 52 Ca 0.15 -0.39 -0.13 0.00 -1.01 0.00 0.00 57.07 55.69 1eej s TYR 52 Cb -0.11 -1.24 -0.01 0.00 -0.11 0.00 0.00 41.96 40.49 1eej s TYR 52 CO 0.05 0.11 0.24 0.34 -1.11 0.00 0.00 175.55 175.18 1eej s ASP 53 N -1.20 6.00 -0.25 2.29 -1.08 -0.36 -4.91 116.67 117.16 1eej s ASP 53 Ca 0.10 -0.51 0.09 0.00 -0.52 0.00 0.00 52.55 51.71 1eej s ASP 53 Cb -0.09 -2.12 0.45 0.00 -1.46 0.00 0.00 42.92 39.69 1eej s ASP 53 CO 0.02 -0.26 1.27 1.33 0.52 0.00 0.00 175.17 178.05 1eej n VAL 54 N 5.10 2.38 0.85 1.11 0.24 -1.26 -1.94 118.33 124.80 1eej n VAL 54 Ca -0.13 -3.43 0.12 0.00 -2.04 0.00 0.00 64.34 58.87 1eej n VAL 54 Cb 0.49 -0.52 0.25 0.00 -1.47 0.00 0.00 33.84 32.60 1eej n VAL 54 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 1eej n SER 55 N -1.01 0.52 -1.43 -1.34 3.41 -1.26 -4.94 113.62 107.59 1eej n SER 55 Ca 0.29 -0.05 0.00 0.00 -0.26 0.00 0.00 58.87 58.85 1eej n SER 55 Cb 0.82 0.16 0.00 0.00 -0.26 0.00 0.00 64.21 64.92 1eej n SER 55 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1eej n GLY 56 N 1.44 3.55 0.34 5.00 0.00 -1.26 -5.05 105.19 109.21 1eej n GLY 56 Ca 0.05 -2.13 -0.11 0.00 0.00 0.00 0.00 46.02 43.83 1eej n GLY 56 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1eej h THR 57 N 0.35 0.00 -2.68 2.61 2.02 -1.94 -3.43 112.91 109.84 1eej h THR 57 Ca 0.00 0.00 -0.57 0.00 0.77 0.00 0.00 66.41 66.61 1eej h THR 57 Cb 0.00 0.00 -0.15 0.00 -1.74 0.00 0.00 68.15 66.26 1eej h THR 57 CO 0.00 0.00 -0.77 0.00 0.37 0.00 0.00 175.52 175.12 1eej s ALA 58 N -5.15 2.46 0.40 6.16 0.00 -1.26 -5.12 121.76 119.25 1eej s ALA 58 Ca -0.11 -1.74 -0.26 0.00 0.00 0.00 0.00 51.96 49.86 1eej s ALA 58 Cb 0.06 -0.23 -0.09 0.00 0.00 0.00 0.00 23.12 22.87 1eej s ALA 58 CO 0.46 0.26 1.29 -1.25 0.00 0.00 0.00 175.76 176.52 1eej s PRO 59 N -3.28 3.98 -0.12 0.00 0.04 -1.26 -4.85 135.00 129.51 1eej s PRO 59 Ca 0.25 2.13 0.01 0.00 0.04 0.00 0.00 61.00 63.42 1eej s PRO 59 Cb -0.05 -2.75 0.02 0.00 0.04 0.00 0.00 34.50 31.76 1eej s PRO 59 CO 0.11 -0.47 -0.14 0.54 0.04 0.00 0.00 177.00 177.08 1eej s VAL 60 N -1.27 1.44 -0.70 -0.36 0.11 -0.82 -4.97 120.40 113.83 1eej s VAL 60 Ca 0.57 -0.58 -0.26 0.00 -2.93 0.00 0.00 61.98 58.77 1eej s VAL 60 Cb -0.37 -1.35 -0.01 0.00 -1.53 0.00 0.00 36.38 33.12 1eej s VAL 60 CO 0.48 0.43 1.71 0.21 -3.33 0.00 0.00 175.10 174.61 1eej s ASN 61 N 1.22 5.52 0.43 3.54 3.84 -1.26 -1.22 114.94 127.02 1eej s ASN 61 Ca -0.02 -0.06 0.20 0.00 0.21 0.00 0.00 52.86 53.20 1eej s ASN 61 Cb -0.14 -2.54 0.96 0.00 -0.55 0.00 0.00 41.25 38.98 1eej s ASN 61 CO -0.05 -2.25 1.88 -0.37 -2.79 0.00 0.00 177.10 173.51 1eej h VAL 62 N 6.72 0.86 -0.18 -5.21 -1.51 -1.60 -1.72 116.25 113.62 1eej h VAL 62 Ca -0.20 -1.10 -0.02 0.00 -1.23 0.00 0.00 66.70 64.15 1eej h VAL 62 Cb 1.11 1.66 -0.01 0.00 -2.13 0.00 0.00 31.29 31.92 1eej h VAL 62 CO 1.24 0.27 0.02 0.74 -1.23 0.00 0.00 177.57 178.62 1eej h THR 63 N 0.00 1.23 -0.30 7.19 2.02 -1.87 -1.59 112.91 119.59 1eej h THR 63 Ca -0.00 -0.76 -0.07 0.00 0.77 0.00 0.00 66.41 66.35 1eej h THR 63 Cb 0.64 1.39 -0.02 0.00 -1.74 0.00 0.00 68.15 68.42 1eej h THR 63 CO 0.04 0.23 -0.12 0.78 0.37 0.00 0.00 175.52 176.82 1eej h ASN 64 N 0.08 0.50 -0.58 4.18 4.21 -1.82 -1.21 115.58 120.94 1eej h ASN 64 Ca 0.05 -0.13 0.02 0.00 1.21 0.00 0.00 56.30 57.45 1eej h ASN 64 Cb 0.33 -0.13 -0.03 0.00 -1.12 0.00 0.00 38.32 37.36 1eej h ASN 64 CO 0.00 0.65 0.36 0.50 -1.29 0.00 0.00 177.43 177.66 1eej h LYS 65 N 0.48 0.71 -0.21 0.81 3.64 -1.00 -2.28 116.57 118.72 1eej h LYS 65 Ca 0.09 -0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 59.39 1eej h LYS 65 Cb 0.50 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 32.15 1eej h LYS 65 CO 0.03 0.47 -0.01 0.52 -2.27 0.00 0.00 179.45 178.19 1eej h MET 66 N 0.73 0.38 0.00 1.90 2.86 -0.87 -2.81 114.93 117.12 1eej h MET 66 Ca 0.23 -0.13 0.00 0.00 -2.06 0.00 0.00 59.70 57.74 1eej h MET 66 Cb -0.02 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 31.61 1eej h MET 66 CO -0.08 0.59 0.11 1.28 1.06 0.00 0.00 176.91 179.87 1eej n LEU 67 N -4.66 0.47 0.27 1.22 4.77 -0.50 -0.96 117.00 117.62 1eej n LEU 67 Ca -0.04 0.68 0.17 0.00 -0.03 0.00 0.00 56.01 56.79 1eej n LEU 67 Cb 0.24 -0.71 0.92 0.00 -2.33 0.00 0.00 43.42 41.54 1eej n LEU 67 CO 0.37 -0.84 1.14 -0.07 -1.33 0.00 0.00 177.39 176.66 1eej h LEU 68 N 0.00 0.00 -0.35 2.23 3.38 -1.14 0.21 115.31 119.63 1eej h LEU 68 Ca 0.00 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 1eej h LEU 68 Cb 0.22 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 40.95 1eej h LEU 68 CO 0.00 0.00 0.14 0.50 0.09 0.00 0.00 178.44 179.17 1eej h LYS 69 N 0.00 0.52 -0.44 1.13 3.64 -1.26 0.15 116.57 120.32 1eej h LYS 69 Ca 0.03 -0.09 -0.13 0.00 -1.27 0.00 0.00 60.65 59.18 1eej h LYS 69 Cb 0.21 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 31.93 1eej h LYS 69 CO -0.00 0.51 -0.26 1.96 -2.27 0.00 0.00 179.45 179.39 1eej h GLN 70 N 0.42 0.92 0.04 1.90 1.08 -0.86 -2.42 115.11 116.20 1eej h GLN 70 Ca 0.12 -0.41 -0.00 0.00 -1.45 0.00 0.00 58.65 56.91 1eej h GLN 70 Cb 0.18 -0.02 0.00 0.00 -0.05 0.00 0.00 27.48 27.59 1eej h GLN 70 CO -0.01 1.06 -0.02 1.25 -0.95 0.00 0.00 178.83 180.16 1eej h LEU 71 N 0.79 -0.05 -2.00 1.46 5.85 -0.71 -2.45 115.31 118.20 1eej h LEU 71 Ca 0.10 -0.05 -0.02 0.00 0.84 0.00 0.00 57.88 58.74 1eej h LEU 71 Cb 0.82 0.01 -0.00 0.00 0.37 0.00 0.00 40.66 41.86 1eej h LEU 71 CO 0.07 0.02 -0.10 0.78 -0.34 0.00 0.00 178.44 178.87 1eej h ASN 72 N -0.11 0.00 0.72 1.25 2.35 -0.67 -0.82 115.58 118.29 1eej h ASN 72 