#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 0.34 -0.19 1.67 5.19 -1.99 -1.85 116.42 119.60 1eej h ASP 2 Ca 0.00 0.04 -0.01 0.00 -0.62 0.00 0.00 57.03 56.43 1eej h ASP 2 Cb 0.00 -0.03 -0.01 0.00 0.18 0.00 0.00 39.33 39.48 1eej h ASP 2 CO 0.00 0.13 0.06 0.00 -3.12 0.00 0.00 179.24 176.31 1eej h ALA 3 N 1.61 0.25 -0.68 3.45 0.00 -2.00 -1.62 119.26 120.27 1eej h ALA 3 Ca 0.46 -0.13 -0.05 0.00 0.00 0.00 0.00 54.91 55.19 1eej h ALA 3 Cb 1.26 -0.07 -0.03 0.00 0.00 0.00 0.00 17.79 18.95 1eej h ALA 3 CO -0.15 -0.13 0.23 0.00 0.00 0.00 0.00 179.25 179.20 1eej h ALA 4 N 0.88 1.12 -0.47 0.00 0.00 -1.67 -2.50 119.26 116.63 1eej h ALA 4 Ca 0.06 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.74 1eej h ALA 4 Cb 0.23 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1eej h ALA 4 CO -0.00 0.61 0.17 0.82 0.00 0.00 0.00 179.25 180.85 1eej h ILE 5 N 1.00 1.22 -0.09 0.00 2.04 -1.27 -2.51 117.51 117.90 1eej h ILE 5 Ca 0.22 -0.69 -0.08 0.00 1.00 0.00 0.00 64.86 65.31 1eej h ILE 5 Cb 0.25 0.79 -0.01 0.00 -0.74 0.00 0.00 36.82 37.11 1eej h ILE 5 CO -0.01 0.26 -0.31 1.56 0.00 0.00 0.00 178.15 179.65 1eej h GLN 6 N 0.62 0.16 -0.31 2.37 4.20 -1.11 -2.03 115.11 119.01 1eej h GLN 6 Ca 0.15 -0.06 -0.08 0.00 0.06 0.00 0.00 58.65 58.72 1eej h GLN 6 Cb 0.23 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 27.99 1eej h GLN 6 CO -0.01 0.46 -0.12 1.96 -0.67 0.00 0.00 178.83 180.45 1eej h GLN 7 N 0.15 0.64 -0.22 1.46 1.08 -1.25 -0.18 115.11 116.78 1eej h GLN 7 Ca 0.02 -0.27 -0.01 0.00 -1.45 0.00 0.00 58.65 56.95 1eej h GLN 7 Cb 0.62 -0.02 -0.01 0.00 -0.05 0.00 0.00 27.48 28.02 1eej h GLN 7 CO 0.05 0.84 0.12 1.15 -0.95 0.00 0.00 178.83 180.04 1eej h THR 8 N 0.40 1.12 -0.84 -0.54 2.02 -1.25 -0.74 112.91 113.09 1eej h THR 8 Ca 0.07 -0.32 -0.00 0.00 0.77 0.00 0.00 66.41 66.93 1eej h THR 8 Cb 0.64 0.92 -0.04 0.00 -1.74 0.00 0.00 68.15 67.93 1eej h THR 8 CO 0.04 0.11 0.52 -0.07 0.37 0.00 0.00 175.52 176.49 1eej h LEU 9 N 0.25 0.99 -0.29 2.58 3.38 -1.30 -2.33 115.31 118.60 1eej h LEU 9 Ca 0.08 -0.05 -0.00 0.00 0.09 0.00 0.00 57.88 58.00 1eej h LEU 9 Cb 0.08 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.56 1eej h LEU 9 CO -0.01 0.75 0.17 0.00 0.09 0.00 0.00 178.44 179.44 1eej h ALA 10 N 1.42 0.37 -0.11 1.53 0.00 -0.48 0.13 119.26 122.13 1eej h ALA 10 Ca 0.30 -0.05 0.03 0.00 0.00 0.00 0.00 54.91 55.19 1eej h ALA 10 Cb -0.07 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.60 1eej h ALA 10 CO -0.06 -0.12 0.10 0.87 0.00 0.00 0.00 179.25 180.03 1eej h LYS 11 N 0.37 0.00 -0.01 0.00 1.79 -0.63 -0.75 116.57 117.34 1eej h LYS 11 Ca 0.10 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.57 1eej h LYS 11 Cb 0.02 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.67 1eej h LYS 11 CO -0.02 0.00 -0.34 -1.33 -1.08 0.00 0.00 179.45 176.68 1eej n MET 12 N -4.13 0.97 -1.06 3.15 2.81 -0.63 -4.94 117.12 113.28 1eej n MET 12 Ca -0.00 -0.67 -0.02 0.00 -1.81 0.00 0.00 57.70 55.19 1eej n MET 12 Cb 0.21 -1.49 -0.01 0.00 -0.71 0.00 0.00 33.22 31.22 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 1.37 0.56 3.81 3.03 0.00 -0.29 -5.02 105.19 108.65 1eej n GLY 13 Ca 0.11 -0.73 -0.36 0.00 0.00 0.00 0.00 46.02 45.03 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 -2.05 5.43 -0.16 -0.61 1.01 0.31 -5.00 121.20 120.14 1eej s ILE 14 Ca 0.00 0.26 -0.02 0.00 0.00 0.00 0.00 60.65 60.89 1eej s ILE 14 Cb 0.00 -3.46 -0.02 0.00 0.01 0.00 0.00 42.46 38.99 1eej s ILE 14 CO 0.00 0.54 -0.08 -0.75 0.00 0.00 0.00 174.94 174.65 1eej s LYS 15 N -0.42 3.49 0.21 2.79 2.47 -1.26 -3.90 119.74 123.12 1eej s LYS 15 Ca 0.13 -0.61 0.02 0.00 -1.56 0.00 0.00 55.97 53.95 1eej s LYS 15 Cb -0.12 -2.80 -0.03 0.00 -1.46 0.00 0.00 37.83 33.41 1eej s LYS 15 CO 0.02 0.15 0.36 -1.54 0.16 0.00 0.00 175.35 174.50 1eej s SER 16 N 0.56 6.34 0.00 1.43 1.04 -1.26 -1.26 113.70 120.55 1eej s SER 16 Ca -0.05 0.22 0.00 0.00 0.48 0.00 0.00 55.95 56.60 1eej s SER 16 Cb -0.15 -1.93 0.00 0.00 0.10 0.00 0.00 66.02 64.04 1eej s SER 16 CO 0.03 -0.05 0.00 -1.54 0.98 0.00 0.00 173.24 172.67 1eej n SER 17 N -0.97 1.89 -3.66 7.02 3.41 -0.12 -4.97 113.62 116.22 1eej n SER 17 Ca -0.07 -0.07 -0.10 0.00 -0.26 0.00 0.00 58.87 58.37 1eej n SER 17 Cb 0.55 0.51 -0.08 0.00 -0.26 0.00 0.00 64.21 64.93 1eej n SER 17 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1eej s ASP 18 N -0.89 -0.73 -0.05 4.04 2.15 -1.22 -5.01 116.67 114.95 1eej s ASP 18 Ca 0.00 1.25 0.02 0.00 0.43 0.00 0.00 52.55 54.25 1eej s ASP 18 Cb 0.00 1.17 0.02 0.00 -0.30 0.00 0.00 42.92 43.80 1eej s ASP 18 CO 0.00 -0.22 -0.09 -0.63 -0.17 0.00 0.00 175.17 174.06 1eej s ILE 19 N 1.16 0.86 0.06 4.11 1.01 -1.26 -0.23 121.20 126.90 1eej s ILE 19 Ca -0.07 -0.33 0.01 0.00 0.00 0.00 0.00 60.65 60.27 1eej s ILE 19 Cb -0.06 -0.81 -0.03 0.00 0.01 0.00 0.00 42.46 41.57 1eej s ILE 19 CO -0.11 0.29 -0.05 -1.10 0.00 0.00 0.00 174.94 173.96 1eej s GLN 20 N 0.70 0.60 0.22 2.79 -1.52 0.21 -4.98 119.66 117.69 1eej s GLN 20 Ca -0.12 -1.01 -0.30 0.00 -1.95 0.00 0.00 55.36 51.97 1eej s GLN 20 Cb -0.15 -0.08 -0.09 0.00 -0.22 0.00 0.00 33.01 32.47 1eej s GLN 20 CO 0.02 -0.03 1.37 -2.14 -0.25 0.00 0.00 175.29 174.27 1eej s PRO 21 N -2.78 4.33 0.59 2.91 0.02 -1.26 0.52 135.00 139.32 1eej s PRO 21 Ca -0.00 2.17 -0.09 0.00 0.02 0.00 0.00 61.00 63.10 1eej s PRO 21 Cb -0.01 -3.15 -0.02 0.00 0.02 0.00 0.00 34.50 31.33 1eej s PRO 21 CO -0.04 -0.33 0.95 0.00 -0.33 0.00 0.00 177.00 177.25 1eej s ALA 22 N 0.06 3.18 -0.54 -1.55 0.00 -0.50 -4.56 121.76 117.86 1eej s ALA 22 Ca 0.58 -0.34 0.21 0.00 0.00 0.00 0.00 51.96 52.41 1eej s ALA 22 Cb -0.39 -2.86 0.91 0.00 0.00 0.00 0.00 23.12 20.78 1eej s ALA 22 CO 0.40 -0.68 1.64 -2.30 0.00 0.00 0.00 175.76 174.82 1eej n PRO 23 N -2.63 0.15 -3.48 0.00 -0.02 -1.26 -4.57 135.00 123.19 1eej n PRO 23 Ca 0.04 0.43 -0.38 0.00 -2.02 0.00 0.00 63.50 61.58 1eej n PRO 23 Cb 0.55 -1.81 -0.08 0.00 -0.02 0.00 0.00 33.50 32.14 1eej n PRO 23 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1eej s VAL 24 N -3.29 5.25 0.24 -1.45 1.01 -1.26 -5.04 120.40 115.86 1eej s VAL 24 Ca 0.03 0.53 -0.30 0.00 0.00 0.00 0.00 61.98 62.23 1eej s VAL 24 Cb 0.08 -3.65 -0.14 0.00 0.00 0.00 0.00 36.38 32.67 1eej s VAL 24 CO 0.33 0.28 1.16 0.00 0.00 0.00 0.00 175.10 176.87 1eej n ALA 25 N 4.40 -0.12 -0.97 5.51 0.00 -1.26 -1.82 120.51 126.26 1eej n ALA 25 Ca -0.11 0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.76 1eej n ALA 25 Cb 0.51 -2.08 0.00 0.00 0.00 0.00 0.00 19.45 17.88 1eej n ALA 25 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1eej n GLY 26 N 1.70 0.47 3.38 0.00 0.00 -1.26 -5.00 105.19 104.47 1eej n GLY 26 Ca 0.12 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.94 1eej n GLY 26 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1eej s MET 27 N -0.45 1.43 0.03 1.61 1.00 -0.75 -0.35 119.30 121.82 1eej s MET 27 Ca 0.00 -1.70 0.01 0.00 0.00 0.00 0.00 55.69 54.00 1eej s MET 27 Cb 0.00 -1.01 -0.02 0.00 0.00 0.00 0.00 34.83 33.80 1eej s MET 27 CO 0.00 0.04 -0.05 0.15 0.00 0.00 0.00 175.02 175.17 1eej s LYS 28 N -3.74 0.39 -0.25 2.03 1.02 -0.07 -1.40 119.74 117.72 1eej s LYS 28 Ca 0.27 -0.65 -0.17 0.00 0.02 0.00 0.00 55.97 55.45 1eej s LYS 28 Cb 0.03 -0.07 -0.03 0.00 -0.52 0.00 0.00 37.83 37.24 1eej s LYS 28 CO 0.10 -0.00 0.45 0.99 -0.92 0.00 0.00 175.35 175.96 1eej s THR 29 N -1.37 5.13 -0.17 2.17 2.01 0.18 -1.93 115.64 121.66 1eej s THR 29 Ca -0.13 0.76 0.01 0.00 0.31 0.00 0.00 61.69 62.64 1eej s THR 29 Cb -0.10 -3.77 0.03 0.00 0.01 0.00 0.00 72.50 68.67 1eej s THR 29 CO -0.00 0.15 -0.16 -0.69 -0.69 0.00 0.00 174.62 173.23 1eej s VAL 30 N 1.98 1.80 -0.19 3.82 1.01 0.22 -0.62 120.40 128.43 1eej s VAL 30 Ca 0.19 -0.85 -0.23 0.00 0.00 0.00 0.00 61.98 61.09 1eej s VAL 30 Cb -0.15 -1.70 -0.02 0.00 0.00 0.00 0.00 36.38 34.51 1eej s VAL 30 CO 0.09 0.42 0.73 -0.22 0.00 0.00 0.00 175.10 176.12 1eej s LEU 31 N 1.38 4.16 0.35 3.92 2.96 0.68 -0.25 118.68 131.87 1eej s LEU 31 Ca 0.03 1.00 0.03 0.00 -0.22 0.00 0.00 54.13 54.98 1eej s LEU 31 Cb -0.14 -3.06 -0.04 0.00 0.50 0.00 0.00 46.19 43.46 1eej s LEU 31 CO -0.11 -0.34 0.13 0.42 -1.32 0.00 0.00 176.35 175.13 1eej s THR 32 N 2.04 0.59 -2.00 3.68 -4.23 -0.56 -0.94 115.64 114.22 1eej s THR 32 Ca 0.33 -2.00 0.13 0.00 -1.18 0.00 0.00 61.69 58.97 1eej s THR 32 Cb -0.16 -2.50 0.37 0.00 1.34 0.00 0.00 72.50 71.55 1eej s THR 32 CO 0.11 0.00 1.34 -0.46 -0.54 0.00 0.00 174.62 175.07 1eej n ASN 33 N -1.03 0.00 -0.32 3.99 6.94 -0.39 -1.22 115.26 123.24 1eej n ASN 33 Ca -0.02 -1.15 0.04 0.00 -0.02 0.00 0.00 54.58 53.43 1eej n ASN 33 Cb 0.65 0.00 0.09 0.00 -2.36 0.00 0.00 39.78 38.16 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 -0.76 2.53 0.00 0.53 7.64 -1.26 -5.02 113.62 117.27 1eej n SER 34 Ca 0.10 -2.18 0.00 0.00 1.01 0.00 0.00 58.87 57.80 1eej n SER 34 Cb 0.05 -0.17 0.00 0.00 -1.01 0.00 0.00 64.21 63.08 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 -0.21 -3.53 3.67 0.23 0.00 -0.36 -4.93 105.19 100.05 1eej n GLY 35 Ca 0.07 -2.14 -0.43 0.00 0.00 0.00 0.00 46.02 43.53 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 -0.88 4.74 0.27 1.61 1.01 -1.26 -1.49 120.40 124.39 1eej s VAL 36 Ca 0.00 1.98 0.11 0.00 0.00 0.00 0.00 61.98 64.07 1eej s VAL 36 Cb 0.00 -4.29 -0.05 0.00 0.00 0.00 0.00 36.38 32.04 1eej s VAL 36 CO 0.00 -0.10 -0.13 -0.76 0.00 0.00 0.00 175.10 174.11 1eej s LEU 37 N 2.71 2.80 -0.22 3.92 1.43 0.65 -4.73 118.68 125.24 1eej s LEU 37 Ca 0.45 -0.89 -0.02 0.00 -1.03 0.00 0.00 54.13 52.64 1eej s LEU 37 Cb -0.16 -1.32 0.01 0.00 0.03 0.00 0.00 46.19 44.75 1eej s LEU 37 CO 0.10 0.03 -0.08 -0.31 0.23 0.00 0.00 176.35 176.32 1eej s TYR 38 N -2.41 2.96 0.00 0.29 2.02 -0.66 -0.61 117.35 118.95 1eej s TYR 38 Ca 0.30 -1.35 0.07 0.00 -0.37 0.00 0.00 57.07 55.72 1eej s TYR 38 Cb -0.06 -2.05 -0.02 0.00 -0.40 0.00 0.00 41.96 39.44 1eej s TYR 38 CO 0.17 -0.68 -0.21 0.42 -1.57 0.00 0.00 175.55 173.67 1eej s ILE 39 N 1.37 1.69 0.59 2.71 1.01 -0.81 0.27 121.20 128.04 1eej s ILE 39 Ca 0.03 -1.01 -0.17 0.00 0.00 0.00 0.00 60.65 59.50 1eej s ILE 39 Cb -0.15 -1.43 -0.03 0.00 0.01 0.00 0.00 42.46 40.86 1eej s ILE 39 CO -0.06 0.39 1.10 0.42 0.00 0.00 0.00 174.94 176.79 1eej s THR 40 N -0.60 3.37 0.56 2.92 -4.23 -0.63 -0.89 115.64 116.13 1eej s THR 40 Ca 0.08 0.72 0.31 0.00 -1.18 0.00 0.00 61.69 61.63 1eej s THR 40 Cb -0.08 -3.24 0.46 0.00 1.34 0.00 0.00 72.50 70.97 1eej s THR 40 CO 0.00 -0.31 1.86 0.44 -0.54 0.00 0.00 174.62 176.07 1eej h ASP 41 N 0.62 0.00 0.19 3.99 3.32 -1.02 0.20 116.42 123.72 1eej h ASP 41 Ca -0.48 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.57 1eej h ASP 41 Cb 1.24 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.79 1eej h ASP 41 CO 0.56 0.00 -0.11 -0.90 -1.72 0.00 0.00 179.24 177.07 1eej n ASP 42 N -4.05 0.84 -1.00 6.45 5.68 -1.26 -1.33 116.55 121.88 1eej n ASP 42 Ca 0.16 -0.94 -0.12 0.00 -0.50 0.00 0.00 54.79 53.38 1eej n ASP 42 Cb 0.92 0.01 -0.05 0.00 -1.14 0.00 0.00 41.12 40.86 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 1.18 0.02 6.12 0.00 0.71 -4.71 105.19 109.74 1eej n GLY 43 Ca 0.16 -0.44 0.11 0.00 0.00 0.00 0.00 46.02 45.84 1eej n GLY 43 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1eej n LYS 44 N -2.59 0.51 -4.31 1.61 5.02 -1.26 -4.80 118.16 112.34 1eej n LYS 44 Ca -0.13 -0.13 -0.19 0.00 -2.02 0.00 0.00 58.31 55.85 1eej n LYS 44 Cb 0.43 -1.54 -0.15 0.00 -0.02 0.00 0.00 35.03 33.75 1eej n LYS 44 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 1eej s HIS 45 N -3.39 0.77 -0.07 2.13 3.76 -1.26 -5.04 115.29 112.19 1eej s HIS 45 Ca -0.04 -0.17 0.03 0.00 -0.15 0.00 0.00 55.06 54.74 1eej s HIS 45 Cb 0.14 -0.54 0.00 0.00 1.11 0.00 0.00 32.58 33.30 1eej s HIS 45 CO 0.89 -0.06 -0.17 0.42 -0.85 0.00 0.00 174.74 174.97 1eej s ILE 46 N 0.07 1.48 -0.15 0.60 1.01 -1.26 -1.60 121.20 121.34 1eej s ILE 46 Ca -0.01 -0.70 -0.00 0.00 0.00 0.00 0.00 60.65 59.94 1eej s ILE 46 Cb -0.06 -1.30 -0.01 0.00 0.01 0.00 0.00 42.46 41.10 1eej s ILE 46 CO -0.00 0.43 -0.14 -0.63 0.00 0.00 0.00 174.94 174.60 1eej s ILE 47 N 0.37 2.81 0.16 2.92 1.01 0.14 -4.98 121.20 123.64 1eej s ILE 47 Ca -0.12 -0.73 -0.18 0.00 0.00 0.00 0.00 60.65 59.62 1eej s ILE 47 Cb -0.15 -2.19 0.08 0.00 0.01 0.00 0.00 42.46 40.21 1eej s ILE 47 CO 0.05 0.51 1.66 1.56 0.00 0.00 0.00 174.94 178.72 1eej h GLN 48 N 7.14 -0.06 0.00 2.79 1.08 -1.92 -1.75 115.11 122.39 1eej h GLN 48 Ca -0.30 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.90 1eej h GLN 48 Cb 1.20 0.01 0.00 0.00 -0.05 0.00 0.00 27.48 28.64 1eej h GLN 48 CO 0.56 -0.04 0.00 0.41 -0.95 0.00 0.00 178.83 178.81 1eej n GLY 49 N -1.33 -2.08 3.63 3.46 0.00 -1.26 -4.54 105.19 103.07 1eej n GLY 49 Ca 0.01 -1.65 -0.29 0.00 0.00 0.00 0.00 46.02 44.09 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 -0.12 0.39 -0.11 1.61 0.04 -1.26 -5.13 135.00 130.42 1eej s PRO 50 Ca 0.00 0.97 -0.04 0.00 0.04 0.00 0.00 61.00 61.96 1eej s PRO 50 Cb 0.00 -1.70 -0.04 0.00 0.04 0.00 0.00 34.50 32.81 1eej s PRO 50 CO 0.00 -2.88 0.04 1.41 0.04 0.00 0.00 177.00 175.62 1eej s MET 51 N -4.71 3.28 -0.06 4.56 1.75 -1.26 -5.00 119.30 117.86 1eej s MET 51 Ca 0.66 -0.33 0.05 0.00 -1.25 0.00 0.00 55.69 54.81 1eej s MET 51 Cb -0.21 -2.96 -0.00 0.00 2.84 0.00 0.00 34.83 34.49 1eej s MET 51 CO 0.60 0.64 -0.20 0.71 -0.65 0.00 0.00 175.02 176.11 1eej s TYR 52 N -0.67 2.08 -0.34 4.11 1.51 -1.26 -0.38 117.35 122.39 1eej s TYR 52 Ca 0.11 -0.68 -0.21 0.00 -1.01 0.00 0.00 57.07 55.28 1eej s TYR 52 Cb -0.12 -1.39 0.00 0.00 -0.11 0.00 0.00 41.96 40.34 1eej s TYR 52 CO 0.02 -0.25 0.66 0.34 -1.11 0.00 0.00 175.55 175.22 1eej s ASP 53 N 0.11 6.47 -0.31 2.29 -1.08 0.49 -4.89 116.67 119.75 1eej s ASP 53 Ca -0.08 0.27 0.08 0.00 -0.52 0.00 0.00 52.55 52.31 1eej s ASP 53 Cb -0.14 -2.34 0.53 0.00 -1.46 0.00 0.00 42.92 39.51 1eej s ASP 53 CO 0.04 -0.59 1.53 1.33 0.52 0.00 0.00 175.17 178.00 1eej n VAL 54 N 5.57 2.64 -3.68 1.11 0.24 -1.26 -1.29 118.33 121.65 1eej n VAL 54 Ca -0.00 -2.59 -0.28 0.00 -2.04 0.00 0.00 64.34 59.43 1eej n VAL 54 Cb 0.49 -0.34 -0.11 0.00 -1.47 0.00 0.00 33.84 32.41 1eej n VAL 54 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 1eej s SER 55 N -2.33 3.33 0.00 -1.34 1.04 -1.26 -4.96 113.70 108.18 