#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2eea s SER 2 N 0.00 0.62 0.19 1.61 0.01 -1.26 -5.19 113.70 109.68 2eea s SER 2 Ca 0.00 -1.36 -0.23 0.00 1.31 0.00 0.00 55.95 55.67 2eea s SER 2 Cb 0.00 0.60 0.05 0.00 0.21 0.00 0.00 66.02 66.89 2eea s SER 2 CO 0.00 -1.19 0.70 -0.94 0.41 0.00 0.00 173.24 172.22 2eea s SER 3 N -3.18 -0.41 0.00 2.44 1.04 -1.26 -5.08 113.70 107.25 2eea s SER 3 Ca 0.30 -0.25 0.00 0.00 0.48 0.00 0.00 55.95 56.48 2eea s SER 3 Cb 0.01 0.62 0.00 0.00 0.10 0.00 0.00 66.02 66.75 2eea s SER 3 CO 0.17 -1.07 0.00 0.61 0.98 0.00 0.00 173.24 173.92 2eea n GLY 4 N -0.40 -0.19 2.88 7.32 0.00 -1.26 -5.11 105.19 108.43 2eea n GLY 4 Ca -0.11 -0.04 -0.52 0.00 0.00 0.00 0.00 46.02 45.35 2eea n GLY 4 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2eea n SER 5 N -1.99 0.79 -4.13 1.61 3.41 -1.26 -4.92 113.62 107.14 2eea n SER 5 Ca 0.00 0.92 -0.13 0.00 -0.26 0.00 0.00 58.87 59.40 2eea n SER 5 Cb 0.00 -0.69 -0.10 0.00 -0.26 0.00 0.00 64.21 63.16 2eea n SER 5 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2eea s SER 6 N 1.97 0.33 -0.38 4.04 1.04 -1.26 -5.13 113.70 114.31 2eea s SER 6 Ca 0.80 -1.42 -0.03 0.00 0.48 0.00 0.00 55.95 55.78 2eea s SER 6 Cb -1.14 0.39 0.20 0.00 0.10 0.00 0.00 66.02 65.57 2eea s SER 6 CO 0.61 -0.86 0.96 -0.83 0.98 0.00 0.00 173.24 174.10 2eea s GLY 7 N -3.19 -1.62 -0.10 7.32 0.00 -1.26 -5.13 107.32 103.34 2eea s GLY 7 Ca 0.39 0.52 -0.29 0.00 0.00 0.00 0.00 44.72 45.34 2eea s GLY 7 CO 0.13 4.11 1.53 2.56 0.00 0.00 0.00 173.10 181.43 2eea s PRO 8 N 1.31 4.18 -0.30 2.90 0.04 -1.26 -4.97 135.00 136.90 2eea s PRO 8 Ca 0.22 1.99 -0.16 0.00 0.04 0.00 0.00 61.00 63.09 2eea s PRO 8 Cb 0.06 -3.92 0.19 0.00 0.04 0.00 0.00 34.50 30.86 2eea s PRO 8 CO -0.10 -0.83 1.15 -1.83 0.04 0.00 0.00 177.00 175.43 2eea s GLU 9 N 3.90 0.18 -0.08 4.56 -1.05 -1.26 -5.16 118.70 119.79 2eea s GLU 9 Ca 0.67 0.31 -0.09 0.00 -0.15 0.00 0.00 54.97 55.71 2eea s GLU 9 Cb -0.29 0.04 -0.04 0.00 -0.44 0.00 0.00 34.13 33.39 2eea s GLU 9 CO 0.25 -0.04 0.22 0.45 0.95 0.00 0.00 175.26 177.09 2eea s SER 10 N 1.18 6.50 0.15 0.83 0.15 -1.26 -5.07 113.70 116.18 2eea s SER 10 Ca -0.08 0.59 -0.31 0.00 0.70 0.00 0.00 55.95 56.85 2eea s SER 10 Cb -0.03 -2.11 -0.08 0.00 -1.71 0.00 0.00 66.02 62.09 2eea s SER 10 CO -0.12 0.37 1.34 -2.16 1.20 0.00 0.00 173.24 173.87 2eea s PRO 11 N -1.13 4.36 -0.58 5.44 0.04 -1.26 -5.00 135.00 136.87 2eea s PRO 11 Ca 0.18 2.04 0.04 0.00 0.04 0.00 0.00 61.00 63.31 2eea s PRO 11 Cb -0.13 -3.23 0.15 0.00 0.04 0.00 0.00 34.50 31.33 2eea s PRO 11 CO 0.08 -0.34 0.38 -0.51 0.04 0.00 0.00 177.00 176.65 2eea s LEU 12 N 0.54 3.89 0.00 -3.56 1.43 -1.26 -5.07 118.68 114.65 2eea s LEU 12 Ca 0.60 -3.36 0.03 0.00 -1.03 0.00 0.00 54.13 50.38 2eea s LEU 12 Cb -0.36 -1.38 -0.01 0.00 0.03 0.00 0.00 46.19 44.47 2eea s LEU 12 CO 0.34 -0.16 0.30 0.00 0.23 0.00 0.00 176.35 177.06 2eea n GLN 13 N 2.61 0.44 -3.83 1.70 6.02 -1.26 -5.19 117.38 117.86 2eea n GLN 13 Ca 0.16 -2.49 -0.13 0.00 -0.01 0.00 0.00 57.00 54.52 2eea n GLN 13 Cb 0.36 2.19 -0.02 0.00 1.02 0.00 0.00 30.24 33.79 2eea n GLN 13 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 177.06 177.24 2eea