Ca -0.01 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.74 1eej h ASN 72 Cb 0.10 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.47 1eej h ASN 72 CO 0.01 0.10 0.00 0.00 -1.65 0.00 0.00 177.43 175.89 1eej h ALA 73 N 1.90 1.00 -0.51 -0.83 0.00 -0.94 -2.03 119.26 117.86 1eej h ALA 73 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1eej h ALA 73 Cb 0.29 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1eej h ALA 73 CO 0.01 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.54 1eej n LEU 74 N -2.33 3.38 -0.28 0.00 4.77 -0.32 -4.67 117.00 117.56 1eej n LEU 74 Ca 0.02 -1.92 0.09 0.00 -0.03 0.00 0.00 56.01 54.17 1eej n LEU 74 Cb 0.23 -0.34 0.24 0.00 -2.33 0.00 0.00 43.42 41.22 1eej n LEU 74 CO 0.20 0.83 0.97 -0.08 -1.33 0.00 0.00 177.39 177.99 1eej h GLU 75 N 3.20 0.30 0.00 3.23 4.81 -1.34 0.12 114.58 124.91 1eej h GLU 75 Ca 0.00 -0.02 -0.05 0.00 -0.13 0.00 0.00 59.36 59.16 1eej h GLU 75 Cb 0.85 -0.07 -0.01 0.00 0.63 0.00 0.00 28.75 30.16 1eej h GLU 75 CO 0.00 0.20 -0.26 0.87 -0.73 0.00 0.00 179.01 179.09 1eej h LYS 76 N 0.31 0.00 -0.00 1.92 1.79 -1.83 -2.57 116.57 116.18 1eej h LYS 76 Ca 0.49 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.96 1eej h LYS 76 Cb 0.89 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.54 1eej h LYS 76 CO -0.54 0.26 -0.10 0.39 -1.08 0.00 0.00 179.45 178.38 1eej n GLU 77 N -3.54 0.62 -2.69 3.15 1.02 0.39 -4.87 120.64 114.72 1eej n GLU 77 Ca -0.01 -0.19 -0.33 0.00 -0.02 0.00 0.00 57.16 56.62 1eej n GLU 77 Cb 0.41 -1.50 -0.06 0.00 -0.02 0.00 0.00 31.44 30.27 1eej n GLU 77 CO 0.00 0.00 0.00 -1.64 1.18 0.00 0.00 177.13 176.67 1eej s MET 78 N -2.51 4.12 -0.36 3.49 -1.94 -0.97 -4.92 119.30 116.21 1eej s MET 78 Ca 0.28 1.10 -0.14 0.00 -1.71 0.00 0.00 55.69 55.23 1eej s MET 78 Cb 0.20 -2.16 -0.01 0.00 2.01 0.00 0.00 34.83 34.87 1eej s MET 78 CO 0.48 -0.13 0.27 0.42 -0.01 0.00 0.00 175.02 176.05 1eej s ILE 79 N -2.27 5.27 -0.19 2.53 1.01 -1.00 -4.88 121.20 121.66 1eej s ILE 79 Ca 0.62 -0.32 -0.08 0.00 0.00 0.00 0.00 60.65 60.86 1eej s ILE 79 Cb -0.10 -3.79 -0.04 0.00 0.01 0.00 0.00 42.46 38.54 1eej s ILE 79 CO 0.18 -0.11 0.09 -0.69 0.00 0.00 0.00 174.94 174.41 1eej s VAL 80 N 1.74 5.05 -0.58 2.92 1.01 -1.26 -0.99 120.40 128.29 1eej s VAL 80 Ca 0.06 0.06 0.03 0.00 0.00 0.00 0.00 61.98 62.13 1eej s VAL 80 Cb -0.18 -3.29 0.14 0.00 0.00 0.00 0.00 36.38 33.06 1eej s VAL 80 CO 0.11 0.45 0.35 -0.31 0.00 0.00 0.00 175.10 175.69 1eej s TYR 81 N 0.36 3.30 0.11 5.22 2.02 0.11 -4.99 117.35 123.49 1eej s TYR 81 Ca 0.05 -3.10 -0.31 0.00 -0.37 0.00 0.00 57.07 53.34 1eej s TYR 81 Cb -0.12 -2.90 -0.08 0.00 -0.40 0.00 0.00 41.96 38.47 1eej s TYR 81 CO -0.01 -0.74 1.39 0.21 -1.57 0.00 0.00 175.55 174.83 1eej s LYS 82 N -0.44 4.32 0.06 -0.62 2.47 -1.26 -2.05 119.74 122.22 1eej s LYS 82 Ca 0.18 2.07 -0.28 0.00 -1.56 0.00 0.00 55.97 56.38 1eej s LYS 82 Cb -0.21 -3.26 -0.05 0.00 -1.46 0.00 0.00 37.83 32.85 1eej s LYS 82 CO -0.03 -0.44 0.88 0.00 0.16 0.00 0.00 175.35 175.93 1eej s ALA 83 N 1.13 3.27 0.16 3.13 0.00 -1.26 -4.96 121.76 123.23 1eej s ALA 83 Ca 0.64 0.45 -0.16 0.00 0.00 0.00 0.00 51.96 52.89 1eej s ALA 83 Cb -0.37 -3.18 0.09 0.00 0.00 0.00 0.00 23.12 19.67 1eej s ALA 83 CO 0.30 -0.04 1.70 -1.35 0.00 0.00 0.00 175.76 176.37 1eej h PRO 84 N 5.91 0.10 -2.94 0.00 0.11 -1.95 -3.01 132.00 130.21 1eej h PRO 84 Ca -0.43 -0.01 -0.70 0.00 0.11 0.00 0.00 66.00 64.98 1eej h PRO 84 Cb 1.21 -0.02 -0.35 0.00 0.11 0.00 0.00 31.00 31.94 1eej h PRO 84 CO 0.72 0.07 -0.02 1.04 -0.21 0.00 0.00 178.00 179.60 1eej n GLN 85 N -5.19 3.02 -1.74 1.05 1.13 -1.26 -5.05 117.38 109.35 1eej n GLN 85 Ca 0.02 -4.55 -0.43 0.00 -1.94 0.00 0.00 57.00 50.10 1eej n GLN 85 Cb 0.19 -2.40 -0.03 0.00 0.11 0.00 0.00 30.24 28.12 1eej n GLN 85 CO 0.00 0.00 0.00 -2.00 -1.44 0.00 0.00 177.06 173.62 1eej s GLU 86 N -1.98 3.41 -0.07 -1.09 2.12 -1.14 -4.23 118.70 115.72 1eej s GLU 86 Ca 0.32 1.99 0.09 0.00 0.36 0.00 0.00 54.97 57.72 1eej s GLU 86 Cb 0.01 -4.27 -0.13 0.00 0.26 0.00 0.00 34.13 30.00 1eej s GLU 86 CO -0.05 -1.78 0.09 1.63 -0.54 0.00 0.00 175.26 174.61 1eej n LYS 87 N 8.38 1.79 -4.06 4.30 4.76 0.11 -5.02 118.16 128.42 1eej n LYS 87 Ca 0.26 -0.03 -0.13 0.00 -2.87 0.00 0.00 58.31 55.53 1eej n LYS 87 Cb 0.45 -1.24 -0.12 0.00 -1.84 0.00 0.00 35.03 32.28 1eej n LYS 87 CO 0.00 0.00 0.00 -1.01 -1.37 0.00 0.00 177.40 175.02 1eej s HIS 88 N -2.37 0.52 -0.14 2.13 3.76 -0.78 -5.04 115.29 113.38 1eej s HIS 88 Ca -0.04 -0.37 -0.01 0.00 -0.15 0.00 0.00 55.06 54.49 1eej s HIS 88 Cb 0.04 -0.32 0.03 0.00 1.11 0.00 0.00 32.58 33.44 1eej s HIS 88 CO 0.39 -0.08 -0.05 0.08 -0.85 0.00 0.00 174.74 174.23 1eej s VAL 89 N -1.00 0.99 0.13 -0.90 1.01 -1.26 -1.00 120.40 118.37 1eej s VAL 89 Ca -0.07 -0.42 0.10 0.00 0.00 0.00 0.00 61.98 61.58 1eej s VAL 89 Cb -0.07 -1.11 -0.04 0.00 0.00 0.00 0.00 36.38 35.15 1eej s VAL 89 CO 0.00 0.23 -0.24 0.27 0.00 0.00 0.00 175.10 175.36 1eej s ILE 90 N 1.70 2.03 -0.17 2.22 -4.36 -0.72 -4.04 121.20 117.86 1eej s ILE 90 Ca 0.03 -1.70 -0.02 0.00 -0.26 0.00 0.00 60.65 58.70 1eej s ILE 90 Cb -0.14 -1.83 -0.01 0.00 1.25 0.00 0.00 42.46 41.73 1eej s ILE 90 CO -0.08 -0.01 -0.09 -0.89 0.24 0.00 0.00 174.94 174.11 1eej s THR 91 N -1.20 3.20 -0.15 8.37 2.01 -0.88 -1.74 115.64 125.25 1eej s THR 91 Ca 0.12 -0.58 0.00 0.00 0.31 0.00 0.00 61.69 61.53 1eej s THR 91 Cb -0.10 -2.39 -0.00 0.00 0.01 0.00 0.00 72.50 70.02 1eej s THR 91 CO 0.06 0.48 -0.15 -0.69 -0.69 0.00 0.00 174.62 173.63 1eej s VAL 92 N 0.84 