1eej s SER 55 Ca 0.46 -3.45 0.00 0.00 0.48 0.00 0.00 55.95 53.45 1eej s SER 55 Cb 0.41 -1.10 0.00 0.00 0.10 0.00 0.00 66.02 65.44 1eej s SER 55 CO 0.02 -0.13 0.00 0.61 0.98 0.00 0.00 173.24 174.71 1eej n GLY 56 N 2.44 -0.57 0.26 7.32 0.00 -1.26 -4.97 105.19 108.41 1eej n GLY 56 Ca 0.23 -0.69 0.17 0.00 0.00 0.00 0.00 46.02 45.74 1eej n GLY 56 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1eej h THR 57 N 0.00 0.00 -1.54 2.61 1.35 -1.97 -3.46 112.91 109.91 1eej h THR 57 Ca 0.00 -0.31 0.25 0.00 -0.55 0.00 0.00 66.41 65.80 1eej h THR 57 Cb 0.00 1.24 -0.18 0.00 -1.73 0.00 0.00 68.15 67.48 1eej h THR 57 CO 0.00 0.00 0.79 0.00 -0.25 0.00 0.00 175.52 176.06 1eej s ALA 58 N -3.72 -2.07 -0.15 6.62 0.00 -1.26 -5.12 121.76 116.06 1eej s ALA 58 Ca -0.00 1.46 -0.29 0.00 0.00 0.00 0.00 51.96 53.13 1eej s ALA 58 Cb 0.10 -0.02 -0.06 0.00 0.00 0.00 0.00 23.12 23.14 1eej s ALA 58 CO 0.47 -0.65 1.99 -2.14 0.00 0.00 0.00 175.76 175.43 1eej s PRO 59 N -2.47 3.59 -0.18 0.00 0.02 -1.26 -4.77 135.00 129.93 1eej s PRO 59 Ca 0.10 2.10 -0.05 0.00 0.02 0.00 0.00 61.00 63.17 1eej s PRO 59 Cb -0.00 -4.23 -0.03 0.00 0.02 0.00 0.00 34.50 30.26 1eej s PRO 59 CO -0.05 -1.57 -0.01 0.08 -0.33 0.00 0.00 177.00 175.12 1eej s VAL 60 N 6.40 4.00 -0.54 3.83 1.01 -0.41 -4.93 120.40 129.76 1eej s VAL 60 Ca 0.90 -0.31 -0.26 0.00 0.00 0.00 0.00 61.98 62.31 1eej s VAL 60 Cb -0.34 -2.79 0.03 0.00 0.00 0.00 0.00 36.38 33.29 1eej s VAL 60 CO 0.36 0.46 1.02 0.21 0.00 0.00 0.00 175.10 177.15 1eej s ASN 61 N 0.70 6.41 0.38 3.32 3.84 -1.26 -0.38 114.94 127.95 1eej s ASN 61 Ca -0.01 -0.09 0.09 0.00 0.21 0.00 0.00 52.86 53.07 1eej s ASN 61 Cb -0.14 -2.48 0.76 0.00 -0.55 0.00 0.00 41.25 38.84 1eej s ASN 61 CO 0.02 -1.28 1.90 0.58 -2.79 0.00 0.00 177.10 175.53 1eej h VAL 62 N 6.08 1.19 -0.29 -5.21 2.07 -1.09 -1.98 116.25 117.02 1eej h VAL 62 Ca -0.25 -0.85 -0.04 0.00 0.82 0.00 0.00 66.70 66.38 1eej h VAL 62 Cb 1.07 1.26 -0.01 0.00 -1.52 0.00 0.00 31.29 32.08 1eej h VAL 62 CO 1.11 0.26 0.01 0.74 0.02 0.00 0.00 177.57 179.71 1eej h THR 63 N 0.22 1.25 -0.61 2.57 2.02 -1.91 0.23 112.91 116.68 1eej h THR 63 Ca 0.04 -0.90 -0.04 0.00 0.77 0.00 0.00 66.41 66.28 1eej h THR 63 Cb 0.41 1.27 -0.03 0.00 -1.74 0.00 0.00 68.15 68.07 1eej h THR 63 CO 0.03 0.29 0.22 0.78 0.37 0.00 0.00 175.52 177.21 1eej h ASN 64 N 0.30 0.83 -0.63 4.18 2.35 -1.85 -1.66 115.58 119.11 1eej h ASN 64 Ca 0.08 -0.12 -0.08 0.00 -0.55 0.00 0.00 56.30 55.63 1eej h ASN 64 Cb 0.41 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 38.54 1eej h ASN 64 CO 0.01 0.77 0.07 0.50 -1.65 0.00 0.00 177.43 177.13 1eej h LYS 65 N 0.89 1.07 -0.75 0.81 3.64 -1.05 -0.64 116.57 120.54 1eej h LYS 65 Ca 0.21 -0.30 -0.03 0.00 -1.27 0.00 0.00 60.65 59.25 1eej h LYS 65 Cb 0.21 -0.12 -0.03 0.00 -0.41 0.00 0.00 32.23 31.88 1eej h LYS 65 CO -0.01 1.00 0.34 1.98 -2.27 0.00 0.00 179.45 180.49 1eej h MET 66 N 0.99 1.09 -0.31 1.90 4.05 -0.33 -1.49 114.93 120.84 1eej h MET 66 Ca 0.19 -0.17 -0.12 0.00 -0.28 0.00 0.00 59.70 59.32 1eej h MET 66 Cb 0.48 -0.19 -0.01 0.00 -0.80 0.00 0.00 31.60 31.07 1eej h MET 66 CO 0.02 0.87 -0.30 -0.07 0.23 0.00 0.00 176.91 177.66 1eej h LEU 67 N 1.06 0.66 -1.41 3.39 3.38 -0.96 -2.59 115.31 118.83 1eej h LEU 67 Ca 0.25 -0.25 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 1eej h LEU 67 Cb 0.15 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 1eej h LEU 67 CO -0.03 0.92 -0.25 -0.07 0.09 0.00 0.00 178.44 179.10 1eej h LEU 68 N 0.55 0.00 -0.80 1.67 3.38 -0.76 -1.71 115.31 117.64 1eej h LEU 68 Ca 0.07 0.00 -0.11 0.00 0.09 0.00 0.00 57.88 57.93 1eej h LEU 68 Cb 0.79 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.52 1eej h LEU 68 CO 0.06 0.25 -0.25 0.50 0.09 0.00 0.00 178.44 179.09 1eej h LYS 69 N 0.00 0.62 -0.49 1.13 3.64 -0.88 -1.13 116.57 119.45 1eej h LYS 69 Ca -0.00 -0.25 -0.13 0.00 -1.27 0.00 0.00 60.65 59.00 1eej h LYS 69 Cb 0.60 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.38 1eej h LYS 69 CO 0.03 0.82 -0.18 1.96 -2.27 0.00 0.00 179.45 179.80 1eej h GLN 70 N 0.54 1.00 -0.83 1.90 1.08 -1.19 -2.44 115.11 115.16 1eej h GLN 70 Ca 0.08 -0.41 -0.04 0.00 -1.45 0.00 0.00 58.65 56.82 1eej h GLN 70 Cb 0.72 -0.04 -0.04 0.00 -0.05 0.00 0.00 27.48 28.07 1eej h GLN 70 CO 0.06 1.09 0.36 1.25 -0.95 0.00 0.00 178.83 180.64 1eej h LEU 71 N 0.86 1.12 -0.61 1.46 5.85 -1.13 -2.32 115.31 120.53 1eej h LEU 71 Ca 0.12 -0.16 -0.01 0.00 0.84 0.00 0.00 57.88 58.67 1eej h LEU 71 Cb 0.76 -0.29 -0.03 0.00 0.37 0.00 0.00 40.66 41.47 1eej h LEU 71 CO 0.06 0.96 0.36 -1.13 -0.34 0.00 0.00 178.44 178.35 1eej h ASN 72 N 1.20 0.74 0.44 1.25 -0.73 -1.05 -1.79 115.58 115.64 1eej h ASN 72 Ca 0.28 -0.07 -0.02 0.00 1.87 0.00 0.00 56.30 58.36 1eej h ASN 72 Cb 0.17 -0.19 -0.00 0.00 0.27 0.00 0.00 38.32 38.57 1eej h ASN 72 CO -0.03 0.60 -0.09 0.00 -0.37 0.00 0.00 177.43 177.54 1eej h ALA 73 N 1.18 1.19 -0.05 1.57 0.00 -0.98 -2.18 119.26 119.99 1eej h ALA 73 Ca 0.22 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1eej h ALA 73 Cb 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1eej h ALA 73 CO -0.04 0.11 0.00 1.28 0.00 0.00 0.00 179.25 180.60 1eej n LEU 74 N -3.47 1.06 -0.14 0.00 4.77 -0.68 -4.05 117.00 114.49 1eej n LEU 74 Ca -0.02 -0.39 0.04 0.00 -0.03 0.00 0.00 56.01 55.62 1eej n LEU 74 Cb 0.23 -0.03 0.35 0.00 -2.33 0.00 0.00 43.42 41.64 1eej n LEU 74 CO 0.28 0.19 1.21 -0.33 -1.33 0.00 0.00 177.39 177.41 1eej h GLU 75 N 1.57 0.74 0.00 3.23 5.08 -1.26 0.58 114.58 124.52 1eej h GLU 75 Ca 0.00 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1eej h GLU 75 Cb 0.34 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.42 1eej h GLU 75 CO 0.00 0.49 0.00 0.36 -1.00 0.00 0.00 179.01 178.86 1eej n LYS 76 N -4.46 0.11 -0.13 2.33 2.85 -1.26 -2.02 118.16 115.59 1eej n LYS 76 Ca 0.08 0.43 0.07 0.00 -1.05 0.00 0.00 58.31 57.84 1eej n LYS 76 Cb 0.13 -1.75 0.13 0.00 -0.65 0.00 0.00 35.03 32.90 1eej n LYS 76 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 1eej n GLU 77 N -1.96 2.08 -3.06 -1.58 1.02 0.17 -5.00 120.64 112.31 1eej n GLU 77 Ca 0.01 -1.82 -0.35 0.00 -0.02 0.00 0.00 57.16 54.98 1eej n GLU 77 Cb 0.15 -1.29 -0.06 0.00 -0.02 0.00 0.00 31.44 30.21 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 -1.04 4.22 -0.34 3.49 -1.94 -0.85 -4.88 119.30 117.96 1eej s MET 78 Ca 0.23 0.88 -0.15 0.00 -1.71 0.00 0.00 55.69 54.93 1eej s MET 78 Cb 0.13 -2.71 -0.01 0.00 2.01 0.00 0.00 34.83 34.25 1eej s MET 78 CO 0.18 0.29 0.37 0.42 -0.01 0.00 0.00 175.02 176.27 1eej s ILE 79 N -1.70 5.16 -0.21 2.53 1.01 -0.76 -4.85 121.20 122.38 1eej s ILE 79 Ca 0.48 0.09 -0.08 0.00 0.00 0.00 0.00 60.65 61.14 1eej s ILE 79 Cb -0.15 -3.83 -0.04 0.00 0.01 0.00 0.00 42.46 38.46 1eej s ILE 79 CO 0.20 -0.09 0.08 -0.69 0.00 0.00 0.00 174.94 174.44 1eej s VAL 80 N 2.05 4.78 -0.49 2.92 1.01 -1.26 0.20 120.40 129.60 1eej s VAL 80 Ca 0.12 -0.03 -0.00 0.00 0.00 0.00 0.00 61.98 62.07 1eej s VAL 80 Cb -0.16 -3.19 0.13 0.00 0.00 0.00 0.00 36.38 33.16 1eej s VAL 80 CO 0.12 0.41 0.27 -0.31 0.00 0.00 0.00 175.10 175.58 1eej s TYR 81 N 0.82 3.48 0.18 5.22 1.51 0.97 -5.00 117.35 124.53 1eej s TYR 81 Ca 0.04 -2.76 -0.30 0.00 -1.01 0.00 0.00 57.07 53.05 1eej s TYR 81 Cb -0.13 -3.09 -0.07 0.00 -0.11 0.00 0.00 41.96 38.55 1eej s TYR 81 CO 0.02 -0.88 0.99 0.21 -1.11 0.00 0.00 175.55 174.78 1eej s LYS 82 N 0.42 4.73 0.27 -0.62 2.20 -1.26 -1.31 119.74 124.17 1eej s LYS 82 Ca 0.13 1.53 -0.29 0.00 -0.36 0.00 0.00 55.97 56.98 1eej s LYS 82 Cb -0.22 -3.32 -0.09 0.00 -1.51 0.00 0.00 37.83 32.69 1eej s LYS 82 CO -0.04 0.29 1.02 0.00 -0.36 0.00 0.00 175.35 176.26 1eej s ALA 83 N -0.50 3.36 0.25 3.13 0.00 -1.26 -4.94 121.76 121.79 1eej s ALA 83 Ca 0.45 0.75 -0.11 0.00 0.00 0.00 0.00 51.96 53.05 1eej s ALA 83 Cb -0.26 -3.26 0.35 0.00 0.00 0.00 0.00 23.12 19.95 1eej s ALA 83 CO 0.32 0.03 1.59 -1.35 0.00 0.00 0.00 175.76 176.35 1eej h PRO 84 N 3.90 -0.00 -4.29 0.00 0.11 -1.95 -3.19 132.00 126.58 1eej h PRO 84 Ca -0.46 0.00 -0.63 0.00 0.11 0.00 0.00 66.00 65.02 1eej h PRO 84 Cb 1.21 0.00 -0.40 0.00 0.11 0.00 0.00 31.00 31.92 1eej h PRO 84 CO 0.67 -0.00 -0.73 -0.65 -0.21 0.00 0.00 178.00 177.08 1eej s GLN 85 N -6.25 1.22 -0.07 1.05 1.11 -1.26 -5.09 119.66 110.37 1eej s GLN 85 Ca -0.15 -1.61 -0.30 0.00 0.01 0.00 0.00 55.36 53.32 1eej s GLN 85 Cb 0.23 -2.79 -0.05 0.00 -1.01 0.00 0.00 33.01 29.39 1eej s GLN 85 CO 0.76 -0.96 1.64 -2.00 0.01 0.00 0.00 175.29 174.74 1eej s GLU 86 N 1.14 4.14 -0.09 2.91 2.12 -1.21 -4.48 118.70 123.24 1eej s GLU 86 Ca 0.11 2.13 0.06 0.00 0.36 0.00 0.00 54.97 57.62 1eej s GLU 86 Cb -0.18 -3.99 -0.09 0.00 0.26 0.00 0.00 34.13 30.13 1eej s GLU 86 CO -0.14 -0.89 0.00 1.63 -0.54 0.00 0.00 175.26 175.33 1eej n LYS 87 N 7.17 2.15 -3.91 4.30 4.76 0.04 -5.04 118.16 127.62 1eej n LYS 87 Ca 0.17 0.01 -0.10 0.00 -2.87 0.00 0.00 58.31 55.52 1eej n LYS 87 Cb 0.43 -1.21 -0.10 0.00 -1.84 0.00 0.00 35.03 32.31 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 -2.20 0.11 -0.12 2.13 3.76 -0.80 -5.03 115.29 113.14 1eej s HIS 88 Ca -0.06 -0.26 -0.00 0.00 -0.15 0.00 0.00 55.06 54.59 1eej s HIS 88 Cb 0.03 -0.09 0.02 0.00 1.11 0.00 0.00 32.58 33.65 1eej s HIS 88 CO 0.31 -0.24 -0.09 0.08 -0.85 0.00 0.00 174.74 173.95 1eej s VAL 89 N -1.36 1.11 0.09 -0.90 1.01 -1.26 -0.96 120.40 118.13 1eej s VAL 89 Ca -0.15 -0.34 0.09 0.00 0.00 0.00 0.00 61.98 61.58 1eej s VAL 89 Cb -0.08 -1.11 -0.03 0.00 0.00 0.00 0.00 36.38 35.16 1eej s VAL 89 CO 0.01 0.38 -0.24 0.27 0.00 0.00 0.00 175.10 175.52 1eej s ILE 90 N 1.63 1.95 -0.20 2.22 -4.36 -0.47 -3.81 121.20 118.17 1eej s ILE 90 Ca 0.04 -1.51 -0.05 0.00 -0.26 0.00 0.00 60.65 58.88 1eej s ILE 90 Cb -0.13 -1.72 -0.02 0.00 1.25 0.00 0.00 42.46 41.84 1eej s ILE 90 CO -0.08 0.12 -0.01 -0.89 0.24 0.00 0.00 174.94 174.32 1eej s THR 91 N -0.99 3.89 -0.15 8.37 2.01 -0.67 -1.05 115.64 127.05 1eej s THR 91 Ca 0.10 -0.34 0.01 0.00 0.31 0.00 0.00 61.69 61.77 1eej s THR 91 Cb -0.10 -2.75 0.01 0.00 0.01 0.00 0.00 72.50 69.67 1eej s THR 91 CO 0.04 0.44 -0.18 -0.69 -0.69 0.00 0.00 174.62 173.53 1eej s VAL 92 N 0.95 2.36 -0.30 3.82 1.01 0.82 0.02 120.40 129.08 1eej s VAL 92 Ca 0.01 -0.87 -0.26 0.00 0.00 0.00 0.00 61.98 60.86 1eej s VAL 92 Cb -0.14 -1.98 0.01 0.00 0.00 0.00 0.00 36.38 34.27 1eej s VAL 92 CO 0.02 0.53 0.94 -0.36 0.00 0.00 0.00 175.10 176.22 1eej s PHE 93 N 0.90 3.19 0.21 5.22 0.08 0.16 -1.75 117.98 126.00 1eej s PHE 93 Ca -0.04 1.05 0.09 0.00 0.12 0.00 0.00 56.93 58.14 1eej s PHE 93 Cb -0.15 -3.43 -0.05 0.00 -0.57 0.00 0.00 43.02 38.83 1eej s PHE 93 CO -0.03 -0.64 -0.16 -0.08 -0.10 0.00 0.00 175.22 174.21 1eej s THR 94 N 3.28 1.87 -0.09 0.64 -1.32 -0.63 -2.20 115.64 117.20 1eej s THR 94 Ca 0.39 -2.18 0.00 0.00 -1.21 0.00 0.00 61.69 58.69 1eej s THR 94 Cb -0.13 -2.04 0.02 0.00 -1.51 0.00 0.00 72.50 68.84 1eej s THR 94 CO 0.13 -0.51 -0.07 -0.62 -2.21 0.00 0.00 174.62 171.34 1eej s ASP 95 N -3.22 1.89 0.00 8.08 -1.08 -1.26 -0.48 116.67 120.61 1eej s ASP 95 Ca 0.22 -0.26 0.08 0.00 -0.52 0.00 0.00 52.55 52.08 1eej s ASP 95 Cb -0.02 -0.75 0.36 0.00 -1.46 0.00 0.00 42.92 41.04 1eej s ASP 95 CO 0.08 -0.09 1.25 2.30 0.52 0.00 0.00 175.17 179.23 1eej n ILE 96 N 4.61 1.36 0.89 4.11 -6.64 -1.26 -1.34 119.36 121.09 1eej n ILE 96 Ca -0.16 0.34 0.11 0.00 -1.77 0.00 0.00 62.75 61.27 1eej n ILE 96 Cb 0.50 -1.20 0.08 0.00 -1.44 0.00 0.00 39.64 37.59 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 -1.47 0.00 -3.07 7.28 -2.24 -1.26 -4.91 114.28 108.60 1eej n THR 97 Ca 0.02 -0.48 -0.40 0.00 -2.27 0.00 0.00 64.05 60.92 1eej n THR 97 Cb 0.09 1.43 -0.06 0.00 -2.10 0.00 0.00 70.33 69.70 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 8.38 0.42 2.00 0.00 0.00 -1.92 -0.15 103.07 111.80 1eej h GLY 99 Ca -0.30 0.05 -0.04 0.00 0.00 0.00 0.00 47.33 47.03 1eej h GLY 99 CO 0.79 -0.10 -0.21 -0.97 0.00 0.00 0.00 176.54 176.04 1eej h TYR 100 N 0.11 0.00 -0.16 5.60 0.05 -1.94 -2.02 116.97 118.62 1eej h TYR 100 Ca 0.21 0.00 -0.19 0.00 0.05 0.00 0.00 58.73 58.80 1eej h TYR 100 Cb 0.29 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.03 1eej h TYR 100 CO -0.27 0.21 -0.66 0.00 -1.05 0.00 0.00 178.16 176.39 1eej h HIS 102 N 0.44 0.49 -0.22 0.00 3.86 -0.45 -1.70 115.15 117.57 1eej h HIS 102 Ca -0.02 -0.01 -0.00 0.00 -1.16 0.00 0.00 60.37 59.18 1eej h HIS 102 Cb 1.24 -0.16 -0.01 0.00 1.06 0.00 0.00 27.41 29.54 1eej h HIS 102 CO 0.06 0.37 0.13 -0.22 0.86 0.00 0.00 177.93 179.13 1eej h LYS 103 N 0.46 0.30 -0.40 2.45 3.64 -1.21 -0.81 116.57 121.00 1eej h LYS 103 Ca 0.13 -0.03 0.06 0.00 -1.27 0.00 0.00 60.65 59.53 1eej h LYS 103 Cb 0.04 -0.06 -0.05 0.00 -0.41 0.00 0.00 32.23 31.75 1eej h LYS 103 CO -0.02 0.26 0.11 1.25 -2.27 0.00 0.00 179.45 178.78 1eej h LEU 104 N 0.26 0.08 -0.81 5.20 6.46 -0.81 -1.85 115.31 123.83 1eej h LEU 104 Ca 0.08 0.06 -0.06 0.00 -0.12 0.00 0.00 57.88 57.84 1eej h LEU 104 Cb 0.04 0.06 -0.03 0.00 -0.73 0.00 0.00 40.66 40.00 1eej h LEU 104 CO -0.01 0.08 0.23 -0.74 -0.62 0.00 0.00 178.44 177.37 1eej h HIS 105 N 0.25 1.15 0.00 1.25 2.76 -1.02 -2.01 115.15 117.54 1eej h HIS 105 Ca 0.19 -0.11 -0.01 0.00 -2.20 0.00 0.00 60.37 58.24 1eej h HIS 105 Cb 0.21 -0.34 -0.00 0.00 1.55 0.00 0.00 27.41 28.83 1eej h HIS 105 CO -0.18 0.91 -0.06 0.93 -1.30 0.00 0.00 177.93 178.23 1eej h GLU 106 N 1.07 0.00 -0.63 5.26 5.08 -0.47 -1.52 114.58 123.37 1eej h GLU 106 Ca 0.23 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.59 1eej h GLU 106 Cb 0.29 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.54 1eej h GLU 106 CO -0.01 0.06 0.00 1.04 -1.00 0.00 0.00 179.01 179.10 1eej n GLN 107 N -3.49 3.83 -0.22 2.33 6.02 -0.76 -4.60 117.38 120.50 1eej n GLN 107 Ca -0.02 -2.91 0.06 0.00 -0.01 0.00 0.00 57.00 54.11 1eej n GLN 107 Cb 0.18 -1.92 0.32 0.00 1.02 0.00 0.00 30.24 29.84 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 4.02 0.81 -0.61 -1.09 4.05 -0.95 -0.55 114.93 120.60 1eej h MET 108 Ca 0.00 -0.05 -0.00 0.00 -0.28 0.00 0.00 59.70 59.37 1eej h MET 108 Cb 1.50 -0.18 -0.03 0.00 -0.80 0.00 0.00 31.60 32.09 1eej h MET 108 CO 0.25 0.53 0.36 0.00 0.23 0.00 0.00 176.91 178.29 1eej h ALA 109 N 1.58 1.49 -0.13 0.39 0.00 -1.82 -0.55 119.26 120.22 1eej h ALA 109 Ca 0.33 -0.07 -0.07 0.00 0.00 0.00 0.00 