n PHE 14 N -0.49 -1.50 -3.65 1.08 3.01 -1.26 -5.18 117.46 109.47 2eea n PHE 14 Ca 0.04 -2.18 -0.02 0.00 1.01 0.00 0.00 57.45 56.30 2eea n PHE 14 Cb 0.48 0.56 -0.07 0.00 -0.01 0.00 0.00 39.48 40.45 2eea n PHE 14 CO 0.00 0.00 0.00 1.52 1.01 0.00 0.00 176.76 179.29 2eea s TYR 15 N -2.98 -0.26 -0.50 1.38 1.13 -1.26 -5.12 117.35 109.74 2eea s TYR 15 Ca 0.26 0.56 0.03 0.00 -1.41 0.00 0.00 57.07 56.51 2eea s TYR 15 Cb -0.01 0.27 0.14 0.00 -1.10 0.00 0.00 41.96 41.26 2eea s TYR 15 CO 0.19 -0.13 0.29 0.14 -2.51 0.00 0.00 175.55 173.53 2eea s VAL 16 N 0.79 1.87 -0.52 -3.49 -7.23 -1.26 -4.94 120.40 105.61 2eea s VAL 16 Ca -0.03 -3.03 0.02 0.00 -1.81 0.00 0.00 61.98 57.13 2eea s VAL 16 Cb -0.04 -2.29 0.50 0.00 0.56 0.00 0.00 36.38 35.11 2eea s VAL 16 CO -0.12 -0.91 1.81 0.59 -0.31 0.00 0.00 175.10 176.16 2eea n ASN 17 N 3.14 5.95 -4.44 4.85 4.13 -1.26 -5.04 115.26 122.59 2eea n ASN 17 Ca 0.11 -3.75 -0.42 0.00 1.68 0.00 0.00 54.58 52.20 2eea n ASN 17 Cb 0.35 -0.81 0.00 0.00 -1.54 0.00 0.00 39.78 37.79 2eea n ASN 17 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2eea n TYR 18 N -0.95 -0.56 0.23 3.10 0.18 -1.26 -4.85 117.16 113.05 2eea n TYR 18 Ca 0.56 0.62 0.11 0.00 1.88 0.00 0.00 57.90 61.06 2eea n TYR 18 Cb 0.94 -1.98 0.53 0.00 -0.38 0.00 0.00 39.34 38.44 2eea n TYR 18 CO 0.00 0.00 0.00 -1.00 -2.08 0.00 0.00 176.86 173.78 2eea h PRO 19 N 0.81 0.00 -4.88 -3.48 0.13 -2.06 -3.45 132.00 119.07 2eea h PRO 19 Ca -0.40 0.00 -0.65 0.00 -0.87 0.00 0.00 66.00 64.08 2eea h PRO 19 Cb 1.40 0.00 0.04 0.00 0.13 0.00 0.00 31.00 32.57 2eea h PRO 19 CO 0.52 0.20 0.10 -1.71 -0.23 0.00 0.00 178.00 176.88 2eea n ASN 20 N -3.45 0.09 -3.62 1.44 2.85 -1.26 -4.93 115.26 106.38 2eea n ASN 20 Ca -0.00 0.95 -0.05 0.00 -0.11 0.00 0.00 54.58 55.36 2eea n ASN 20 Cb 0.38 -0.74 -0.05 0.00 1.24 0.00 0.00 39.78 40.61 2eea n ASN 20 CO 0.00 0.00 0.00 -0.44 -2.11 0.00 0.00 177.26 174.71 2eea s SER 21 N 0.24 -0.17 0.00 1.20 0.01 -1.26 -5.15 113.70 108.58 2eea s SER 21 Ca 0.75 0.21 0.00 0.00 1.31 0.00 0.00 55.95 58.22 2eea s SER 21 Cb -1.05 0.17 0.00 0.00 0.21 0.00 0.00 66.02 65.35 2eea s SER 21 CO 0.48 -0.14 0.00 0.61 0.41 0.00 0.00 173.24 174.60 2eea n GLY 22 N 0.76 1.20 3.49 3.44 0.00 -1.26 -5.18 105.19 107.65 2eea n GLY 22 Ca -0.05 -0.51 -0.25 0.00 0.00 0.00 0.00 46.02 45.21 2eea n GLY 22 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2eea s SER 23 N 2.00 2.68 -0.02 1.61 1.04 -1.26 -5.14 113.70 114.62 2eea s SER 23 Ca 0.00 -1.71 0.07 0.00 0.48 0.00 0.00 55.95 54.79 2eea s SER 23 Cb 0.00 0.56 -0.02 0.00 0.10 0.00 0.00 66.02 66.66 2eea s SER 23 CO 0.00 -0.98 -0.24 -0.69 0.98 0.00 0.00 173.24 172.32 2eea s VAL 24 N -3.23 1.86 -0.07 5.02 1.01 -1.26 -4.84 120.40 118.89 2eea s VAL 24 Ca 0.25 -1.02 -0.13 0.00 0.00 0.00 0.00 61.98 61.09 2eea s VAL 24 Cb 0.02 -1.55 0.03 0.00 0.00 0.00 0.00 36.38 34.88 2eea s VAL 24 CO 0.16 0.52 0.31 -0.44 0.00 0.00 0.00 175.10 175.65 2eea s SER 25 N -0.58 -0.25 -0.19 3.32 0.01 -1.26 -4.82 113.70 109.94 2eea s SER 25 Ca 0.09 0.35 -0.06 0.00 1.31 0.00 0.00 55.95 57.65 2eea s SER 25 Cb -0.09 0.48 -0.03 0.00 0.21 0.00 0.00 66.02 66.59 2eea s SER 25 CO -0.01 -0.27 0.02 0.00 0.41 