2.74 -0.28 3.82 1.01 0.14 -0.09 120.40 128.58 1eej s VAL 92 Ca -0.03 -0.75 -0.23 0.00 0.00 0.00 0.00 61.98 60.97 1eej s VAL 92 Cb -0.15 -2.16 -0.00 0.00 0.00 0.00 0.00 36.38 34.07 1eej s VAL 92 CO 0.01 0.51 0.78 -0.36 0.00 0.00 0.00 175.10 176.04 1eej s PHE 93 N 0.77 3.24 0.26 5.22 0.40 -0.12 -1.64 117.98 126.11 1eej s PHE 93 Ca -0.06 0.90 0.08 0.00 -0.60 0.00 0.00 56.93 57.25 1eej s PHE 93 Cb -0.15 -3.13 -0.05 0.00 0.51 0.00 0.00 43.02 40.19 1eej s PHE 93 CO 0.01 -0.49 -0.10 -0.08 0.70 0.00 0.00 175.22 175.25 1eej s THR 94 N 2.87 1.80 -0.10 0.64 -1.32 -0.83 -2.22 115.64 116.49 1eej s THR 94 Ca 0.32 -2.18 -0.01 0.00 -1.21 0.00 0.00 61.69 58.61 1eej s THR 94 Cb -0.15 -2.33 0.03 0.00 -1.51 0.00 0.00 72.50 68.54 1eej s THR 94 CO 0.11 -0.39 -0.01 -0.62 -2.21 0.00 0.00 174.62 171.50 1eej s ASP 95 N -3.43 1.88 0.04 8.08 -1.08 -1.26 -0.73 116.67 120.18 1eej s ASP 95 Ca 0.28 -0.22 0.07 0.00 -0.52 0.00 0.00 52.55 52.16 1eej s ASP 95 Cb 0.01 -0.54 0.33 0.00 -1.46 0.00 0.00 42.92 41.26 1eej s ASP 95 CO 0.11 -0.19 1.23 2.30 0.52 0.00 0.00 175.17 179.14 1eej n ILE 96 N 5.09 1.57 -0.18 4.11 -6.64 -1.26 -1.19 119.36 120.87 1eej n ILE 96 Ca -0.08 0.44 0.12 0.00 -1.77 0.00 0.00 62.75 61.45 1eej n ILE 96 Cb 0.50 -1.37 0.30 0.00 -1.44 0.00 0.00 39.64 37.63 1eej n ILE 96 CO 0.00 0.00 0.00 0.35 -1.77 0.00 0.00 176.55 175.13 1eej n THR 97 N -1.61 0.87 -3.80 7.28 -2.24 -1.26 -4.89 114.28 108.64 1eej n THR 97 Ca 0.01 -0.92 -0.36 0.00 -2.27 0.00 0.00 64.05 60.51 1eej n THR 97 Cb 0.06 0.58 -0.10 0.00 -2.10 0.00 0.00 70.33 68.77 1eej n THR 97 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1eej h GLY 99 N 7.42 1.10 1.85 0.00 0.00 -1.91 -1.68 103.07 109.85 1eej h GLY 99 Ca -0.37 -0.39 -0.09 0.00 0.00 0.00 0.00 47.33 46.48 1eej h GLY 99 CO 0.65 0.36 -0.34 -0.97 0.00 0.00 0.00 176.54 176.24 1eej h TYR 100 N 1.00 0.19 -0.23 5.60 0.05 -1.95 -1.62 116.97 120.01 1eej h TYR 100 Ca 0.30 -0.04 -0.12 0.00 0.05 0.00 0.00 58.73 58.91 1eej h TYR 100 Cb -0.06 -0.05 -0.01 0.00 1.01 0.00 0.00 36.73 37.63 1eej h TYR 100 CO -0.03 0.50 -0.38 0.00 -1.05 0.00 0.00 178.16 177.21 1eej h HIS 102 N 0.43 0.96 -0.32 0.00 -0.00 -0.86 -0.82 115.15 114.54 1eej h HIS 102 Ca 0.04 -0.24 -0.06 0.00 -0.00 0.00 0.00 60.37 60.12 1eej h HIS 102 Cb 0.85 -0.22 -0.02 0.00 -0.00 0.00 0.00 27.41 28.03 1eej h HIS 102 CO 0.03 1.00 -0.04 -0.22 -0.00 0.00 0.00 177.93 178.70 1eej h LYS 103 N 0.64 0.51 0.04 5.26 3.64 -1.08 -0.28 116.57 125.30 1eej h LYS 103 Ca 0.09 -0.12 -0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1eej h LYS 103 Cb 0.75 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.50 1eej h LYS 103 CO 0.06 0.57 -0.02 1.25 -2.27 0.00 0.00 179.45 179.04 1eej h LEU 104 N 0.48 -0.04 -1.25 5.20 6.46 -1.01 -3.24 115.31 121.91 1eej h LEU 104 Ca 0.10 -0.51 0.03 0.00 -0.12 0.00 0.00 57.88 57.38 1eej h LEU 104 Cb 0.38 0.01 -0.05 0.00 -0.73 0.00 0.00 40.66 40.28 1eej h LEU 104 CO 0.02 0.51 0.52 -0.74 -0.62 0.00 0.00 178.44 178.13 1eej h HIS 105 N -0.61 0.95 0.00 1.25 2.76 -0.92 -1.06 115.15 117.51 1eej h HIS 105 Ca -0.01 0.02 -0.00 0.00 -2.20 0.00 0.00 60.37 58.19 1eej h HIS 105 Cb 0.55 -0.32 -0.00 0.00 1.55 0.00 0.00 27.41 29.20 1eej h HIS 105 CO 0.11 0.55 -0.01 1.49 -1.30 0.00 0.00 177.93 178.77 1eej h GLU 106 N 0.98 0.00 -0.38 5.26 4.81 -1.09 -0.94 114.58 123.22 1eej h GLU 106 Ca 0.32 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.55 1eej h GLU 106 Cb 0.04 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.42 1eej h GLU 106 CO -0.09 0.01 0.00 1.04 -0.73 0.00 0.00 179.01 179.24 1eej n GLN 107 N -3.37 3.52 -0.18 1.92 6.02 -0.41 -4.70 117.38 120.17 1eej n GLN 107 Ca -0.03 -2.88 -0.01 0.00 -0.01 0.00 0.00 57.00 54.08 1eej n GLN 107 Cb 0.11 -1.93 0.08 0.00 1.02 0.00 0.00 30.24 29.53 1eej n GLN 107 CO 0.00 0.00 0.00 1.98 -1.01 0.00 0.00 177.06 178.03 1eej h MET 108 N 2.57 0.16 -0.56 -1.09 4.05 -1.02 0.39 114.93 119.43 1eej h MET 108 Ca 0.00 -0.01 0.11 0.00 -0.28 0.00 0.00 59.70 59.52 1eej h MET 108 Cb 1.54 -0.04 -0.03 0.00 -0.80 0.00 0.00 31.60 32.28 1eej h MET 108 CO 0.28 0.11 0.38 0.00 0.23 0.00 0.00 176.91 177.91 1eej h ALA 109 N 1.48 2.15 -0.21 0.39 0.00 -1.84 -0.16 119.26 121.07 1eej h ALA 109 Ca 0.29 -0.01 -0.20 0.00 0.00 0.00 0.00 54.91 54.98 1eej h ALA 109 Cb 0.44 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1eej h ALA 109 CO -0.43 -0.29 -0.67 -0.44 0.00 0.00 0.00 179.25 177.43 1eej h ASP 110 N 0.28 0.93 -0.35 0.00 5.19 -1.29 0.02 116.42 121.19 1eej h ASP 110 Ca 0.26 -0.56 -0.03 0.00 -0.62 0.00 0.00 57.03 56.08 1eej h ASP 110 Cb 0.66 -0.27 -0.01 0.00 0.18 0.00 0.00 39.33 39.88 1eej h ASP 110 CO -0.06 1.35 0.09 1.88 -3.12 0.00 0.00 179.24 179.38 1eej h TYR 111 N 0.59 0.59 -0.91 4.55 0.05 -0.67 -1.99 116.97 119.18 1eej h TYR 111 Ca -0.02 -0.07 -0.01 0.00 0.05 0.00 0.00 58.73 58.68 1eej h TYR 111 Cb 1.28 -0.17 -0.04 0.00 1.01 0.00 0.00 36.73 38.81 1eej h TYR 111 CO 0.08 0.59 0.53 -0.91 -1.05 0.00 0.00 178.16 177.39 1eej h ASN 112 N 0.42 1.12 0.40 3.88 -0.26 -1.03 -0.30 115.58 119.81 1eej h ASN 112 Ca 0.11 -0.08 -0.05 0.00 -0.56 0.00 0.00 56.30 55.72 1eej h ASN 112 Cb 0.29 -0.28 -0.01 0.00 -1.06 0.00 0.00 38.32 37.26 1eej h ASN 112 CO 0.00 0.87 -0.22 0.00 -1.06 0.00 0.00 177.43 177.02 1eej h ALA 113 N 1.31 1.35 -0.33 -0.83 0.00 -0.73 -1.61 119.26 118.42 1eej h ALA 113 Ca 0.33 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1eej h ALA 113 Cb -0.02 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.73 1eej h ALA 113 CO -0.06 0.28 