54.91 55.10 1eej h ALA 109 Cb 0.25 -0.25 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 1eej h ALA 109 CO -0.12 0.44 -0.20 -0.44 0.00 0.00 0.00 179.25 178.93 1eej h ASP 110 N 0.84 0.40 -0.42 0.00 5.19 -1.47 0.36 116.42 121.33 1eej h ASP 110 Ca 0.22 -0.53 0.01 0.00 -0.62 0.00 0.00 57.03 56.11 1eej h ASP 110 Cb -0.02 -0.12 -0.02 0.00 0.18 0.00 0.00 39.33 39.35 1eej h ASP 110 CO -0.04 0.86 0.26 1.88 -3.12 0.00 0.00 179.24 179.08 1eej h TYR 111 N -0.04 0.50 -0.74 4.55 0.05 -1.14 -1.36 116.97 118.80 1eej h TYR 111 Ca 0.01 0.01 -0.01 0.00 0.05 0.00 0.00 58.73 58.80 1eej h TYR 111 Cb 0.77 -0.16 -0.04 0.00 1.01 0.00 0.00 36.73 38.31 1eej h TYR 111 CO 0.10 0.30 0.43 -0.91 -1.05 0.00 0.00 178.16 177.03 1eej h ASN 112 N 0.54 0.90 0.24 3.88 -0.26 -1.07 -0.02 115.58 119.78 1eej h ASN 112 Ca 0.16 -0.07 -0.03 0.00 -0.56 0.00 0.00 56.30 55.79 1eej h ASN 112 Cb -0.03 -0.23 -0.00 0.00 -1.06 0.00 0.00 38.32 37.00 1eej h ASN 112 CO -0.05 0.71 -0.15 0.00 -1.06 0.00 0.00 177.43 176.87 1eej h ALA 113 N 1.23 1.53 -0.34 -0.83 0.00 -0.48 -0.93 119.26 119.43 1eej h ALA 113 Ca 0.26 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1eej h ALA 113 Cb -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.75 1eej h ALA 113 CO -0.05 0.19 0.00 1.28 0.00 0.00 0.00 179.25 180.68 1eej n LEU 114 N -4.05 2.43 0.00 0.00 4.77 -0.55 -4.90 117.00 114.71 1eej n LEU 114 Ca -0.02 -1.22 0.00 0.00 -0.03 0.00 0.00 56.01 54.73 1eej n LEU 114 Cb 0.24 -0.36 0.00 0.00 -2.33 0.00 0.00 43.42 40.97 1eej n LEU 114 CO 0.34 0.48 0.00 0.61 -1.33 0.00 0.00 177.39 177.48 1eej n GLY 115 N 0.83 0.48 3.53 -0.72 0.00 -0.35 -4.90 105.19 104.06 1eej n GLY 115 Ca 0.13 -0.50 -0.39 0.00 0.00 0.00 0.00 46.02 45.27 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 5.05 -0.09 -0.61 1.01 -0.09 -0.78 121.20 123.69 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 -3.48 -0.04 0.00 0.01 0.00 0.00 42.46 38.95 1eej s ILE 116 CO 0.00 0.16 0.57 -0.89 0.00 0.00 0.00 174.94 174.78 1eej s THR 117 N 1.71 5.12 -0.15 2.92 2.01 -0.14 -3.47 115.64 123.63 1eej s THR 117 Ca 0.06 1.15 -0.01 0.00 0.31 0.00 0.00 61.69 63.20 1eej s THR 117 Cb -0.16 -3.90 -0.01 0.00 0.01 0.00 0.00 72.50 68.43 1eej s THR 117 CO 0.09 0.31 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.54 1eej s VAL 118 N 0.61 3.22 -0.19 3.82 1.01 -0.43 -1.37 120.40 127.07 1eej s VAL 118 Ca 0.30 -0.59 -0.01 0.00 0.00 0.00 0.00 61.98 61.69 1eej s VAL 118 Cb -0.16 -2.38 0.01 0.00 0.00 0.00 0.00 36.38 33.84 1eej s VAL 118 CO 0.14 0.50 -0.14 -0.13 0.00 0.00 0.00 175.10 175.46 1eej s ARG 119 N 0.58 3.14 0.04 2.72 0.52 -0.21 -0.02 118.95 125.72 1eej s ARG 119 Ca -0.06 -0.76 -0.10 0.00 -0.52 0.00 0.00 55.73 54.29 1eej s ARG 119 Cb -0.15 -2.72 -0.05 0.00 0.52 0.00 0.00 34.95 32.55 1eej s ARG 119 CO 0.03 -0.18 0.36 0.71 0.02 0.00 0.00 175.30 176.23 1eej s TYR 120 N 1.31 3.60 0.07 -0.53 2.02 0.13 -0.13 117.35 123.83 1eej s TYR 120 Ca 0.04 0.75 0.06 0.00 -0.37 0.00 0.00 57.07 57.55 1eej s TYR 120 Cb -0.14 -2.12 -0.03 0.00 -0.40 0.00 0.00 41.96 39.27 1eej s TYR 120 CO -0.09 0.57 -0.15 -0.51 -1.57 0.00 0.00 175.55 173.80 1eej s LEU 121 N -1.71 2.27 0.04 -1.29 1.43 -0.72 -1.82 118.68 116.89 1eej s LEU 121 Ca 0.29 -0.62 -0.24 0.00 -1.03 0.00 0.00 54.13 52.54 1eej s LEU 121 Cb -0.14 -0.59 -0.06 0.00 0.03 0.00 0.00 46.19 45.43 1eej s LEU 121 CO 0.16 -0.04 0.72 0.00 0.23 0.00 0.00 176.35 177.41 1eej s ALA 122 N -1.22 3.41 -0.37 4.21 0.00 -1.26 -1.60 121.76 124.93 1eej s ALA 122 Ca -0.00 0.21 0.02 0.00 0.00 0.00 0.00 51.96 52.19 1eej s ALA 122 Cb -0.10 -2.92 0.15 0.00 0.00 0.00 0.00 23.12 20.26 1eej s ALA 122 CO 0.03 0.12 0.29 0.12 0.00 0.00 0.00 175.76 176.31 1eej s PHE 123 N -0.21 0.46 -0.44 0.00 2.19 0.37 -3.39 117.98 116.95 1eej s PHE 123 Ca 0.36 -1.52 -0.28 0.00 0.33 0.00 0.00 56.93 55.82 1eej s PHE 123 Cb -0.20 -0.75 -0.00 0.00 -1.31 0.00 0.00 43.02 40.76 1eej s PHE 123 CO 0.22 -0.88 1.59 -1.25 1.83 0.00 0.00 175.22 176.73 1eej s PRO 124 N 0.97 3.32 0.50 10.12 0.04 -1.26 -4.11 135.00 144.58 1eej s PRO 124 Ca 0.21 0.94 0.20 0.00 0.04 0.00 0.00 61.00 62.39 1eej s PRO 124 Cb -0.16 -4.14 1.26 0.00 0.04 0.00 0.00 34.50 31.50 1eej s PRO 124 CO -0.04 -1.88 2.01 0.00 0.04 0.00 0.00 177.00 177.14 1eej h ARG 125 N 11.98 0.13 0.00 4.56 3.08 -1.98 0.14 114.38 132.29 1eej h ARG 125 Ca -0.29 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 59.75 1eej h ARG 125 Cb 1.13 -0.03 0.00 0.00 0.08 0.00 0.00 29.97 31.15 1eej h ARG 125 CO 1.11 0.08 0.00 1.04 -1.07 0.00 0.00 179.97 181.13 1eej n GLN 126 N -4.44 0.68 0.00 0.04 6.02 -1.26 -5.00 117.38 113.42 1eej n GLN 126 Ca 0.08 0.01 0.00 0.00 -0.01 0.00 0.00 57.00 57.08 1eej n GLN 126 Cb 0.45 -1.50 0.00 0.00 1.02 0.00 0.00 30.24 30.21 1eej n GLN 126 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1eej n GLY 127 N 0.59 -2.51 3.84 1.08 0.00 0.50 -4.77 105.19 103.92 1eej n GLY 127 Ca 0.17 -1.72 -0.32 0.00 0.00 0.00 0.00 46.02 44.15 1eej n GLY 127 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1eej s LEU 128 N 0.00 3.52 0.00 0.99 1.43 -1.26 -3.60 118.68 119.76 1eej s LEU 128 Ca 0.00 1.61 0.00 0.00 -1.03 0.00 0.00 54.13 54.71 1eej s LEU 128 Cb 0.00 -4.51 0.00 0.00 0.03 0.00 0.00 46.19 41.71 1eej s LEU 128 CO 0.00 -0.80 0.00 0.47 0.23 0.00 0.00 176.35 176.25 1eej n ASP 129 N -1.91 -3.55 -4.92 2.29 8.00 -1.26 -5.01 116.55 110.19 1eej n ASP 129 Ca 0.07 0.00 -0.27 0.00 0.71 0.00 0.00 54.79 55.30 1eej n ASP 129 Cb 0.54 -1.43 0.04 0.00 -0.02 0.00 0.00 41.12 40.25 1eej n ASP 129 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1eej s SER 130 N -2.07 5.45 0.28 -2.24 1.04 -1.24 -4.91 113.70 110.00 1eej s SER 130 Ca 0.00 0.71 -0.03 0.00 0.48 0.00 0.00 55.95 57.10 1eej s SER 130 Cb 0.00 -1.62 0.37 0.00 0.10 0.00 0.00 66.02 64.86 1eej s SER 130 CO 0.00 -1.18 1.92 0.44 0.98 0.00 0.00 173.24 175.40 1eej h ASP 131 N -0.29 0.99 -0.71 7.02 3.32 -1.95 -1.36 116.42 123.45 1eej h ASP 131 Ca -0.45 -0.06 -0.01 0.00 0.02 0.00 0.00 57.03 56.53 1eej h ASP 131 Cb 1.27 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 40.53 1eej h ASP 131 CO 0.61 0.76 0.39 0.00 -1.72 0.00 0.00 179.24 179.29 1eej h ALA 132 N 1.40 0.91 -0.50 3.45 0.00 -1.93 0.02 119.26 122.60 1eej h ALA 132 Ca 0.29 -0.11 -0.09 0.00 0.00 0.00 0.00 54.91 55.01 1eej h ALA 132 Cb -0.04 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.45 1eej h ALA 132 CO -0.05 0.42 -0.03 1.49 0.00 0.00 0.00 179.25 181.07 1eej h GLU 133 N 0.97 0.91 -0.64 0.00 4.22 -1.66 -1.37 114.58 117.02 1eej h GLU 133 Ca 0.25 -0.31 -0.05 0.00 0.08 0.00 0.00 59.36 59.34 1eej h GLU 133 Cb 0.03 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.18 1eej h GLU 133 CO -0.04 0.96 0.22 0.87 -2.18 0.00 0.00 179.01 178.83 1eej h LYS 134 N 0.78 0.98 -0.50 1.92 1.57 -0.93 -0.90 116.57 119.48 1eej h LYS 134 Ca 0.14 -0.20 -0.07 0.00 -1.87 0.00 0.00 60.65 58.65 1eej h LYS 134 Cb 0.57 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.71 1eej h LYS 134 CO 0.03 0.85 0.04 1.49 -0.57 0.00 0.00 179.45 181.29 1eej h GLU 135 N 0.91 0.86 0.00 3.15 4.57 -0.83 -2.71 114.58 120.53 1eej h GLU 135 Ca 0.21 -0.25 -0.12 0.00 -1.18 0.00 0.00 59.36 58.02 1eej h GLU 135 Cb 0.26 -0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 28.75 1eej h GLU 135 CO -0.01 0.87 -0.56 0.52 -1.18 0.00 0.00 179.01 178.66 1eej h MET 136 N 0.73 0.00 -0.48 1.92 2.86 -1.08 -2.34 114.93 116.54 1eej h MET 136 Ca 0.15 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.79 1eej h MET 136 Cb 0.46 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.09 1eej h MET 136 CO 0.02 0.56 0.31 -0.22 1.06 0.00 0.00 176.91 178.63 1eej h LYS 137 N 0.00 0.64 -0.45 1.72 1.63 -0.99 0.39 116.57 119.51 1eej h LYS 137 Ca -0.01 -0.05 -0.01 0.00 -0.85 0.00 0.00 60.65 59.74 1eej h LYS 137 Cb 1.08 -0.14 -0.02 0.00 -0.60 0.00 0.00 32.23 32.55 1eej h LYS 137 CO 0.07 0.45 0.26 0.00 -3.45 0.00 0.00 179.45 176.77 1eej h ALA 138 N 1.16 0.57 0.14 5.00 0.00 -1.22 -2.01 119.26 122.89 1eej h ALA 138 Ca 0.17 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 1eej h ALA 138 Cb -0.04 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.57 1eej h ALA 138 CO -0.04 0.08 -0.07 0.82 0.00 0.00 0.00 179.25 180.04 1eej h ILE 139 N 0.59 0.89 0.00 0.00 2.04 -1.04 -2.52 117.51 117.48 1eej h ILE 139 Ca 0.16 -0.13 0.00 0.00 1.00 0.00 0.00 64.86 65.89 1eej h ILE 139 Cb 0.03 0.98 0.00 0.00 -0.74 0.00 0.00 36.82 37.08 1eej h ILE 139 CO -0.03 0.03 0.00 -0.50 0.00 0.00 0.00 178.15 177.65 1eej h TRP 140 N -0.25 0.00 -0.17 1.37 6.55 -0.83 -1.94 115.95 120.68 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 0.20 0.00 0.00 0.00 -0.86 0.00 0.00 29.16 28.50 1eej h TRP 140 CO -0.05 0.00 0.00 0.00 -1.05 0.00 0.00 178.44 177.34 1eej s ALA 142 N -1.64 2.08 0.51 0.00 0.00 -0.73 -4.72 121.76 117.25 1eej s ALA 142 Ca 0.30 0.34 0.16 0.00 0.00 0.00 0.00 51.96 52.75 1eej s ALA 142 Cb 0.19 -3.31 1.23 0.00 0.00 0.00 0.00 23.12 21.23 1eej s ALA 142 CO 0.28 -1.99 2.12 -0.22 0.00 0.00 0.00 175.76 175.95 1eej h LYS 143 N -1.29 0.07 -2.76 0.00 3.64 -1.92 -3.32 116.57 111.00 1eej h LYS 143 Ca -0.43 -0.00 -0.55 0.00 -1.27 0.00 0.00 60.65 58.39 1eej h LYS 143 Cb 1.24 -0.02 -0.40 0.00 -0.41 0.00 0.00 32.23 32.65 1eej h LYS 143 CO 0.49 0.05 -0.80 0.34 -2.27 0.00 0.00 179.45 177.26 1eej s ASP 144 N -6.92 3.38 0.22 4.20 -1.08 -1.26 -5.03 116.67 110.19 1eej s ASP 144 Ca -0.05 -1.59 -0.07 0.00 -0.52 0.00 0.00 52.55 50.31 1eej s ASP 144 Cb 0.17 -0.39 0.35 0.00 -1.46 0.00 0.00 42.92 41.59 1eej s ASP 144 CO 0.69 -0.40 1.74 0.11 0.52 0.00 0.00 175.17 177.83 1eej h LYS 145 N 7.95 0.41 0.26 4.34 1.57 -1.79 -1.22 116.57 128.10 1eej h LYS 145 Ca -0.12 -0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.63 1eej h LYS 145 Cb 1.00 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 33.22 1eej h LYS 145 CO 0.39 0.27 -0.13 -0.91 -0.57 0.00 0.00 179.45 178.50 1eej h ASN 146 N 0.43 -0.30 -0.92 0.86 4.21 -1.94 -0.55 115.58 117.36 1eej h ASN 146 Ca 0.35 0.01 0.01 0.00 1.21 0.00 0.00 56.30 57.88 1eej h ASN 146 Cb 0.47 0.08 -0.05 0.00 -1.12 0.00 0.00 38.32 37.71 1eej h ASN 146 CO -0.35 -0.21 0.60 0.50 -1.29 0.00 0.00 177.43 176.68 1eej h LYS 147 N -0.36 1.22 -0.52 0.81 3.64 -1.91 0.32 116.57 119.78 1eej h LYS 147 Ca -0.04 -0.08 -0.03 0.00 -1.27 0.00 0.00 60.65 59.24 1eej h LYS 147 Cb 0.27 -0.27 -0.02 0.00 -0.41 0.00 0.00 32.23 31.80 1eej h LYS 147 CO 0.06 0.82 0.22 0.00 -2.27 0.00 0.00 179.45 178.28 1eej h ALA 148 N 1.33 0.67 -0.47 5.00 0.00 -1.04 0.23 119.26 124.99 1eej h ALA 148 Ca 0.34 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 55.05 1eej h ALA 148 Cb -0.13 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.44 1eej h ALA 148 CO -0.07 0.27 0.10 0.35 0.00 0.00 0.00 179.25 179.89 1eej h PHE 149 N 0.70 0.80 -0.40 0.00 3.04 -0.69 -1.81 116.94 118.59 1eej h PHE 149 Ca 0.18 -0.10 0.03 0.00 3.98 0.00 0.00 57.97 62.05 1eej h PHE 149 Cb 0.17 -0.22 -0.03 0.00 2.56 0.00 0.00 35.95 38.43 1eej h PHE 149 CO 0.00 0.74 0.20 -0.44 -2.02 0.00 0.00 178.31 176.80 1eej h ASP 150 N 0.63 0.31 0.24 0.41 3.32 -0.51 -0.93 116.42 119.90 1eej h ASP 150 Ca 0.14 0.02 -0.01 0.00 0.02 0.00 0.00 57.03 57.20 1eej h ASP 150 Cb 0.36 -0.04 -0.00 0.00 0.22 0.00 0.00 39.33 39.86 1eej h ASP 150 CO 0.01 0.22 -0.15 0.44 -1.72 0.00 0.00 179.24 178.03 1eej h ASP 151 N 0.42 -0.38 -0.08 6.45 3.32 -0.31 -0.90 116.42 124.93 1eej h ASP 151 Ca 0.17 0.02 0.01 0.00 0.02 0.00 0.00 57.03 57.26 1eej h ASP 151 Cb 0.06 0.12 -0.01 0.00 0.22 0.00 0.00 39.33 39.71 1eej h ASP 151 CO -0.11 -0.25 -0.01 0.58 -1.72 0.00 0.00 179.24 177.73 1eej h VAL 152 N -0.39 0.93 0.00 -1.35 2.07 -1.19 -0.67 116.25 115.66 1eej h VAL 152 Ca -0.02 -0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.49 1eej h VAL 152 Cb 0.32 0.92 0.00 0.00 -1.52 0.00 0.00 31.29 31.01 1eej h VAL 152 CO 0.02 0.00 0.00 0.24 0.02 0.00 0.00 177.57 177.85 1eej h MET 153 N 0.01 0.00 -0.01 1.57 2.86 -1.09 0.19 114.93 118.47 1eej h MET 153 Ca 0.04 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.68 1eej h MET 153 Cb 0.05 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.71 1eej h MET 153 CO -0.08 0.00 -0.05 0.00 1.06 0.00 0.00 176.91 177.84 1eej n ALA 154 N -2.06 2.70 -0.33 6.32 0.00 -0.35 -4.90 120.51 121.87 1eej n ALA 154 Ca -0.02 -0.36 0.00 0.00 0.00 0.00 0.00 53.44 53.06 1eej n ALA 154 Cb 0.11 -1.26 0.00 0.00 0.00 0.00 0.00 19.45 18.29 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 1.18 0.76 3.97 0.00 0.00 0.66 -5.06 105.19 106.71 1eej n GLY 155 Ca 0.18 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.97 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 -0.67 1.98 -0.17 1.61 1.02 -0.46 -5.00 119.74 118.05 1eej s LYS 156 Ca 0.00 -0.82 -0.05 0.00 0.02 0.00 0.00 55.97 55.12 1eej s LYS 156 Cb 0.00 -2.32 -0.03 0.00 -0.52 0.00 0.00 37.83 34.96 1eej s LYS 156 CO 0.00 -1.24 0.01 -1.12 -0.92 0.00 0.00 175.35 172.08 1eej s SER 157 N -4.61 5.13 0.24 2.83 0.01 -1.26 -4.14 113.70 111.90 1eej s SER 157 Ca 0.63 -0.06 -0.13 0.00 1.31 0.00 0.00 55.95 57.69 1eej s SER 157 Cb -0.08 -1.86 -0.08 0.00 0.21 0.00 0.00 66.02 64.21 1eej s SER 157 CO 0.43 0.15 0.63 0.54 0.41 0.00 0.00 173.24 175.40 1eej s VAL 158 N 0.49 4.79 0.18 3.43 0.11 -1.26 -4.95 120.40 123.19 1eej s VAL 158 Ca -0.00 0.79 -0.30 0.00 -2.93 0.00 0.00 61.98 59.53 1eej s VAL 158 Cb -0.14 -3.67 -0.08 0.00 -1.53 0.00 0.00 36.38 30.97 1eej s VAL 158 CO 0.02 -0.01 1.20 0.00 -3.33 0.00 0.00 175.10 172.97 1eej s ALA 159 N -1.76 3.43 0.29 1.54 0.00 -1.26 -4.96 121.76 119.04 1eej s ALA 159 Ca 0.47 0.94 -0.30 0.00 0.00 0.00 0.00 51.96 53.08 1eej s ALA 159 Cb -0.12 -3.42 -0.13 0.00 0.00 0.00 0.00 23.12 19.45 1eej s ALA 159 CO 0.20 -0.37 1.38 -2.30 0.00 0.00 0.00 175.76 174.67 1eej n PRO 160 N 2.61 2.17 -3.90 0.00 -0.02 -1.26 -4.81 135.00 129.78 1eej n PRO 160 Ca 0.05 0.77 -0.10 0.00 -2.02 0.00 0.00 63.50 62.19 1eej n PRO 160 Cb 0.45 -2.41 -0.10 0.00 -0.02 0.00 0.00 33.50 31.42 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 -0.49 -0.19 -0.01 3.55 0.00 -1.26 -5.06 121.76 118.29 1eej s ALA 161 Ca 0.62 -0.32 0.04 0.00 0.00 0.00 0.00 51.96 52.30 1eej s ALA 161 Cb -0.59 0.16 -0.01 0.00 0.00 0.00 0.00 23.12 22.68 1eej s ALA 161 CO 0.55 -0.23 -0.13 0.45 0.00 0.00 0.00 