0.00 0.00 173.24 173.39 2eea s ALA 26 N -0.57 3.20 -0.05 1.44 0.00 -1.26 -2.37 121.76 122.15 2eea s ALA 26 Ca -0.07 -0.85 -0.12 0.00 0.00 0.00 0.00 51.96 50.92 2eea s ALA 26 Cb -0.04 -1.81 0.02 0.00 0.00 0.00 0.00 23.12 21.29 2eea s ALA 26 CO 0.02 0.06 0.28 1.52 0.00 0.00 0.00 175.76 177.64 2eea s TYR 27 N 0.62 -0.20 0.00 0.00 1.13 -1.02 -5.06 117.35 112.81 2eea s TYR 27 Ca 0.01 0.41 0.00 0.00 -1.41 0.00 0.00 57.07 56.08 2eea s TYR 27 Cb -0.14 0.08 0.00 0.00 -1.10 0.00 0.00 41.96 40.80 2eea s TYR 27 CO 0.02 -0.28 0.00 0.41 -2.51 0.00 0.00 175.55 173.19 2eea n GLY 28 N 1.94 3.21 0.00 5.49 0.00 -1.26 -2.06 105.19 112.52 2eea n GLY 28 Ca -0.18 -1.14 0.07 0.00 0.00 0.00 0.00 46.02 44.76 2eea n GLY 28 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2eea n PRO 29 N -1.32 0.22 0.04 1.61 -0.04 -1.26 -2.23 135.00 132.02 2eea n PRO 29 Ca 0.00 0.14 0.11 0.00 -0.04 0.00 0.00 63.50 63.71 2eea n PRO 29 Cb 0.00 -1.50 0.05 0.00 -0.04 0.00 0.00 33.50 32.01 2eea n PRO 29 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2eea n GLY 30 N -0.04 -1.27 0.13 0.55 0.00 -1.24 -3.58 105.19 99.75 2eea n GLY 30 Ca 0.07 -0.36 -0.19 0.00 0.00 0.00 0.00 46.02 45.54 2eea n GLY 30 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2eea n LEU 31 N -2.04 2.83 -0.08 0.99 4.77 -0.95 -4.45 117.00 118.07 2eea n LEU 31 Ca 0.02 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.89 2eea n LEU 31 Cb 0.45 -0.99 -0.04 0.00 -2.33 0.00 0.00 43.42 40.50 2eea n LEU 31 CO 0.39 0.90 0.78 0.58 -1.33 0.00 0.00 177.39 178.72 2eea h VAL 32 N 0.03 1.24 -2.77 4.08 2.07 -1.72 -3.27 116.25 115.91 2eea h VAL 32 Ca -0.52 -0.83 0.06 0.00 0.82 0.00 0.00 66.70 66.23 2eea h VAL 32 Cb 1.96 1.30 -0.01 0.00 -1.52 0.00 0.00 31.29 33.02 2eea h VAL 32 CO -0.02 0.26 0.42 0.00 0.02 0.00 0.00 177.57 178.26 2eea n TYR 33 N -4.66 -1.87 -3.58 1.57 0.18 -1.23 -0.92 117.16 106.64 2eea n TYR 33 Ca -0.03 -1.55 -0.03 0.00 1.88 0.00 0.00 57.90 58.16 2eea n TYR 33 Cb 0.22 0.77 0.01 0.00 -0.38 0.00 0.00 39.34 39.96 2eea n TYR 33 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 2eea n GLY 34 N -0.62 1.13 3.02 -7.48 0.00 -1.21 -4.06 105.19 95.97 2eea n GLY 34 Ca -0.06 -1.08 -0.26 0.00 0.00 0.00 0.00 46.02 44.63 2eea n GLY 34 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2eea s VAL 35 N -2.39 1.22 0.10 1.61 1.01 -1.26 -2.66 120.40 118.03 2eea s VAL 35 Ca 0.11 -0.50 -0.35 0.00 0.00 0.00 0.00 61.98 61.24 2eea s VAL 35 Cb -0.02 -1.13 -0.14 0.00 0.00 0.00 0.00 36.38 35.08 2eea s VAL 35 CO 0.04 0.38 1.55 0.00 0.00 0.00 0.00 175.10 177.07 2eea n ALA 36 N 4.06 0.64 -3.21 5.51 0.00 0.55 -1.65 120.51 126.41 2eea n ALA 36 Ca -0.20 0.45 -0.16 0.00 0.00 0.00 0.00 53.44 53.53 2eea n ALA 36 Cb 0.51 -2.29 0.06 0.00 0.00 0.00 0.00 19.45 17.74 2eea n ALA 36 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 2eea n ASN 37 N 3.58 -3.95 -3.70 0.00 5.03 -1.13 -4.83 115.26 110.25 2eea n ASN 37 Ca 0.18 -0.43 -0.11 0.00 0.87 0.00 0.00 54.58 55.09 2eea n ASN 37 Cb 0.26 -3.90 -0.10 0.00 -1.02 0.00 0.00 39.78 35.01 2eea n ASN 37 CO 0.00 0.00 0.00 -0.54 -1.83 0.00 0.00 177.26 174.89 2eea s LYS 38 N -5.59 0.43 0.91 3.52 1.02 -0.66 -5.01 119.74 114.36 2eea