0.00 1.28 0.00 0.00 0.00 179.25 180.75 1eej n LEU 114 N -3.86 2.58 -0.00 0.00 4.77 -0.69 -4.89 117.00 114.91 1eej n LEU 114 Ca -0.02 -1.30 -0.00 0.00 -0.03 0.00 0.00 56.01 54.66 1eej n LEU 114 Cb 0.32 -0.40 -0.00 0.00 -2.33 0.00 0.00 43.42 41.01 1eej n LEU 114 CO 0.34 0.47 -0.00 0.61 -1.33 0.00 0.00 177.39 177.48 1eej n GLY 115 N 0.74 0.46 3.54 -0.72 0.00 -0.61 -4.86 105.19 103.74 1eej n GLY 115 Ca 0.13 -0.42 -0.39 0.00 0.00 0.00 0.00 46.02 45.34 1eej n GLY 115 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1eej s ILE 116 N -2.00 5.18 -0.06 -0.61 1.01 -0.21 0.08 121.20 124.60 1eej s ILE 116 Ca 0.00 -0.08 -0.20 0.00 0.00 0.00 0.00 60.65 60.37 1eej s ILE 116 Cb 0.00 -3.57 -0.05 0.00 0.01 0.00 0.00 42.46 38.86 1eej s ILE 116 CO 0.00 0.12 0.58 -0.89 0.00 0.00 0.00 174.94 174.75 1eej s THR 117 N 1.72 5.04 -0.14 2.92 2.01 -0.17 -3.35 115.64 123.67 1eej s THR 117 Ca 0.06 1.20 0.00 0.00 0.31 0.00 0.00 61.69 63.26 1eej s THR 117 Cb -0.17 -3.92 -0.01 0.00 0.01 0.00 0.00 72.50 68.41 1eej s THR 117 CO 0.10 0.35 -0.14 -0.69 -0.69 0.00 0.00 174.62 173.54 1eej s VAL 118 N 0.31 2.86 -0.14 3.82 1.01 -0.87 -1.75 120.40 125.63 1eej s VAL 118 Ca 0.31 -0.72 0.02 0.00 0.00 0.00 0.00 61.98 61.59 1eej s VAL 118 Cb -0.17 -2.20 0.01 0.00 0.00 0.00 0.00 36.38 34.02 1eej s VAL 118 CO 0.15 0.52 -0.20 -0.13 0.00 0.00 0.00 175.10 175.44 1eej s ARG 119 N 0.52 3.07 -0.04 2.72 0.52 -0.71 -0.71 118.95 124.32 1eej s ARG 119 Ca -0.10 -0.83 -0.06 0.00 -0.52 0.00 0.00 55.73 54.22 1eej s ARG 119 Cb -0.16 -2.48 -0.04 0.00 0.52 0.00 0.00 34.95 32.79 1eej s ARG 119 CO 0.04 -0.00 0.22 0.71 0.02 0.00 0.00 175.30 176.29 1eej s TYR 120 N 0.80 3.59 0.06 -0.53 2.02 -0.16 0.23 117.35 123.35 1eej s TYR 120 Ca -0.07 0.54 0.07 0.00 -0.37 0.00 0.00 57.07 57.24 1eej s TYR 120 Cb -0.16 -1.96 -0.03 0.00 -0.40 0.00 0.00 41.96 39.42 1eej s TYR 120 CO -0.01 0.66 -0.18 -0.51 -1.57 0.00 0.00 175.55 173.94 1eej s LEU 121 N -1.53 2.21 -0.04 -1.29 1.43 -0.65 -2.39 118.68 116.42 1eej s LEU 121 Ca 0.23 -0.55 -0.29 0.00 -1.03 0.00 0.00 54.13 52.50 1eej s LEU 121 Cb -0.13 -0.81 -0.03 0.00 0.03 0.00 0.00 46.19 45.26 1eej s LEU 121 CO 0.13 0.08 0.93 0.00 0.23 0.00 0.00 176.35 177.71 1eej s ALA 122 N -0.94 3.25 -0.36 4.21 0.00 -1.26 -1.96 121.76 124.69 1eej s ALA 122 Ca 0.05 0.42 -0.00 0.00 0.00 0.00 0.00 51.96 52.42 1eej s ALA 122 Cb -0.09 -3.28 0.13 0.00 0.00 0.00 0.00 23.12 19.88 1eej s ALA 122 CO 0.02 -0.29 0.19 0.12 0.00 0.00 0.00 175.76 175.81 1eej s PHE 123 N 1.18 1.13 -0.45 0.00 5.36 0.09 -3.50 117.98 121.79 1eej s PHE 123 Ca 0.48 -1.75 -0.29 0.00 -0.96 0.00 0.00 56.93 54.41 1eej s PHE 123 Cb -0.20 -1.27 0.01 0.00 -0.34 0.00 0.00 43.02 41.22 1eej s PHE 123 CO 0.24 -0.82 1.39 -1.25 -1.46 0.00 0.00 175.22 173.32 1eej s PRO 124 N 1.08 3.52 0.32 10.12 0.04 -1.26 -4.15 135.00 144.67 1eej s PRO 124 Ca 0.16 0.80 0.05 0.00 0.04 0.00 0.00 61.00 62.04 1eej s PRO 124 Cb -0.22 -4.04 0.67 0.00 0.04 0.00 0.00 34.50 30.96 1eej s PRO 124 CO -0.07 -1.64 1.87 0.00 0.04 0.00 0.00 177.00 177.19 1eej h ARG 125 N 10.69 0.84 0.00 4.56 3.08 -1.98 0.01 114.38 131.57 1eej h ARG 125 Ca -0.27 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 59.73 1eej h ARG 125 Cb 1.10 -0.19 0.00 0.00 0.08 0.00 0.00 29.97 30.96 1eej h ARG 125 CO 1.11 0.55 0.00 1.04 -1.07 0.00 0.00 179.97 181.60 1eej n GLN 126 N -4.57 0.88 0.00 0.04 1.13 -1.26 -5.00 117.38 108.60 1eej n GLN 126 Ca 0.17 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 55.23 1eej n GLN 126 Cb 0.37 -1.12 0.00 0.00 0.11 0.00 0.00 30.24 29.60 1eej n GLN 126 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1eej n GLY 127 N 0.48 -0.58 0.28 1.08 0.00 -0.01 -4.52 105.19 101.90 1eej n GLY 127 Ca 0.05 -1.75 0.16 0.00 0.00 0.00 0.00 46.02 44.48 1eej n GLY 127 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1eej h LEU 128 N 0.00 0.00 -6.74 0.99 3.38 -1.95 -3.29 115.31 107.71 1eej h LEU 128 Ca 0.00 0.00 -0.79 0.00 0.09 0.00 0.00 57.88 57.18 1eej h LEU 128 Cb 0.00 0.00 -0.29 0.00 0.09 0.00 0.00 40.66 40.46 1eej h LEU 128 CO 0.00 0.07 0.66 -0.67 0.09 0.00 0.00 178.44 178.59 1eej n ASP 129 N -3.26 6.27 -3.97 -0.43 2.03 -1.26 -4.77 116.55 111.15 1eej n ASP 129 Ca -0.01 -3.46 -0.09 0.00 0.52 0.00 0.00 54.79 51.75 1eej n ASP 129 Cb 0.27 -1.19 -0.06 0.00 -0.72 0.00 0.00 41.12 39.43 1eej n ASP 129 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 1eej s SER 130 N -1.85 -0.07 0.25 1.67 1.04 -1.24 -5.04 113.70 108.45 1eej s SER 130 Ca 0.33 -0.90 -0.03 0.00 0.48 0.00 0.00 55.95 55.84 1eej s SER 130 Cb 0.08 0.54 0.29 0.00 0.10 0.00 0.00 66.02 67.04 1eej s SER 130 CO 0.07 -1.07 1.74 0.44 0.98 0.00 0.00 173.24 175.40 1eej h ASP 131 N 2.32 0.80 -0.65 7.02 3.32 -1.93 -2.86 116.42 124.45 1eej h ASP 131 Ca -0.28 -0.20 0.08 0.00 0.02 0.00 0.00 57.03 56.65 1eej h ASP 131 Cb 1.25 -0.21 -0.07 0.00 0.22 0.00 0.00 39.33 40.52 1eej h ASP 131 CO 0.39 0.87 0.30 0.00 -1.72 0.00 0.00 179.24 179.08 1eej h ALA 132 N 1.22 0.87 -0.50 3.45 0.00 -1.96 0.14 119.26 122.47 1eej h ALA 132 Ca 0.15 0.06 -0.07 0.00 0.00 0.00 0.00 54.91 55.04 1eej h ALA 132 Cb 0.47 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 1eej h ALA 132 CO 0.02 -0.09 0.02 1.49 0.00 0.00 0.00 179.25 180.69 1eej h GLU 133 N 0.53 0.87 -0.43 0.00 4.22 -1.75 -1.21 114.58 116.81 1eej h GLU 133 Ca 0.32 -0.27 -0.05 0.00 0.08 0.00 0.00 59.36 59.44 1eej h GLU 133 Cb 0.33 -0.08 -0.02 0.00 0.50 0.00 0.00 28.75 29.48 1eej h GLU 133 CO -0.26 0.89 0.09 0.87 -2.18 0.00 0.00 179.01 178.42 1eej h LYS 134 