175.76 176.39 1eej s SER 162 N -1.61 1.58 0.15 0.00 0.15 -1.26 -4.29 113.70 108.42 1eej s SER 162 Ca -0.12 -0.24 -0.07 0.00 0.70 0.00 0.00 55.95 56.21 1eej s SER 162 Cb -0.06 -0.23 0.03 0.00 -1.71 0.00 0.00 66.02 64.05 1eej s SER 162 CO -0.01 0.15 0.37 0.00 1.20 0.00 0.00 173.24 174.96 1eej n ASP 164 N -1.15 0.34 -4.75 0.00 5.68 -1.26 -4.84 116.55 110.56 1eej n ASP 164 Ca -0.03 -1.24 -0.41 0.00 -0.50 0.00 0.00 54.79 52.60 1eej n ASP 164 Cb 0.26 -0.01 -0.02 0.00 -1.14 0.00 0.00 41.12 40.21 1eej n ASP 164 CO 0.00 0.00 0.00 -0.69 -1.33 0.00 0.00 177.20 175.18 1eej s VAL 165 N -1.98 2.77 -0.30 2.12 1.01 -1.26 -4.98 120.40 117.78 1eej s VAL 165 Ca 0.40 0.68 0.03 0.00 0.00 0.00 0.00 61.98 63.08 1eej s VAL 165 Cb 0.19 -3.43 0.08 0.00 0.00 0.00 0.00 36.38 33.22 1eej s VAL 165 CO 0.31 0.12 -0.02 -0.62 0.00 0.00 0.00 175.10 174.90 1eej s ASP 166 N 0.12 4.48 0.57 3.32 -1.08 -1.26 -4.97 116.67 117.84 1eej s ASP 166 Ca 0.56 -1.72 0.26 0.00 -0.52 0.00 0.00 52.55 51.13 1eej s ASP 166 Cb -0.40 -1.48 1.58 0.00 -1.46 0.00 0.00 42.92 41.16 1eej s ASP 166 CO 0.45 -0.30 2.12 0.40 0.52 0.00 0.00 175.17 178.36 1eej h ILE 167 N 6.67 0.60 -0.09 4.11 1.08 -1.94 -0.45 117.51 127.47 1eej h ILE 167 Ca -0.12 0.00 0.01 0.00 -0.39 0.00 0.00 64.86 64.37 1eej h ILE 167 Cb 1.03 0.87 -0.00 0.00 -3.07 0.00 0.00 36.82 35.65 1eej h ILE 167 CO 0.48 0.00 0.06 0.00 -0.69 0.00 0.00 178.15 178.00 1eej h ALA 168 N 1.83 2.01 -0.31 1.87 0.00 -1.94 -0.44 119.26 122.29 1eej h ALA 168 Ca 0.08 -0.00 -0.16 0.00 0.00 0.00 0.00 54.91 54.83 1eej h ALA 168 Cb 0.42 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.19 1eej h ALA 168 CO -0.00 -0.03 -0.43 -0.44 0.00 0.00 0.00 179.25 178.36 1eej h ASP 169 N 0.06 0.91 -0.08 0.00 3.32 -1.48 0.15 116.42 119.31 1eej h ASP 169 Ca 0.04 -0.50 -0.01 0.00 0.02 0.00 0.00 57.03 56.58 1eej h ASP 169 Cb 0.08 -0.26 -0.00 0.00 0.22 0.00 0.00 39.33 39.37 1eej h ASP 169 CO -0.00 1.24 0.02 0.45 -1.72 0.00 0.00 179.24 179.22 1eej h HIS 170 N 0.62 0.13 0.22 4.55 3.86 -1.38 -0.44 115.15 122.71 1eej h HIS 170 Ca 0.03 -0.01 -0.01 0.00 -1.16 0.00 0.00 60.37 59.22 1eej h HIS 170 Cb 1.03 -0.04 0.00 0.00 1.06 0.00 0.00 27.41 29.46 1eej h HIS 170 CO 0.07 0.30 -0.11 -0.92 0.86 0.00 0.00 177.93 178.14 1eej h TYR 171 N -0.08 -0.28 -0.47 2.45 3.20 -1.10 -0.88 116.97 119.82 1eej h TYR 171 Ca 0.03 -0.01 0.04 0.00 3.14 0.00 0.00 58.73 61.93 1eej h TYR 171 Cb 0.23 0.09 -0.04 0.00 1.54 0.00 0.00 36.73 38.56 1eej h TYR 171 CO 0.00 -0.15 0.23 0.00 -1.64 0.00 0.00 178.16 176.60 1eej h ALA 172 N 0.46 0.59 -0.66 1.82 0.00 -0.68 -0.70 119.26 120.09 1eej h ALA 172 Ca -0.03 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.87 1eej h ALA 172 Cb 0.25 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 1eej h ALA 172 CO 0.05 -0.12 0.30 1.25 0.00 0.00 0.00 179.25 180.73 1eej h LEU 173 N 0.46 0.88 -0.49 0.00 5.85 -0.96 -0.64 115.31 120.40 1eej h LEU 173 Ca 0.20 -0.14 0.02 0.00 0.84 0.00 0.00 57.88 58.80 1eej h LEU 173 Cb 0.11 -0.23 -0.03 0.00 0.37 0.00 0.00 40.66 40.88 1eej h LEU 173 CO -0.14 0.78 0.29 1.23 -0.34 0.00 0.00 178.44 180.25 1eej h GLY 174 N 0.92 0.69 0.98 3.75 0.00 -0.62 -0.34 103.07 108.45 1eej h GLY 174 Ca 0.22 -0.22 0.01 0.00 0.00 0.00 0.00 47.33 47.34 1eej h GLY 174 CO -0.03 0.19 0.19 -2.08 0.00 0.00 0.00 176.54 174.81 1eej h VAL 175 N 0.58 1.07 -0.31 4.60 2.07 -0.71 0.74 116.25 124.29 1eej h VAL 175 Ca 0.20 -0.14 -0.00 0.00 0.82 0.00 0.00 66.70 67.58 1eej h VAL 175 Cb 0.02 0.64 -0.02 0.00 -1.52 0.00 0.00 31.29 30.41 1eej h VAL 175 CO -0.09 0.07 0.18 1.56 0.02 0.00 0.00 177.57 179.32 1eej h GLN 176 N 0.39 0.42 0.00 1.57 1.08 -0.72 -1.73 115.11 116.13 1eej h GLN 176 Ca 0.11 -0.03 0.00 0.00 -1.45 0.00 0.00 58.65 57.28 1eej h GLN 176 Cb -0.04 -0.09 0.00 0.00 -0.05 0.00 0.00 27.48 27.30 1eej h GLN 176 CO -0.03 0.30 0.00 -0.07 -0.95 0.00 0.00 178.83 178.08 1eej h LEU 177 N 0.43 0.00 0.00 1.46 3.38 -0.40 -3.47 115.31 116.70 1eej h LEU 177 Ca 0.11 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.08 1eej h LEU 177 Cb -0.01 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.74 1eej h LEU 177 CO -0.02 0.00 0.00 0.61 0.09 0.00 0.00 178.44 179.12 1eej n GLY 178 N 1.05 1.26 3.69 0.83 0.00 -0.65 -4.93 105.19 106.45 1eej n GLY 178 Ca 0.04 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.64 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 2.83 -0.06 1.61 1.01 0.17 -4.86 120.40 119.10 1eej s VAL 179 Ca 0.00 0.34 0.09 0.00 0.00 0.00 0.00 61.98 62.41 1eej s VAL 179 Cb 0.00 -3.22 0.13 0.00 0.00 0.00 0.00 36.38 33.29 1eej s VAL 179 CO 0.00 0.00 1.04 -1.54 0.00 0.00 0.00 175.10 174.61 1eej n SER 180 N 5.45 1.15 0.00 3.32 3.41 -1.26 -4.59 113.62 121.09 1eej n SER 180 Ca 0.16 -2.44 0.00 0.00 -0.26 0.00 0.00 58.87 56.33 1eej n SER 180 Cb 0.40 -0.28 0.00 0.00 -0.26 0.00 0.00 64.21 64.06 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 -0.67 1.52 3.27 5.00 0.00 -1.26 -5.15 105.19 107.89 1eej n GLY 181 Ca 0.07 -0.82 -0.24 0.00 0.00 0.00 0.00 46.02 45.02 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 -2.00 1.68 0.46 2.61 -4.23 -1.26 -3.90 115.64 109.01 1eej s THR 182 Ca 0.00 -1.40 -0.20 0.00 -1.18 0.00 0.00 61.69 58.91 1eej s THR 182 Cb 0.00 -1.51 -0.10 0.00 1.34 0.00 0.00 72.50 72.24 1eej s THR 182 CO 0.00 0.04 0.99 -2.16 -0.54 0.00 0.00 174.62 172.95 1eej s PRO 183 N -1.61 4.03 -0.08 3.99 0.04 -1.26 -4.79 135.00 135.31 1eej s PRO 183 Ca 0.07 1.19 0.03 0.00 0.04 0.00 0.00 61.00 62.32 1eej s PRO 183 Cb -0.09 -2.14 0.01 0.00 0.04 0.00 0.00 34.50 32.31 1eej s PRO 183 CO 0.03 -0.21 -0.16 0.00 0.04 0.00 0.00 177.00 176.69 1eej s ALA 184 N -2.16 1.60 -0.15 8.56 0.00 -0.93 -0.64 121.76 128.03 1eej s ALA 184 Ca 0.64 -0.62 -0.06 0.00 0.00 0.00 0.00 51.96 51.91 1eej s ALA 184 Cb -0.12 -0.67 -0.04 0.00 0.00 0.00 0.00 23.12 22.30 1eej s ALA 184 CO 0.18 0.16 0.06 0.08 0.00 0.00 0.00 175.76 176.24 1eej s VAL 185 N 0.58 4.79 -0.22 0.00 1.01 -0.50 -0.66 120.40 125.39 1eej s VAL 185 Ca -0.16 -0.05 -0.03 0.00 0.00 0.00 0.00 61.98 61.75 1eej s VAL 185 Cb -0.16 -3.11 0.00 0.00 0.00 0.00 0.00 36.38 33.10 1eej s VAL 185 CO 0.05 0.52 -0.06 -0.69 0.00 0.00 0.00 175.10 174.92 1eej s VAL 186 N -0.16 3.14 0.77 2.92 1.01 0.10 1.00 120.40 129.17 1eej s VAL 186 Ca 0.07 -0.63 -0.11 0.00 0.00 0.00 0.00 61.98 61.31 1eej s VAL 186 Cb -0.12 -2.44 0.05 0.00 0.00 0.00 0.00 36.38 33.87 1eej s VAL 186 CO 0.01 0.40 1.09 -0.76 0.00 0.00 0.00 175.10 175.84 1eej s LEU 187 N 1.43 2.76 0.66 3.92 1.43 0.11 -1.67 118.68 127.31 1eej s LEU 187 Ca 0.05 1.38 0.41 0.00 -1.03 0.00 0.00 54.13 54.93 1eej s LEU 187 Cb -0.14 -4.07 2.24 0.00 0.03 0.00 0.00 46.19 44.24 1eej s LEU 187 CO -0.05 -1.80 2.30 0.77 0.23 0.00 0.00 176.35 177.80 1eej h SER 188 N -0.97 0.00 0.17 2.29 4.64 -1.90 0.15 113.55 117.94 1eej h SER 188 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 1eej h SER 188 Cb 1.