s LYS 38 Ca 0.26 0.73 -0.15 0.00 0.02 0.00 0.00 55.97 56.84 2eea s LYS 38 Cb -0.11 0.07 -0.04 0.00 -0.52 0.00 0.00 37.83 37.22 2eea s LYS 38 CO 0.54 -0.13 0.05 0.25 -0.92 0.00 0.00 175.35 175.15 2eea n THR 39 N 3.80 0.30 -3.15 2.17 -2.24 -1.26 -4.22 114.28 109.69 2eea n THR 39 Ca -0.20 -0.33 0.05 0.00 -2.27 0.00 0.00 64.05 61.30 2eea n THR 39 Cb 0.56 -0.43 -0.02 0.00 -2.10 0.00 0.00 70.33 68.34 2eea n THR 39 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2eea s ALA 40 N -2.18 -3.43 0.24 6.98 0.00 -0.83 -4.79 121.76 117.75 2eea s ALA 40 Ca 0.53 1.44 0.11 0.00 0.00 0.00 0.00 51.96 54.04 2eea s ALA 40 Cb -0.24 -2.51 -0.05 0.00 0.00 0.00 0.00 23.12 20.33 2eea s ALA 40 CO 0.70 -1.49 -0.19 -0.08 0.00 0.00 0.00 175.76 174.70 2eea s THR 41 N 2.95 2.22 0.06 0.00 -1.32 -1.26 -2.10 115.64 116.19 2eea s THR 41 Ca 0.01 -2.25 0.00 0.00 -1.21 0.00 0.00 61.69 58.24 2eea s THR 41 Cb -0.10 -2.16 -0.04 0.00 -1.51 0.00 0.00 72.50 68.69 2eea s THR 41 CO -0.12 -0.39 -0.04 0.72 -2.21 0.00 0.00 174.62 172.57 2eea s PHE 42 N -2.44 0.60 0.08 9.09 -0.71 -1.09 -3.70 117.98 119.81 2eea s PHE 42 Ca 0.25 -0.90 -0.06 0.00 -1.04 0.00 0.00 56.93 55.18 2eea s PHE 42 Cb -0.05 -0.40 -0.05 0.00 -1.21 0.00 0.00 43.02 41.31 2eea s PHE 42 CO 0.11 -0.26 0.34 0.99 -1.34 0.00 0.00 175.22 175.07 2eea s THR 43 N -3.26 5.20 -0.18 -4.49 2.01 -0.87 -3.50 115.64 110.55 2eea s THR 43 Ca 0.04 0.17 -0.02 0.00 0.31 0.00 0.00 61.69 62.19 2eea s THR 43 Cb 0.03 -3.61 0.05 0.00 0.01 0.00 0.00 72.50 68.98 2eea s THR 43 CO -0.06 0.21 -0.00 -0.63 -0.69 0.00 0.00 174.62 173.44 2eea s ILE 44 N -1.47 0.81 -0.38 1.82 1.01 -1.21 -2.43 121.20 119.35 2eea s ILE 44 Ca 0.34 -0.60 -0.29 0.00 0.00 0.00 0.00 60.65 60.10 2eea s ILE 44 Cb -0.13 -1.16 -0.08 0.00 0.01 0.00 0.00 42.46 41.10 2eea s ILE 44 CO 0.20 -0.05 2.31 0.52 0.00 0.00 0.00 174.94 177.92 2eea n VAL 45 N 4.96 0.15 -3.70 2.92 0.31 -1.00 -2.63 118.33 119.33 2eea n VAL 45 Ca -0.10 -0.51 -0.29 0.00 -0.01 0.00 0.00 64.34 63.43 2eea n VAL 45 Cb 0.47 -2.34 -0.15 0.00 -0.91 0.00 0.00 33.84 30.90 2eea n VAL 45 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 2eea s THR 46 N 9.48 0.63 -0.12 2.52 -4.23 -1.24 -4.08 115.64 118.60 2eea s THR 46 Ca 1.04 -1.06 0.03 0.00 -1.18 0.00 0.00 61.69 60.52 2eea s THR 46 Cb -0.44 -1.38 0.00 0.00 1.34 0.00 0.00 72.50 72.02 2eea s THR 46 CO 0.36 -0.55 -0.22 -1.83 -0.54 0.00 0.00 174.62 171.84 2eea s GLU 47 N 1.76 3.06 -1.00 3.99 -1.05 -1.26 -4.08 118.70 120.12 2eea s GLU 47 Ca 0.06 -0.86 -0.05 0.00 -0.15 0.00 0.00 54.97 53.97 2eea s GLU 47 Cb -0.17 -2.39 0.05 0.00 -0.44 0.00 0.00 34.13 31.18 2eea s GLU 47 CO -0.22 0.09 0.25 -3.47 0.95 0.00 0.00 175.26 172.85 2eea n ASP 48 N 3.79 -3.13 -0.07 0.83 -0.08 -1.26 -4.79 116.55 111.84 2eea n ASP 48 Ca -0.19 -0.09 0.05 0.00 -1.51 0.00 0.00 54.79 53.05 2eea n ASP 48 Cb 0.52 -2.66 0.40 0.00 2.34 0.00 0.00 41.12 41.72 2eea n ASP 48 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2eea h ALA 49 N 0.98 1.70 -0.81 -1.67 0.00 -1.99 -3.48 119.26 113.98 2eea h ALA 49 Ca -0.31 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.57 2eea h ALA 49 Cb 1.22 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.82 