N 0.73 0.71 -0.59 1.92 1.57 -1.18 -0.38 116.57 119.34 1eej h LYS 134 Ca 0.14 -0.18 -0.10 0.00 -1.87 0.00 0.00 60.65 58.64 1eej h LYS 134 Cb 0.49 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.69 1eej h LYS 134 CO 0.02 0.73 -0.03 0.93 -0.57 0.00 0.00 179.45 180.53 1eej h GLU 135 N 0.57 1.07 0.00 3.15 4.39 -0.65 -2.66 114.58 120.45 1eej h GLU 135 Ca 0.13 -0.36 -0.12 0.00 0.34 0.00 0.00 59.36 59.35 1eej h GLU 135 Cb 0.35 -0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 28.90 1eej h GLU 135 CO 0.01 1.06 -0.59 0.52 -1.16 0.00 0.00 179.01 178.84 1eej h MET 136 N 0.97 0.00 -0.58 2.33 2.86 -1.15 -2.51 114.93 116.84 1eej h MET 136 Ca 0.16 0.00 -0.06 0.00 -2.06 0.00 0.00 59.70 57.74 1eej h MET 136 Cb 0.60 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.23 1eej h MET 136 CO 0.04 0.59 0.12 -0.22 1.06 0.00 0.00 176.91 178.50 1eej h LYS 137 N 0.00 0.92 -0.18 1.72 1.63 -0.94 -0.04 116.57 119.68 1eej h LYS 137 Ca -0.01 -0.21 -0.15 0.00 -0.85 0.00 0.00 60.65 59.43 1eej h LYS 137 Cb 1.34 -0.13 -0.01 0.00 -0.60 0.00 0.00 32.23 32.84 1eej h LYS 137 CO 0.08 0.84 -0.53 0.00 -3.45 0.00 0.00 179.45 176.39 1eej h ALA 138 N 1.24 0.73 0.17 5.00 0.00 -1.35 -2.46 119.26 122.60 1eej h ALA 138 Ca 0.19 -0.50 -0.01 0.00 0.00 0.00 0.00 54.91 54.58 1eej h ALA 138 Cb 0.36 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.06 1eej h ALA 138 CO 0.00 0.68 -0.08 0.82 0.00 0.00 0.00 179.25 180.67 1eej h ILE 139 N 0.41 0.93 0.00 0.00 2.04 -0.99 -2.64 117.51 117.27 1eej h ILE 139 Ca 0.01 -0.56 0.00 0.00 1.00 0.00 0.00 64.86 65.32 1eej h ILE 139 Cb 1.06 1.27 0.00 0.00 -0.74 0.00 0.00 36.82 38.41 1eej h ILE 139 CO 0.10 0.13 0.00 -0.50 0.00 0.00 0.00 178.15 177.88 1eej h TRP 140 N -0.51 0.00 -0.16 1.37 6.55 -1.05 -2.14 115.95 120.02 1eej h TRP 140 Ca -0.02 0.00 0.00 0.00 0.95 0.00 0.00 58.89 59.82 1eej h TRP 140 Cb 0.39 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.69 1eej h TRP 140 CO 0.01 0.00 0.00 0.00 -1.05 0.00 0.00 178.44 177.40 1eej s ALA 142 N -1.82 2.89 0.21 0.00 0.00 -0.80 -4.79 121.76 117.44 1eej s ALA 142 Ca 0.32 0.56 -0.10 0.00 0.00 0.00 0.00 51.96 52.74 1eej s ALA 142 Cb 0.21 -3.24 0.29 0.00 0.00 0.00 0.00 23.12 20.38 1eej s ALA 142 CO 0.31 -0.29 1.70 -0.22 0.00 0.00 0.00 175.76 177.26 1eej h LYS 143 N 1.52 0.23 -4.38 0.00 1.63 -1.92 -3.27 116.57 110.37 1eej h LYS 143 Ca -0.49 -0.01 -0.67 0.00 -0.85 0.00 0.00 60.65 58.62 1eej h LYS 143 Cb 1.21 -0.05 -0.38 0.00 -0.60 0.00 0.00 32.23 32.42 1eej h LYS 143 CO 0.59 0.15 -0.62 0.34 -3.45 0.00 0.00 179.45 176.46 1eej s ASP 144 N -5.29 4.93 0.15 4.20 -1.08 -1.26 -4.99 116.67 113.34 1eej s ASP 144 Ca -0.13 -2.27 -0.17 0.00 -0.52 0.00 0.00 52.55 49.46 1eej s ASP 144 Cb 0.18 -1.72 0.06 0.00 -1.46 0.00 0.00 42.92 39.98 1eej s ASP 144 CO 0.74 -0.42 1.73 0.11 0.52 0.00 0.00 175.17 177.85 1eej h LYS 145 N 7.59 0.20 -0.07 4.34 1.57 -1.79 -1.94 116.57 126.47 1eej h LYS 145 Ca -0.07 -0.01 0.03 0.00 -1.87 0.00 0.00 60.65 58.72 1eej h LYS 145 Cb 1.01 -0.04 -0.03 0.00 0.08 0.00 0.00 32.23 33.25 1eej h LYS 145 CO 0.62 0.13 -0.09 -0.91 -0.57 0.00 0.00 179.45 178.63 1eej h ASN 146 N 0.21 -0.28 -0.69 0.86 4.21 -1.94 0.37 115.58 118.33 1eej h ASN 146 Ca 0.16 0.05 -0.04 0.00 1.21 0.00 0.00 56.30 57.69 1eej h ASN 146 Cb 0.17 0.13 -0.03 0.00 -1.12 0.00 0.00 38.32 37.47 1eej h ASN 146 CO -0.20 -0.13 0.29 0.50 -1.29 0.00 0.00 177.43 176.60 1eej h LYS 147 N -0.12 1.02 -0.86 0.81 3.64 -1.97 -1.51 116.57 117.58 1eej h LYS 147 Ca 0.06 -0.18 -0.02 0.00 -1.27 0.00 0.00 60.65 59.24 1eej h LYS 147 Cb 0.21 -0.17 -0.04 0.00 -0.41 0.00 0.00 32.23 31.82 1eej h LYS 147 CO -0.14 0.84 0.45 0.00 -2.27 0.00 0.00 179.45 178.32 1eej h ALA 148 N 1.13 1.10 -0.27 5.00 0.00 -1.02 -0.52 119.26 124.68 1eej h ALA 148 Ca 0.23 -0.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 1eej h ALA 148 Cb 0.19 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 17.63 1eej h ALA 148 CO -0.02 0.63 -0.07 0.35 0.00 0.00 0.00 179.25 180.14 1eej h PHE 149 N 1.21 0.59 -0.32 0.00 3.04 -0.63 -2.05 116.94 118.78 1eej h PHE 149 Ca 0.30 -0.13 0.02 0.00 3.98 0.00 0.00 57.97 62.14 1eej h PHE 149 Cb 0.06 -0.14 -0.03 0.00 2.56 0.00 0.00 35.95 38.40 1eej h PHE 149 CO 0.01 0.73 0.16 -0.44 -2.02 0.00 0.00 178.31 176.75 1eej h ASP 150 N 0.27 0.24 -0.13 0.41 3.32 -0.98 -2.07 116.42 117.48 1eej h ASP 150 Ca 0.07 0.01 0.03 0.00 0.02 0.00 0.00 57.03 57.16 1eej h ASP 150 Cb 0.55 -0.03 -0.03 0.00 0.22 0.00 0.00 39.33 40.04 1eej h ASP 150 CO 0.03 0.18 -0.04 0.44 -1.72 0.00 0.00 179.24 178.13 1eej h ASP 151 N 0.34 -0.15 -0.50 6.45 3.32 -1.03 -0.37 116.42 124.48 1eej h ASP 151 Ca 0.13 0.04 0.05 0.00 0.02 0.00 0.00 57.03 57.28 1eej h ASP 151 Cb 0.04 0.09 -0.05 0.00 0.22 0.00 0.00 39.33 39.63 1eej h ASP 151 CO -0.09 -0.06 0.23 0.58 -1.72 0.00 0.00 179.24 178.18 1eej h VAL 152 N -0.02 0.91 -0.74 -1.35 2.07 -1.16 0.21 116.25 116.16 1eej h VAL 152 Ca 0.07 -0.15 -0.06 0.00 0.82 0.00 0.00 66.70 67.38 1eej h VAL 152 Cb 0.12 0.42 -0.03 0.00 -1.52 0.00 0.00 31.29 30.28 1eej h VAL 152 CO -0.14 0.08 0.25 0.24 0.02 0.00 0.00 177.57 178.01 1eej h MET 153 N 0.44 1.14 0.00 1.57 2.86 -1.08 -2.43 114.93 117.43 1eej h MET 153 Ca 0.23 -0.24 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 1eej h MET 153 Cb 0.18 -0.17 0.00 0.00 0.06 0.00 0.00 31.60 31.68 1eej h MET 153 CO -0.19 0.96 0.00 0.00 1.06 0.00 0.00 176.91 178.74 1eej n ALA 154 N -2.44 2.41 -1.45 6.32 0.00 -0.17 -4.86 120.51 120.31 1eej n ALA 154 Ca 0.06 -0.15 0.00 0.00 0.00 0.00 0.00 53.44 