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.34 1eej h SER 188 CO 0.59 0.00 -0.31 -0.46 -0.87 0.00 0.00 176.83 175.78 1eej n ASN 189 N -3.19 1.28 0.00 4.97 6.94 -1.26 -4.94 115.26 119.05 1eej n ASN 189 Ca -0.03 -1.05 0.00 0.00 -0.02 0.00 0.00 54.58 53.48 1eej n ASN 189 Cb 0.12 0.22 0.00 0.00 -2.36 0.00 0.00 39.78 37.76 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 1.36 0.69 3.74 4.83 0.00 0.53 -5.08 105.19 111.26 1eej n GLY 190 Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.04 2.90 -0.17 2.61 2.01 -1.26 -4.65 115.64 115.03 1eej s THR 191 Ca 0.00 0.76 -0.15 0.00 0.31 0.00 0.00 61.69 62.60 1eej s THR 191 Cb 0.00 -3.48 -0.04 0.00 0.01 0.00 0.00 72.50 68.98 1eej s THR 191 CO 0.00 0.12 0.36 -0.22 -0.69 0.00 0.00 174.62 174.20 1eej s LEU 192 N -0.39 4.21 -0.36 4.42 2.96 -1.26 0.07 118.68 128.32 1eej s LEU 192 Ca 0.57 0.55 0.01 0.00 -0.22 0.00 0.00 54.13 55.04 1eej s LEU 192 Cb -0.39 -2.48 0.11 0.00 0.50 0.00 0.00 46.19 43.93 1eej s LEU 192 CO 0.42 0.00 0.15 -0.69 -1.32 0.00 0.00 176.35 174.91 1eej s VAL 193 N 0.88 1.16 0.42 1.68 1.01 0.28 -5.00 120.40 120.84 1eej s VAL 193 Ca 0.19 -1.92 -0.25 0.00 0.00 0.00 0.00 61.98 60.00 1eej s VAL 193 Cb -0.14 -1.85 -0.08 0.00 0.00 0.00 0.00 36.38 34.31 1eej s VAL 193 CO 0.07 -0.76 1.26 -2.84 0.00 0.00 0.00 175.10 172.82 1eej s PRO 194 N 1.06 3.90 0.00 2.72 0.02 -1.26 -1.41 135.00 140.03 1eej s PRO 194 Ca 0.13 2.03 0.00 0.00 0.02 0.00 0.00 61.00 63.19 1eej s PRO 194 Cb -0.20 -2.65 0.00 0.00 0.02 0.00 0.00 34.50 31.66 1eej s PRO 194 CO -0.13 -0.51 0.00 0.41 -0.33 0.00 0.00 177.00 176.44 1eej n GLY 195 N 0.64 3.04 3.86 0.52 0.00 0.19 -4.88 105.19 108.56 1eej n GLY 195 Ca 0.05 -1.92 -0.35 0.00 0.00 0.00 0.00 46.02 43.79 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 -2.82 3.61 -0.05 1.61 5.04 -1.26 -4.61 117.35 118.88 1eej s TYR 196 Ca 0.00 0.89 -0.03 0.00 -2.44 0.00 0.00 57.07 55.49 1eej s TYR 196 Cb 0.00 -2.23 0.03 0.00 0.35 0.00 0.00 41.96 40.10 1eej s TYR 196 CO 0.00 0.52 0.11 -0.65 -1.34 0.00 0.00 175.55 174.18 1eej s GLN 197 N -1.78 0.08 0.88 4.97 -0.21 -1.26 -5.11 119.66 117.23 1eej s GLN 197 Ca 0.33 0.24 -0.11 0.00 0.02 0.00 0.00 55.36 55.84 1eej s GLN 197 Cb -0.15 -0.09 0.12 0.00 1.00 0.00 0.00 33.01 33.89 1eej s GLN 197 CO 0.18 -0.10 1.10 -2.14 -2.12 0.00 0.00 175.29 172.20 1eej s PRO 198 N 0.70 1.35 0.14 2.91 0.02 -1.26 -4.59 135.00 134.27 1eej s PRO 198 Ca -0.05 1.15 -0.31 0.00 0.02 0.00 0.00 61.00 61.80 1eej s PRO 198 Cb -0.07 -1.79 -0.08 0.00 0.02 0.00 0.00 34.50 32.58 1eej s PRO 198 CO -0.03 -2.27 1.55 -1.35 -0.33 0.00 0.00 177.00 174.57 1eej h PRO 199 N -1.59 -0.28 -0.21 5.54 0.11 -1.93 0.43 132.00 134.07 1eej h PRO 199 Ca -0.47 0.02 0.02 0.00 0.11 0.00 0.00 66.00 65.68 1eej h PRO 199 Cb 1.26 0.06 -0.02 0.00 0.11 0.00 0.00 31.00 32.42 1eej h PRO 199 CO 0.49 -0.18 0.09 0.87 -0.21 0.00 0.00 178.00 179.06 1eej h LYS 200 N -0.29 0.19 -0.45 1.05 1.57 -1.92 0.19 116.57 116.91 1eej h LYS 200 Ca 0.11 -0.01 -0.02 0.00 -1.87 0.00 0.00 60.65 58.86 1eej h LYS 200 Cb 0.55 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.80 1eej h LYS 200 CO -0.69 0.13 0.22 0.93 -0.57 0.00 0.00 179.45 179.47 1eej h GLU 201 N 0.20 0.65 -0.80 3.15 3.07 -1.84 -1.67 114.58 117.34 1eej h GLU 201 Ca 0.09 -0.09 0.01 0.00 -0.50 0.00 0.00 59.36 58.87 1eej h GLU 201 Cb 0.04 -0.12 -0.04 0.00 -0.84 0.00 0.00 28.75 27.79 1eej h GLU 201 CO -0.08 0.55 0.53 1.98 -1.40 0.00 0.00 179.01 180.59 1eej h MET 202 N 0.59 1.04 -0.54 2.33 4.05 0.15 0.99 114.93 123.53 1eej h MET 202 Ca 0.16 -0.06 -0.03 0.00 -0.28 0.00 0.00 59.70 59.49 1eej h MET 202 Cb 0.11 -0.23 -0.02 0.00 -0.80 0.00 0.00 31.60 30.65 1eej h MET 202 CO -0.02 0.69 0.23 -0.22 0.23 0.00 0.00 176.91 177.81 1eej h LYS 203 N 1.07 0.81 -0.12 0.39 1.63 -0.66 0.50 116.57 120.18 1eej h LYS 203 Ca 0.30 -0.14 -0.01 0.00 -0.85 0.00 0.00 60.65 59.96 1eej h LYS 203 Cb -0.09 -0.13 -0.01 0.00 -0.60 0.00 0.00 32.23 31.40 1eej h LYS 203 CO -0.08 0.69 0.05 1.49 -3.45 0.00 0.00 179.45 178.15 1eej h GLU 204 N 0.74 0.18 -0.39 1.90 4.57 -0.83 -0.08 114.58 120.66 1eej h GLU 204 Ca 0.18 -0.03 0.06 0.00 -1.18 0.00 0.00 59.36 58.39 1eej h GLU 204 Cb 0.18 -0.03 -0.05 0.00 -0.16 0.00 0.00 28.75 28.69 1eej h GLU 204 CO -0.02 0.29 0.08 0.35 -1.18 0.00 0.00 179.01 178.53 1eej h PHE 205 N 0.03 0.12 -0.36 0.92 3.57 -0.56 -0.85 116.94 119.82 1eej h PHE 205 Ca 0.04 0.02 -0.11 0.00 3.53 0.00 0.00 57.97 61.45 1eej h PHE 205 Cb 0.18 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 38.91 1eej h PHE 205 CO -0.01 0.01 -0.23 -0.07 -2.23 0.00 0.00 178.31 175.77 1eej h LEU 206 N 0.20 0.72 -0.51 0.59 3.38 -0.76 0.47 115.31 119.41 1eej h LEU 206 Ca 0.19 -0.26 -0.03 0.00 0.09 0.00 0.00 57.88 57.87 1eej h LEU 206 Cb 0.23 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 1eej h LEU 206 CO -0.25 0.93 0.20 0.44 0.09 0.00 0.00 178.44 179.85 1eej h ASP 207 N 0.62 0.70 -0.29 -0.43 3.32 -0.50 0.28 116.42 120.12 1eej h ASP 207 Ca 0.09 -0.17 -0.03 0.00 0.02 0.00 0.00 57.03 56.93 1eej h ASP 207 Cb 0.73 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 40.08 1eej h ASP 207 CO 0.06 0.69 0.04 -0.33 -1.72 0.00 0.00 179.24 177.98 1eej h GLU 208 N 0.68 0.48 -0.53 3.56 4.39 -0.95 -1.00 114.58 121.21 1eej h GLU 208 Ca 0.17 -0.13 0.01 0.00 0.34 0.00 0.00 59.36 59.75 1eej h GLU 208 Cb 0.21 -0.06 -0.03 0.00 -0.10 0.00 0.00 28.75 28.77 1eej h GLU 208 CO -0.01 0.59 0.34 1.25 -1.16 0.00 0.00 179.01 180.02 1eej h HIS 209 N 0.30 0.65 -0.87 4.33 2.76 -0.73 0.43 115.15 122.02 1eej h HIS 209 Ca 0.09 0.02 -0.01 0.00 -2.20 0.00 0.00 60.37 58.26 1eej h HIS 209 Cb 0.34 -0.22 -0.04 0.00 1.55 0.00 0.00 27.41 29.04 1eej h HIS 209 CO 0.02 0.40 0.50 0.37 -1.30 0.00 0.00 177.93 177.92 1eej h GLN 210 N 0.70 1.20 -0.31 5.26 4.15 -0.79 0.39 115.11 125.70 1eej h GLN 210 Ca 0.20 -0.13 -0.15 0.00 0.77 0.00 0.00 58.65 59.34 1eej h GLN 210 Cb -0.06 -0.24 -0.00 0.00 0.21 0.00 0.00 27.48 27.38 1eej h GLN 210 CO -0.05 0.86 -0.41 0.87 -1.93 0.00 0.00 178.83 178.17 1eej h LYS 211 N 1.20 0.82 -0.37 1.69 1.57 -0.56 -2.04 116.57 118.89 1eej h LYS 211 Ca 0.31 -0.47 -0.11 0.00 -1.87 0.00 0.00 60.65 58.50 1eej h LYS 211 Cb -0.01 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.32 1eej h LYS 211 CO -0.05 1.11 -0.23 0.52 -0.57 0.00 0.00 179.45 180.22 1eej h MET 212 N 0.59 0.73 0.00 3.15 2.86 0.21 0.55 114.93 123.03 1eej h MET 212 Ca 0.04 -0.30 -0.04 0.00 -2.06 0.00 0.00 59.70 57.34 1eej h MET 212 Cb 1.00 -0.03 -0.01 0.00 0.06 0.00 0.00 31.60 32.62 1eej h MET 212 CO 0.10 0.90 -0.21 1.15 1.06 0.00 0.00 176.91 179.90 1eej h THR 213 N 0.64 0.58 -0.47 2.22 2.02 -0.19 -2.69 112.91 115.02 1eej h THR 213 Ca 0.09 -1.01 0.00 0.00 0.77 0.00 0.00 66.41 66.26 1eej h THR 213 Cb 0.73 1.67 0.00 0.00 -1.74 0.00 0.00 68.15 68.81 1eej h THR 213 CO 0.06 0.21 0.00 -1.54 0.37 0.00 0.00 175.52 174.61 1eej n SER 214 N -3.46 3.34 -0.63 4.18 3.41 -0.77 -4.95 113.62 114.74 1eej n SER 214 Ca -0.00 -1.96 -0.08 0.00 -0.26 0.00 0.00 58.87 56.57 1eej n SER 214 Cb 0.39 -0.31 -0.04 0.00 -0.26 0.00 0.00 64.21 63.99 1eej n SER 214 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1eej n GLY 215 N 1.14 0.89 0.59 5.00 0.00 -0.20 -5.03 105.19 107.58 1eej n GLY 215 Ca 0.18 -0.15 0.07 0.00 0.00 0.00 0.00 46.02 46.12 1eej n GLY 215 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60