2eea h ALA 49 CO 0.39 0.25 0.00 0.41 0.00 0.00 0.00 179.25 180.30 2eea n GLY 50 N -1.47 -0.82 1.37 0.00 0.00 -1.26 -3.51 105.19 99.50 2eea n GLY 50 Ca 0.06 -1.12 -0.07 0.00 0.00 0.00 0.00 46.02 44.89 2eea n GLY 50 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 2eea n GLU 51 N -0.54 1.33 0.16 1.61 0.28 -1.26 -4.53 120.64 117.69 2eea n GLU 51 Ca 0.00 -0.78 -0.16 0.00 -0.16 0.00 0.00 57.16 56.06 2eea n GLU 51 Cb 0.00 -1.30 -0.09 0.00 1.43 0.00 0.00 31.44 31.47 2eea n GLU 51 CO 0.00 0.00 0.00 0.78 -0.16 0.00 0.00 177.13 177.75 2eea h GLY 52 N 3.16 -1.19 0.00 -1.84 0.00 -1.97 -3.47 103.07 97.76 2eea h GLY 52 Ca 0.16 0.62 0.00 0.00 0.00 0.00 0.00 47.33 48.12 2eea h GLY 52 CO 0.30 -0.31 0.00 0.61 0.00 0.00 0.00 176.54 177.14 2eea n GLY 53 N -1.48 -0.10 3.51 4.60 0.00 -1.26 -4.67 105.19 105.79 2eea n GLY 53 Ca -0.09 0.01 -0.42 0.00 0.00 0.00 0.00 46.02 45.52 2eea n GLY 53 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 2eea s LEU 54 N 0.00 3.94 -0.08 0.99 2.96 -1.26 -2.06 118.68 123.16 2eea s LEU 54 Ca 0.00 -0.50 0.02 0.00 -0.22 0.00 0.00 54.13 53.43 2eea s LEU 54 Cb 0.00 -2.70 -0.02 0.00 0.50 0.00 0.00 46.19 43.96 2eea s LEU 54 CO 0.00 -1.43 -0.13 -1.81 -1.32 0.00 0.00 176.35 171.67 2eea s ASP 55 N 3.26 4.12 0.11 3.68 1.01 -0.94 -5.05 116.67 122.85 2eea s ASP 55 Ca 0.30 -0.22 0.08 0.00 0.71 0.00 0.00 52.55 53.43 2eea s ASP 55 Cb -0.12 -1.19 -0.04 0.00 1.01 0.00 0.00 42.92 42.58 2eea s ASP 55 CO 0.17 0.28 -0.21 -0.76 0.21 0.00 0.00 175.17 174.85 2eea s LEU 56 N -0.32 2.31 0.01 1.23 1.02 -1.26 -1.44 118.68 120.22 2eea s LEU 56 Ca 0.03 -0.70 -0.21 0.00 0.02 0.00 0.00 54.13 53.28 2eea s LEU 56 Cb -0.13 -0.90 0.04 0.00 0.02 0.00 0.00 46.19 45.23 2eea s LEU 56 CO 0.03 0.06 0.46 0.00 0.02 0.00 0.00 176.35 176.92 2eea s ALA 57 N -1.19 -1.17 -0.04 4.21 0.00 0.11 -5.02 121.76 118.66 2eea s ALA 57 Ca 0.07 0.58 -0.05 0.00 0.00 0.00 0.00 51.96 52.56 2eea s ALA 57 Cb -0.10 0.21 0.01 0.00 0.00 0.00 0.00 23.12 23.25 2eea s ALA 57 CO 0.04 -0.40 0.14 0.42 0.00 0.00 0.00 175.76 175.97 2eea s ILE 58 N -1.91 0.02 0.13 0.00 1.01 -1.26 -0.18 121.20 119.01 2eea s ILE 58 Ca -0.09 -0.14 0.04 0.00 0.00 0.00 0.00 60.65 60.47 2eea s ILE 58 Cb -0.02 -0.25 -0.04 0.00 0.01 0.00 0.00 42.46 42.16 2eea s ILE 58 CO 0.02 -0.08 -0.10 -1.61 0.00 0.00 0.00 174.94 173.17 2eea s GLU 59 N -0.21 1.01 0.00 2.79 0.41 -0.72 -4.86 118.70 117.12 2eea s GLU 59 Ca -0.03 -1.39 0.00 0.00 -0.41 0.00 0.00 54.97 53.14 2eea s GLU 59 Cb -0.02 -0.58 0.00 0.00 -1.78 0.00 0.00 34.13 31.75 2eea s GLU 59 CO 0.00 0.07 0.00 0.41 -0.49 0.00 0.00 175.26 175.26 2eea n GLY 60 N -0.05 -0.64 0.23 -1.39 0.00 -1.26 -0.12 105.19 101.96 2eea n GLY 60 Ca -0.11 -0.78 0.11 0.00 0.00 0.00 0.00 46.02 45.23 2eea n GLY 60 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2eea h PRO 61 N 0.00 0.00 -3.82 1.61 0.13 -1.91 -3.44 132.00 124.57 2eea h PRO 61 Ca 0.00 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 64.97 2eea h PRO 61 Cb 0.00 0.00 -0.20 0.00 0.13 0.00 0.00 31.00 30.93 2eea h PRO 61 CO 0.00 0.21 -0.62 -1.12 -0.23 0.00 0.00 178.00 176.24 2eea s SER 62 N -6.18 0.17 0.07 1.44 0.01 -1.26 -5.04 113.70 102.91 2eea s SER 62 