53.35 1eej n ALA 154 Cb 0.22 -1.40 0.00 0.00 0.00 0.00 0.00 19.45 18.27 1eej n ALA 154 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1eej n GLY 155 N 0.53 0.87 3.75 0.00 0.00 -0.75 -5.05 105.19 104.53 1eej n GLY 155 Ca 0.18 -0.60 -0.32 0.00 0.00 0.00 0.00 46.02 45.28 1eej n GLY 155 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1eej s LYS 156 N -3.16 2.91 -0.33 1.61 1.02 0.65 -5.01 119.74 117.43 1eej s LYS 156 Ca 0.00 -0.60 -0.29 0.00 0.02 0.00 0.00 55.97 55.11 1eej s LYS 156 Cb 0.00 -2.75 -0.01 0.00 -0.52 0.00 0.00 37.83 34.54 1eej s LYS 156 CO 0.00 0.61 1.72 -1.12 -0.92 0.00 0.00 175.35 175.64 1eej s SER 157 N -1.92 6.01 0.03 2.83 0.01 -1.26 -4.08 113.70 115.32 1eej s SER 157 Ca 0.24 1.27 -0.28 0.00 1.31 0.00 0.00 55.95 58.49 1eej s SER 157 Cb -0.12 -2.53 -0.04 0.00 0.21 0.00 0.00 66.02 63.54 1eej s SER 157 CO 0.16 -1.62 0.88 0.54 0.41 0.00 0.00 173.24 173.61 1eej s VAL 158 N 6.48 4.78 0.07 3.43 0.11 -1.26 -5.00 120.40 129.00 1eej s VAL 158 Ca 0.76 1.86 -0.31 0.00 -2.93 0.00 0.00 61.98 61.36 1eej s VAL 158 Cb -0.21 -4.22 -0.08 0.00 -1.53 0.00 0.00 36.38 30.33 1eej s VAL 158 CO 0.33 0.26 1.65 0.00 -3.33 0.00 0.00 175.10 174.01 1eej s ALA 159 N 0.48 3.68 0.72 1.54 0.00 -1.26 -4.96 121.76 121.96 1eej s ALA 159 Ca 0.45 1.20 -0.16 0.00 0.00 0.00 0.00 51.96 53.45 1eej s ALA 159 Cb -0.21 -3.69 0.02 0.00 0.00 0.00 0.00 23.12 19.24 1eej s ALA 159 CO 0.26 -1.10 1.20 -2.30 0.00 0.00 0.00 175.76 173.81 1eej n PRO 160 N 5.60 0.68 -3.57 0.00 -0.02 -1.26 -4.87 135.00 131.55 1eej n PRO 160 Ca 0.16 0.29 0.03 0.00 -2.02 0.00 0.00 63.50 61.96 1eej n PRO 160 Cb 0.41 -2.44 -0.00 0.00 -0.02 0.00 0.00 33.50 31.45 1eej n PRO 160 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1eej s ALA 161 N -1.72 -2.43 0.11 3.55 0.00 -1.26 -5.09 121.76 114.91 1eej s ALA 161 Ca 0.78 0.92 -0.03 0.00 0.00 0.00 0.00 51.96 53.62 1eej s ALA 161 Cb -0.34 0.24 -0.03 0.00 0.00 0.00 0.00 23.12 22.99 1eej s ALA 161 CO 0.46 -1.04 0.09 -1.54 0.00 0.00 0.00 175.76 173.72 1eej s SER 162 N -2.96 0.29 0.04 0.00 1.04 -1.26 -4.41 113.70 106.43 1eej s SER 162 Ca 0.15 -1.01 -0.11 0.00 0.48 0.00 0.00 55.95 55.46 1eej s SER 162 Cb 0.07 0.30 0.04 0.00 0.10 0.00 0.00 66.02 66.52 1eej s SER 162 CO -0.06 -0.72 0.49 0.00 0.98 0.00 0.00 173.24 173.94 1eej n ASP 164 N -0.72 0.00 -4.68 0.00 -0.08 -1.26 -4.72 116.55 105.08 1eej n ASP 164 Ca 0.00 0.06 -0.42 0.00 -1.51 0.00 0.00 54.79 52.92 1eej n ASP 164 Cb 0.25 -0.26 -0.03 0.00 2.34 0.00 0.00 41.12 43.42 1eej n ASP 164 CO 0.00 0.00 0.00 -0.69 0.12 0.00 0.00 177.20 176.63 1eej s VAL 165 N -2.53 4.05 -0.45 5.18 1.01 -1.26 -4.99 120.40 121.42 1eej s VAL 165 Ca 0.13 1.39 -0.02 0.00 0.00 0.00 0.00 61.98 63.48 1eej s VAL 165 Cb 0.09 -3.89 0.12 0.00 0.00 0.00 0.00 36.38 32.70 1eej s VAL 165 CO 0.20 -0.02 0.24 -0.62 0.00 0.00 0.00 175.10 174.90 1eej s ASP 166 N 1.70 5.14 0.56 3.32 -1.08 -1.26 -4.93 116.67 120.12 1eej s ASP 166 Ca 0.59 -2.27 0.31 0.00 -0.52 0.00 0.00 52.55 50.65 1eej s ASP 166 Cb -0.27 -1.80 1.46 0.00 -1.46 0.00 0.00 42.92 40.85 1eej s ASP 166 CO 0.23 -0.47 1.86 0.40 0.52 0.00 0.00 175.17 177.71 1eej h ILE 167 N 6.12 0.44 -0.84 4.11 1.08 -1.94 0.15 117.51 126.63 1eej h ILE 167 Ca -0.09 0.00 0.12 0.00 -0.39 0.00 0.00 64.86 64.50 1eej h ILE 167 Cb 1.02 0.55 -0.06 0.00 -3.07 0.00 0.00 36.82 35.25 1eej h ILE 167 CO 0.68 0.00 0.55 0.00 -0.69 0.00 0.00 178.15 178.69 1eej h ALA 168 N 1.46 1.82 -0.29 1.87 0.00 -1.93 -0.80 119.26 121.38 1eej h ALA 168 Ca 0.35 0.00 -0.14 0.00 0.00 0.00 0.00 54.91 55.12 1eej h ALA 168 Cb 1.58 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 19.22 1eej h ALA 168 CO -0.00 -0.02 -0.40 -0.44 0.00 0.00 0.00 179.25 178.38 1eej h ASP 169 N 0.69 0.75 -0.48 0.00 3.32 -1.09 0.11 116.42 119.71 1eej h ASP 169 Ca 0.41 -0.34 -0.09 0.00 0.02 0.00 0.00 57.03 57.03 1eej h ASP 169 Cb 0.61 -0.21 -0.02 0.00 0.22 0.00 0.00 39.33 39.94 1eej h ASP 169 CO -0.17 1.06 -0.07 0.45 -1.72 0.00 0.00 179.24 178.79 1eej h HIS 170 N 0.58 1.00 -0.13 4.55 3.86 -1.31 -1.25 115.15 122.45 1eej h HIS 170 Ca 0.05 -0.20 -0.01 0.00 -1.16 0.00 0.00 60.37 59.05 1eej h HIS 170 Cb 0.93 -0.25 -0.01 0.00 1.06 0.00 0.00 27.41 29.15 1eej h HIS 170 CO 0.05 0.96 0.02 -0.92 0.86 0.00 0.00 177.93 178.90 1eej h TYR 171 N 0.75 0.22 -0.32 2.45 3.20 -1.05 -1.02 116.97 121.20 1eej h TYR 171 Ca 0.13 -0.03 0.03 0.00 3.14 0.00 0.00 58.73 62.00 1eej h TYR 171 Cb 0.60 -0.06 -0.03 0.00 1.54 0.00 0.00 36.73 38.78 1eej h TYR 171 CO 0.04 0.38 0.13 0.00 -1.64 0.00 0.00 178.16 177.08 1eej h ALA 172 N 0.81 0.38 -0.35 1.82 0.00 -0.69 -0.79 119.26 120.44 1eej h ALA 172 Ca 0.04 0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1eej h ALA 172 Cb 0.28 -0.02 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 1eej h ALA 172 CO 0.00 -0.25 0.17 1.25 0.00 0.00 0.00 179.25 180.42 1eej h LEU 173 N 0.29 0.45 -0.17 0.00 5.85 -1.17 -1.84 115.31 118.71 1eej h LEU 173 Ca 0.14 -0.12 0.04 0.00 0.84 0.00 0.00 57.88 58.78 1eej h LEU 173 Cb 0.08 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 40.96 1eej h LEU 173 CO -0.12 0.44 -0.08 1.23 -0.34 0.00 0.00 178.44 179.57 1eej h GLY 174 N 0.42 0.07 0.40 3.75 0.00 -0.84 -0.02 103.07 106.85 1eej h GLY 174 Ca 0.12 0.10 0.08 0.00 0.00 0.00 0.00 47.33 47.63 1eej h GLY 174 CO -0.02 -0.10 0.08 -2.08 0.00 0.00 0.00 176.54 174.43 1eej h VAL 175 N -0.06 0.74 -0.82 4.60 2.07 -0.97 -0.02 116.25 121.79 1eej h VAL 175 Ca 0.09 -0.07 0.00 0.00 0.82 0.00 0.00 66.70 67.54 1eej h VAL 175 Cb 0.20 0.51 -0.04 0.00 -1.52 0.00 0.00 31.29 30.44 1eej h VAL 175 CO -0.21 0.04 0.52 1.56 0.02 0.00 0.00 177.57 179.50 1eej h GLN 176 N 0.22 1.09 0.00 1.57 4.20 -0.77 -0.98 115.11 120.44 1eej h GLN 176 Ca 0.23 -0.08 0.00 0.00 0.06 0.00 0.00 58.65 58.85 1eej h GLN 176 Cb 0.30 -0.24 0.00 0.00 0.30 0.00 0.00 27.48 27.84 1eej h GLN 176 CO -0.30 0.75 0.00 1.28 -0.67 0.00 0.00 178.83 179.89 1eej n LEU 177 N -4.48 0.31 0.00 1.46 4.77 -0.07 -4.86 117.00 114.12 1eej n LEU 177 Ca 0.08 0.58 0.00 0.00 -0.03 0.00 0.00 56.01 56.64 1eej n LEU 177 Cb 0.04 -0.54 0.00 0.00 -2.33 0.00 0.00 43.42 40.59 1eej n LEU 177 CO 0.37 -0.40 0.00 0.61 -1.33 0.00 0.00 177.39 176.64 1eej n GLY 178 N -0.03 1.02 3.63 -0.72 0.00 -0.37 -4.80 105.19 103.93 1eej n GLY 178 Ca 0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.62 1eej n GLY 178 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1eej s VAL 179 N -2.00 3.12 -0.24 1.61 1.01 -0.12 -4.86 120.40 118.93 1eej s VAL 179 Ca 0.00 0.14 0.10 0.00 0.00 0.00 0.00 61.98 62.22 1eej s VAL 179 Cb 0.00 -3.12 0.45 0.00 0.00 0.00 0.00 36.38 33.71 1eej s VAL 179 CO 0.00 -0.05 1.31 -1.54 0.00 0.00 0.00 175.10 174.83 1eej n SER 180 N 9.23 2.02 0.00 3.32 3.41 -1.26 -4.64 113.62 125.70 1eej n SER 180 Ca 0.23 -3.87 0.00 0.00 -0.26 0.00 0.00 58.87 54.98 1eej n SER 180 Cb 0.43 -0.57 0.00 0.00 -0.26 0.00 0.00 64.21 63.81 1eej n SER 180 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1eej n GLY 181 N -1.12 2.40 3.15 5.00 0.00 -1.26 -5.10 105.19 108.26 1eej n GLY 181 Ca 0.25 -1.34 -0.18 0.00 0.00 0.00 0.00 46.02 44.75 1eej n GLY 181 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1eej s THR 182 N -1.99 1.04 0.47 2.61 -4.23 -1.26 -3.97 115.64 108.31 1eej s THR 182 Ca 0.00 -1.23 -0.20 0.00 -1.18 0.00 0.00 61.69 59.08 1eej s THR 182 Cb 0.00 -1.00 -0.09 0.00 1.34 0.00 0.00 72.50 72.75 1eej s THR 182 CO 0.00 -0.21 0.99 -2.16 -0.54 0.00 0.00 174.62 172.70 1eej s PRO 183 N -1.63 3.98 -0.08 3.99 0.04 -1.26 -4.71 135.00 135.33 1eej s PRO 183 Ca -0.02 1.16 0.02 0.00 0.04 0.00 0.00 61.00 62.20 1eej s PRO 183 Cb -0.10 -2.14 0.01 0.00 0.04 0.00 0.00 34.50 32.32 1eej s PRO 183 CO 0.02 -0.25 -0.13 0.00 0.04 0.00 0.00 177.00 176.68 1eej s ALA 184 N -2.23 1.43 -0.15 8.56 0.00 -0.94 -0.17 121.76 128.26 1eej s ALA 184 Ca 0.63 -0.54 -0.11 0.00 0.00 0.00 0.00 51.96 51.94 1eej s ALA 184 Cb -0.12 -0.69 -0.05 0.00 0.00 0.00 0.00 23.12 22.26 1eej s ALA 184 CO 0.20 0.01 0.23 0.08 0.00 0.00 0.00 175.76 176.28 1eej s VAL 185 N 0.86 5.35 -0.22 0.00 1.01 -0.64 -0.94 120.40 125.81 1eej s VAL 185 Ca -0.10 0.41 -0.04 0.00 0.00 0.00 0.00 61.98 62.26 1eej s VAL 185 Cb -0.15 -3.55 -0.00 0.00 0.00 0.00 0.00 36.38 32.67 1eej s VAL 185 CO 0.01 0.47 -0.04 -0.69 0.00 0.00 0.00 175.10 174.85 1eej s VAL 186 N -0.03 3.31 0.73 2.92 1.01 0.87 0.36 120.40 129.57 1eej s VAL 186 Ca 0.15 -0.56 -0.11 0.00 0.00 0.00 0.00 61.98 61.45 1eej s VAL 186 Cb -0.13 -2.53 0.03 0.00 0.00 0.00 0.00 36.38 33.76 1eej s VAL 186 CO 0.03 0.39 1.08 -0.76 0.00 0.00 0.00 175.10 175.84 1eej s LEU 187 N 1.46 2.89 0.00 3.92 1.43 0.24 -2.06 118.68 126.56 1eej s LEU 187 Ca 0.05 1.42 0.00 0.00 -1.03 0.00 0.00 54.13 54.57 1eej s LEU 187 Cb -0.14 -4.19 0.00 0.00 0.03 0.00 0.00 46.19 41.88 1eej s LEU 187 CO -0.04 -1.61 0.95 -1.54 0.23 0.00 0.00 176.35 174.35 1eej n SER 188 N -3.21 0.00 -0.60 2.29 3.41 -1.26 -0.68 113.62 113.57 1eej n SER 188 Ca 0.07 0.45 0.07 0.00 -0.26 0.00 0.00 58.87 59.20 1eej n SER 188 Cb 0.55 -0.45 0.07 0.00 -0.26 0.00 0.00 64.21 64.12 1eej n SER 188 CO 0.00 0.00 0.00 -0.46 -0.16 0.00 0.00 175.04 174.42 1eej n ASN 189 N -1.45 2.27 0.00 4.04 6.94 -1.26 -4.98 115.26 120.82 1eej n ASN 189 Ca 0.00 -1.63 0.00 0.00 -0.02 0.00 0.00 54.58 52.93 1eej n ASN 189 Cb 0.01 -0.02 0.00 0.00 -2.36 0.00 0.00 39.78 37.41 1eej n ASN 189 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1eej n GLY 190 N 0.81 0.82 3.70 4.83 0.00 0.14 -4.32 105.19 111.18 1eej n GLY 190 Ca 0.09 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.69 1eej n GLY 190 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1eej s THR 191 N -2.20 2.60 -0.21 2.61 2.01 -1.26 -4.68 115.64 114.51 1eej s THR 191 Ca 0.00 0.24 -0.15 0.00 0.31 0.00 0.00 61.69 62.09 1eej s THR 191 Cb 0.00 -3.15 -0.04 0.00 0.01 0.00 0.00 72.50 69.32 1eej s THR 191 CO 0.00 0.01 0.37 -0.22 -0.69 0.00 0.00 174.62 174.09 1eej s LEU 192 N 2.13 4.14 -0.48 4.42 2.96 -1.26 -0.59 118.68 130.00 1eej s LEU 192 Ca 0.76 0.46 0.03 0.00 -0.22 0.00 0.00 54.13 55.16 1eej s LEU 192 Cb -0.44 -2.47 0.13 0.00 0.50 0.00 0.00 46.19 43.90 1eej s LEU 192 CO 0.33 -0.07 0.23 -0.69 -1.32 0.00 0.00 176.35 174.83 1eej s VAL 193 N 1.36 2.26 0.46 1.68 1.01 0.16 -4.99 120.40 122.34 1eej s VAL 193 Ca 0.18 -3.00 -0.24 0.00 0.00 0.00 0.00 61.98 58.92 1eej s VAL 193 Cb -0.15 -2.59 -0.07 0.00 0.00 0.00 0.00 36.38 33.57 1eej s VAL 193 CO 0.08 -0.79 1.27 -2.84 0.00 0.00 0.00 175.10 172.82 1eej s PRO 194 N 0.03 3.69 0.00 2.72 0.02 -1.26 -1.62 135.00 138.58 1eej s PRO 194 Ca 0.16 2.05 0.00 0.00 0.02 0.00 0.00 61.00 63.23 1eej s PRO 194 Cb -0.25 -2.52 0.00 0.00 0.02 0.00 0.00 34.50 31.76 1eej s PRO 194 CO -0.02 -0.69 0.00 0.41 -0.33 0.00 0.00 177.00 176.37 1eej n GLY 195 N 0.61 2.77 3.79 0.52 0.00 0.76 -4.90 105.19 108.75 1eej n GLY 195 Ca 0.07 -1.92 -0.39 0.00 0.00 0.00 0.00 46.02 43.78 1eej n GLY 195 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1eej s TYR 196 N -2.90 3.76 -0.02 1.61 5.04 -1.26 -4.64 117.35 118.94 1eej s TYR 196 Ca 0.00 1.26 0.00 0.00 -2.44 0.00 0.00 57.07 