Ca -0.00 -0.42 -0.31 0.00 1.31 0.00 0.00 55.95 56.53 2eea s SER 62 Cb 0.11 0.15 -0.07 0.00 0.21 0.00 0.00 66.02 66.42 2eea s SER 62 CO 0.62 -0.35 1.40 -0.75 0.41 0.00 0.00 173.24 174.57 2eea s LYS 63 N -1.57 4.31 -0.20 12.44 2.20 -1.26 -4.84 119.74 130.82 2eea s LYS 63 Ca -0.14 2.03 0.01 0.00 -0.36 0.00 0.00 55.97 57.51 2eea s LYS 63 Cb -0.08 -3.38 0.03 0.00 -1.51 0.00 0.00 37.83 32.88 2eea s LYS 63 CO -0.01 -0.49 -0.18 0.00 -0.36 0.00 0.00 175.35 174.32 2eea s ALA 64 N 1.62 2.37 0.97 3.13 0.00 -1.26 -4.71 121.76 123.87 2eea s ALA 64 Ca 0.64 -1.33 -0.11 0.00 0.00 0.00 0.00 51.96 51.16 2eea s ALA 64 Cb -0.35 -1.27 0.17 0.00 0.00 0.00 0.00 23.12 21.68 2eea s ALA 64 CO 0.29 -0.54 1.11 -1.83 0.00 0.00 0.00 175.76 174.78 2eea s GLU 65 N 1.25 0.62 -0.11 0.00 1.03 -1.26 -4.93 118.70 115.31 2eea s GLU 65 Ca 0.02 1.30 -0.02 0.00 0.03 0.00 0.00 54.97 56.30 2eea s GLU 65 Cb -0.15 -1.70 0.04 0.00 -0.80 0.00 0.00 34.13 31.52 2eea s GLU 65 CO -0.11 -2.82 0.01 0.42 -1.33 0.00 0.00 175.26 171.43 2eea s ILE 66 N -2.64 0.40 -1.00 1.83 1.01 -1.26 -4.01 121.20 115.54 2eea s ILE 66 Ca 0.67 -0.06 -0.02 0.00 0.00 0.00 0.00 60.65 61.24 2eea s ILE 66 Cb -0.23 -0.67 0.31 0.00 0.01 0.00 0.00 42.46 41.89 2eea s ILE 66 CO 0.59 0.12 1.51 -0.24 0.00 0.00 0.00 174.94 176.93 2eea n SER 67 N 5.13 6.42 -4.74 3.58 2.88 0.83 -4.99 113.62 122.73 2eea n SER 67 Ca -0.08 -3.52 -0.37 0.00 -1.33 0.00 0.00 58.87 53.57 2eea n SER 67 Cb 0.49 -1.15 0.06 0.00 -0.75 0.00 0.00 64.21 62.86 2eea n SER 67 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2eea s ILE 69 N -1.43 -0.16 -0.04 0.00 1.01 0.14 -4.96 121.20 115.77 2eea s ILE 69 Ca 0.81 0.34 -0.23 0.00 0.00 0.00 0.00 60.65 61.58 2eea s ILE 69 Cb -0.36 -0.21 -0.04 0.00 0.01 0.00 0.00 42.46 41.85 2eea s ILE 69 CO 0.39 0.14 0.68 -0.62 0.00 0.00 0.00 174.94 175.53 2eea s ASP 70 N 1.96 7.01 -0.09 3.58 2.15 -1.26 -2.20 116.67 127.82 2eea s ASP 70 Ca 0.01 1.21 0.06 0.00 0.43 0.00 0.00 52.55 54.26 2eea s ASP 70 Cb -0.12 -2.41 -0.10 0.00 -0.30 0.00 0.00 42.92 40.00 2eea s ASP 70 CO -0.04 -0.04 -0.00 0.59 -0.17 0.00 0.00 175.17 175.50 2eea n ASN 71 N 3.37 2.96 -4.03 -0.34 3.02 -1.26 -5.01 115.26 113.97 2eea n ASN 71 Ca -0.03 -0.01 -0.32 0.00 -0.03 0.00 0.00 54.58 54.19 2eea n ASN 71 Cb 0.51 0.50 0.00 0.00 -0.61 0.00 0.00 39.78 40.18 2eea n ASN 71 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 2eea n LYS 72 N -2.44 -4.48 0.00 3.52 4.76 -1.26 -4.81 118.16 113.45 2eea n LYS 72 Ca -0.15 0.50 0.00 0.00 -2.87 0.00 0.00 58.31 55.79 2eea n LYS 72 Cb 0.76 -5.28 0.00 0.00 -1.84 0.00 0.00 35.03 28.67 2eea n LYS 72 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 2eea n ASP 73 N -2.78 2.17 0.00 4.39 -0.08 -1.26 -5.02 116.55 113.97 2eea n ASP 73 Ca 0.03 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.31 2eea n ASP 73 Cb 0.53 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.99 2eea n ASP 73 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2eea n GLY 74 N 2.84 0.09 3.70 0.27 0.00 -1.26 -5.08 105.19 105.76 2eea n GLY 74 Ca 0.00 -0.05 -0.09 0.00 0.00 0.00 0.00 46.02 45.88 2eea n GLY 74 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2eea s THR 75 N -0.92 0.00 0.20 2.61 -4.23 -1.26 -3.65 115.64 108.39 2eea s THR 75 Ca 0.00 -1.24 0.05 0.00 -1.18 0.00 0.00 61.69 59.33 2eea s THR 75 Cb 0.00 -2.24 -0.04 0.00 1.34 0.00 0.00 72.50 71.57 2eea s THR 75 CO 0.00 0.00 0.21 0.00 -0.54 0.00 0.00 174.62 174.29 2eea s THR 77 N -1.92 1.48 -0.25 0.00 2.01 -0.93 -3.29 115.64 112.74 2eea s THR 77 Ca 0.33 -1.04 0.01 0.00 0.31 0.00 0.00 61.69 61.29 2eea s THR 77 Cb -0.09 -1.68 0.04 0.00 0.01 0.00 0.00 72.50 70.78 2eea s THR 77 CO 0.25 0.03 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.42 2eea s VAL 78 N 1.44 2.44 -0.09 3.82 1.01 -1.23 0.24 120.40 128.02 2eea s VAL 78 Ca -0.03 -1.30 -0.01 0.00 0.00 0.00 0.00 61.98 60.64 2eea s VAL 78 Cb -0.17 -2.30 -0.03 0.00 0.00 0.00 0.00 36.38 33.88 2eea s VAL 78 CO -0.07 0.14 -0.05 -0.89 0.00 0.00 0.00 175.10 174.22 2eea s THR 79 N 1.22 3.83 0.03 3.92 2.01 -1.22 -2.67 115.64 122.76 2eea s THR 79 Ca -0.03 -0.42 -0.09 0.00 0.31 0.00 0.00 61.69 61.46 2eea s THR 79 Cb -0.18 -2.60 0.00 0.00 0.01 0.00 0.00 72.50 69.74 2eea s THR 79 CO -0.06 0.58 0.19 -0.72 -0.69 0.00 0.00 174.62 173.92 2eea s TYR 80 N -0.55 0.04 -0.15 4.92 1.13 -0.89 -0.12 117.35 121.73 2eea s TYR 80 Ca 0.08 -0.21 0.01 0.00 -1.41 0.00 0.00 57.07 55.55 2eea s TYR 80 Cb -0.12 -0.02 0.02 0.00 -1.10 0.00 0.00 41.96 40.73 2eea s TYR 80 CO 0.02 -0.40 -0.18 -1.17 -2.51 0.00 0.00 175.55 171.32 2eea s LEU 81 N -1.89 1.90 0.87 -3.49 2.96 -1.26 -1.96 118.68 115.80 2eea s LEU 81 Ca -0.08 -0.54 -0.11 0.00 -0.22 0.00 0.00 54.13 53.18 2eea s LEU 81 Cb -0.03 -1.30 0.11 0.00 0.50 0.00 0.00 46.19 45.48 2eea s LEU 81 CO -0.02 -0.00 1.09 -2.16 -1.32 0.00 0.00 176.35 173.94 2eea s PRO 82 N 1.21 1.50 -0.02 0.98 0.04 -1.26 -4.35 135.00 133.09 2eea s PRO 82 Ca 0.00 0.90 0.02 0.00 0.04 0.00 0.00 61.00 61.96 2eea s PRO 82 Cb -0.14 -1.83 -0.03 0.00 0.04 0.00 0.00 34.50 32.55 2eea s PRO 82 CO -0.08 -2.09 0.00 2.41 0.04 0.00 0.00 177.00 177.28 2eea n THR 83 N -3.79 0.15 -3.81 1.26 -1.04 -1.26 -2.85 114.28 102.93 2eea n THR 83 Ca 0.07 -0.09 -0.12 0.00 -2.04 0.00 0.00 64.05 61.87 2eea n THR 83 Cb 0.55 -0.89 -0.11 0.00 -1.82 0.00 0.00 70.33 68.06 2eea n THR 83 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 2eea s LEU 84 N -4.33 1.22 -0.23 -4.42 1.43 -1.26 -4.61 118.68 106.47 2eea s LEU 84 Ca -0.02 0.19 -0.29 0.00 -1.03 0.00 0.00 54.13 52.99 2eea s LEU 84 Cb 0.01 0.82 -0.02 0.00 0.03 0.00 0.00 46.19 47.03 2eea s LEU 84 CO 0.08 -0.23 1.62 -2.16 0.23 0.00 0.00 176.35 175.90 2eea s PRO 85 N -0.57 3.76 -0.03 1.29 0.04 -1.26 -4.85 135.00 133.38 2eea s PRO 85 Ca -0.07 1.62 -0.31 0.00 0.04 0.00 0.00 61.00 62.29 2eea s PRO 85 Cb -0.04 -4.05 0.12 0.00 0.04 0.00 0.00 34.50 30.58 2eea s PRO 85 CO 0.01 -1.34 1.28 0.20 0.04 0.00 0.00 177.00 177.20 2eea s GLY 86 N 4.34 -0.41 -0.39 0.56 0.00 -1.12 -4.89 107.32 105.42 2eea s GLY 86 Ca 0.72 0.76 -0.28 0.00 0.00 0.00 0.00 44.72 45.91 2eea s GLY 86 CO 0.30 0.15 1.61 0.99 0.00 0.00 0.00 173.10 176.14 2eea s ASP 87 N -2.93 6.08 -0.21 1.64 1.01 -1.26 -3.85 116.67 117.15 2eea s ASP 87 Ca 0.14 0.99 -0.15 0.00 0.71 0.00 0.00 52.55 54.24 2eea s ASP 87 Cb 0.04 -2.53 -0.04 0.00 1.01 0.00 0.00 42.92 41.40 2eea s ASP 87 CO -0.04 -1.62 