55.89 1eej s TYR 196 Cb 0.00 -2.55 0.03 0.00 0.35 0.00 0.00 41.96 39.79 1eej s TYR 196 CO 0.00 0.49 0.02 -0.65 -1.34 0.00 0.00 175.55 174.07 1eej s GLN 197 N -0.75 0.08 0.78 4.97 -0.21 -1.26 -5.09 119.66 118.17 1eej s GLN 197 Ca 0.30 0.16 -0.13 0.00 0.02 0.00 0.00 55.36 55.71 1eej s GLN 197 Cb -0.19 -0.35 0.06 0.00 1.00 0.00 0.00 33.01 33.54 1eej s GLN 197 CO 0.18 -0.17 1.17 -2.14 -2.12 0.00 0.00 175.29 172.22 1eej s PRO 198 N 1.12 1.92 0.23 2.91 0.02 -1.26 -4.52 135.00 135.42 1eej s PRO 198 Ca -0.08 1.62 -0.15 0.00 0.02 0.00 0.00 61.00 62.41 1eej s PRO 198 Cb -0.13 -1.82 0.28 0.00 0.02 0.00 0.00 34.50 32.84 1eej s PRO 198 CO -0.03 -1.98 1.58 -1.35 -0.33 0.00 0.00 177.00 174.89 1eej h PRO 199 N -0.75 -0.04 0.21 5.54 0.11 -1.94 0.33 132.00 135.46 1eej h PRO 199 Ca -0.46 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.64 1eej h PRO 199 Cb 1.28 0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.40 1eej h PRO 199 CO 0.48 -0.03 -0.10 0.87 -0.21 0.00 0.00 178.00 179.01 1eej h LYS 200 N -0.04 -0.27 -0.52 1.05 1.57 -1.93 -0.64 116.57 115.79 1eej h LYS 200 Ca 0.35 0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 59.13 1eej h LYS 200 Cb 0.60 0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.95 1eej h LYS 200 CO -0.87 -0.18 0.24 0.93 -0.57 0.00 0.00 179.45 179.00 1eej h GLU 201 N -0.28 0.76 -0.33 3.15 3.07 -1.73 -1.93 114.58 117.29 1eej h GLU 201 Ca -0.03 -0.12 0.05 0.00 -0.50 0.00 0.00 59.36 58.76 1eej h GLU 201 Cb 0.22 -0.13 -0.05 0.00 -0.84 0.00 0.00 28.75 27.95 1eej h GLU 201 CO 0.04 0.64 0.05 1.98 -1.40 0.00 0.00 179.01 180.32 1eej h MET 202 N 0.70 0.15 -0.45 2.33 4.05 -0.22 0.12 114.93 121.61 1eej h MET 202 Ca 0.18 -0.01 0.02 0.00 -0.28 0.00 0.00 59.70 59.61 1eej h MET 202 Cb 0.14 -0.03 -0.03 0.00 -0.80 0.00 0.00 31.60 30.88 1eej h MET 202 CO -0.02 0.10 0.26 -0.22 0.23 0.00 0.00 176.91 177.26 1eej h LYS 203 N 0.15 0.50 -0.80 0.39 1.63 -0.89 -0.35 116.57 117.21 1eej h LYS 203 Ca 0.15 -0.03 -0.05 0.00 -0.85 0.00 0.00 60.65 59.88 1eej h LYS 203 Cb 0.18 -0.11 -0.04 0.00 -0.60 0.00 0.00 32.23 31.66 1eej h LYS 203 CO -0.22 0.33 0.32 1.49 -3.45 0.00 0.00 179.45 177.93 1eej h GLU 204 N 0.52 1.20 -0.24 1.90 4.57 -0.80 -1.16 114.58 120.58 1eej h GLU 204 Ca 0.18 -0.22 -0.01 0.00 -1.18 0.00 0.00 59.36 58.14 1eej h GLU 204 Cb 0.03 -0.20 -0.01 0.00 -0.16 0.00 0.00 28.75 28.41 1eej h GLU 204 CO -0.09 0.97 0.12 0.35 -1.18 0.00 0.00 179.01 179.18 1eej h PHE 205 N 1.17 0.34 -0.51 0.92 3.57 -0.20 -1.27 116.94 120.96 1eej h PHE 205 Ca 0.27 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.74 1eej h PHE 205 Cb 0.21 -0.11 -0.02 0.00 2.79 0.00 0.00 35.95 38.82 1eej h PHE 205 CO 0.02 0.31 0.26 -0.07 -2.23 0.00 0.00 178.31 176.60 1eej h LEU 206 N 0.26 0.65 -0.23 0.59 3.38 -0.84 0.12 115.31 119.24 1eej h LEU 206 Ca 0.08 -0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1eej h LEU 206 Cb 0.10 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.67 1eej h LEU 206 CO -0.01 0.58 0.15 0.44 0.09 0.00 0.00 178.44 179.69 1eej h ASP 207 N 0.68 0.26 0.12 -0.43 3.32 -1.04 -1.36 116.42 117.96 1eej h ASP 207 Ca 0.18 -0.00 -0.08 0.00 0.02 0.00 0.00 57.03 57.14 1eej h ASP 207 Cb 0.09 -0.06 -0.01 0.00 0.22 0.00 0.00 39.33 39.57 1eej h ASP 207 CO -0.02 0.19 -0.28 -0.33 -1.72 0.00 0.00 179.24 177.07 1eej h GLU 208 N 0.31 0.26 -0.52 3.56 4.39 -1.08 -2.53 114.58 118.97 1eej h GLU 208 Ca 0.09 -0.09 -0.08 0.00 0.34 0.00 0.00 59.36 59.62 1eej h GLU 208 Cb -0.03 -0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 28.58 1eej h GLU 208 CO -0.02 0.52 0.01 1.25 -1.16 0.00 0.00 179.01 179.61 1eej h HIS 209 N 0.23 0.93 0.33 4.33 2.76 -0.47 0.46 115.15 123.71 1eej h HIS 209 Ca 0.03 -0.14 -0.02 0.00 -2.20 0.00 0.00 60.37 58.05 1eej h HIS 209 Cb 0.62 -0.25 0.00 0.00 1.55 0.00 0.00 27.41 29.33 1eej h HIS 209 CO 0.01 0.84 -0.16 1.96 -1.30 0.00 0.00 177.93 179.29 1eej h GLN 210 N 0.81 -0.42 -0.37 5.26 1.08 -0.85 -0.66 115.11 119.96 1eej h GLN 210 Ca 0.16 0.03 -0.01 0.00 -1.45 0.00 0.00 58.65 57.38 1eej h GLN 210 Cb 0.47 0.10 -0.02 0.00 -0.05 0.00 0.00 27.48 27.98 1eej h GLN 210 CO 0.02 -0.24 0.20 0.87 -0.95 0.00 0.00 178.83 178.73 1eej h LYS 211 N -0.50 0.53 0.00 1.46 1.57 -1.33 0.32 116.57 118.62 1eej h LYS 211 Ca -0.04 -0.07 -0.01 0.00 -1.87 0.00 0.00 60.65 58.66 1eej h LYS 211 Cb 0.38 -0.10 -0.00 0.00 0.08 0.00 0.00 32.23 32.59 1eej h LYS 211 CO 0.07 0.44 -0.06 0.52 -0.57 0.00 0.00 179.45 179.85 1eej h MET 212 N 0.47 0.00 0.00 3.15 2.86 -0.87 -1.52 114.93 119.02 1eej h MET 212 Ca 0.13 0.00 -0.02 0.00 -2.06 0.00 0.00 59.70 57.75 1eej h MET 212 Cb 0.08 0.00 -0.00 0.00 0.06 0.00 0.00 31.60 31.73 1eej h MET 212 CO -0.02 0.06 -1.68 2.41 1.06 0.00 0.00 176.91 178.74 1eej n THR 213 N -3.22 0.31 0.00 2.22 -1.04 -0.26 -4.72 114.28 107.57 1eej n THR 213 Ca -0.00 -0.54 0.00 0.00 -2.04 0.00 0.00 64.05 61.47 1eej n THR 213 Cb 0.30 -0.16 0.00 0.00 -1.82 0.00 0.00 70.33 68.65 1eej n THR 213 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 1eej n SER 214 N -2.44 0.00 0.00 8.00 2.88 0.11 -5.06 113.62 117.11 1eej n SER 214 Ca -0.04 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.50 1eej n SER 214 Cb 0.60 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.06 1eej n SER 214 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1eej n GLY 215 N 2.70 0.06 0.00 0.46 0.00 -0.61 -5.06 105.19 102.74 1eej n GLY 215 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1eej n GLY 215 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60