0.35 -0.31 0.21 0.00 0.00 175.17 173.76 2eea s TYR 88 N 6.29 3.36 -0.77 4.23 2.02 -1.22 -4.63 117.35 126.61 2eea s TYR 88 Ca 0.69 0.53 -0.20 0.00 -0.37 0.00 0.00 57.07 57.72 2eea s TYR 88 Cb -0.17 -2.47 0.11 0.00 -0.40 0.00 0.00 41.96 39.02 2eea s TYR 88 CO 0.32 -0.00 0.99 -1.12 -1.57 0.00 0.00 175.55 174.17 2eea s SER 89 N 1.07 6.39 -0.00 2.29 0.01 0.82 -3.40 113.70 120.88 2eea s SER 89 Ca 0.16 -1.56 -0.30 0.00 1.31 0.00 0.00 55.95 55.56 2eea s SER 89 Cb -0.14 -2.39 -0.03 0.00 0.21 0.00 0.00 66.02 63.67 2eea s SER 89 CO 0.07 -1.21 1.01 -0.63 0.41 0.00 0.00 173.24 172.90 2eea s ILE 90 N 3.16 4.75 -0.21 1.44 1.01 -1.10 -1.76 121.20 128.49 2eea s ILE 90 Ca 0.25 1.97 0.02 0.00 0.00 0.00 0.00 60.65 62.89 2eea s ILE 90 Cb -0.13 -4.27 0.04 0.00 0.01 0.00 0.00 42.46 38.12 2eea s ILE 90 CO 0.00 0.14 -0.14 -0.76 0.00 0.00 0.00 174.94 174.19 2eea s LEU 91 N 1.10 2.56 -0.08 2.97 1.43 0.75 -2.18 118.68 125.23 2eea s LEU 91 Ca 0.53 -0.95 0.02 0.00 -1.03 0.00 0.00 54.13 52.69 2eea s LEU 91 Cb -0.22 -1.40 -0.02 0.00 0.03 0.00 0.00 46.19 44.58 2eea s LEU 91 CO 0.27 -0.11 -0.15 -0.69 0.23 0.00 0.00 176.35 175.90 2eea s VAL 92 N 1.28 2.95 -0.01 -1.59 1.01 -1.26 -0.71 120.40 122.07 2eea s VAL 92 Ca -0.01 -0.73 0.05 0.00 0.00 0.00 0.00 61.98 61.28 2eea s VAL 92 Cb -0.16 -2.18 -0.01 0.00 0.00 0.00 0.00 36.38 34.02 2eea s VAL 92 CO -0.09 0.56 -0.16 -0.54 0.00 0.00 0.00 175.10 174.87 2eea s LYS 93 N -0.21 1.30 -0.29 2.72 1.02 -0.52 -3.35 119.74 120.40 2eea s LYS 93 Ca 0.00 -0.58 -0.00 0.00 0.02 0.00 0.00 55.97 55.41 2eea s LYS 93 Cb -0.13 -1.26 0.09 0.00 -0.52 0.00 0.00 37.83 36.01 2eea s LYS 93 CO 0.03 0.34 0.06 -0.47 -0.92 0.00 0.00 175.35 174.40 2eea s TYR 94 N -0.39 1.98 -0.97 3.18 5.04 -0.28 -2.21 117.35 123.71 2eea s TYR 94 Ca 0.06 -1.79 -0.02 0.00 -2.44 0.00 0.00 57.07 52.88 2eea s TYR 94 Cb -0.06 -1.76 0.00 0.00 0.35 0.00 0.00 41.96 40.49 2eea s TYR 94 CO -0.01 -0.84 0.82 -1.71 -1.34 0.00 0.00 175.55 172.47 2eea n ASN 95 N 4.77 -3.09 -2.51 4.32 5.15 -0.88 -2.64 115.26 120.39 2eea n ASN 95 Ca -0.03 -0.46 -0.19 0.00 -0.60 0.00 0.00 54.58 53.30 2eea n ASN 95 Cb 0.43 -4.06 0.02 0.00 -0.53 0.00 0.00 39.78 35.65 2eea n ASN 95 CO 0.00 0.00 0.00 0.47 1.40 0.00 0.00 177.26 179.13 2eea n ASP 96 N -2.44 -5.45 -3.46 1.20 8.00 -1.26 -4.99 116.55 108.15 2eea n ASP 96 Ca -0.15 -0.20 -0.12 0.00 0.71 0.00 0.00 54.79 55.02 2eea n ASP 96 Cb 0.60 -4.33 -0.10 0.00 -0.02 0.00 0.00 41.12 37.27 2eea n ASP 96 CO 0.00 0.00 0.00 -0.54 -0.39 0.00 0.00 177.20 176.27 2eea s LYS 97 N -5.41 0.27 0.79 -1.24 1.02 -1.08 -5.15 119.74 108.94 2eea s LYS 97 Ca 0.21 0.50 -0.14 0.00 0.02 0.00 0.00 55.97 56.56 2eea s LYS 97 Cb -0.09 -0.59 0.07 0.00 -0.52 0.00 0.00 37.83 36.70 2eea s LYS 97 CO 0.26 -0.57 1.21 0.72 -0.92 0.00 0.00 175.35 176.05 2eea n HIS 98 N 5.35 1.34 -3.03 3.18 8.25 -1.26 -1.12 115.22 127.93 2eea n HIS 98 Ca -0.05 0.41 -0.31 0.00 -0.26 0.00 0.00 57.72 57.51 2eea n HIS 98 Cb 0.50 -2.12 -0.04 0.00 1.12 0.00 0.00 29.99 29.45 2eea n HIS 98 CO 0.00 0.00 0.00 0.96 0.64 0.00 0.00 176.34 177.94 2eea s ILE 99 N -2.05 4.81 -0.53 1.59 -4.36 -1.21 -4.84 121.20 114.61 2eea s ILE 99 Ca 0.74 0.60 -0.27 0.00 -0.26 0.00 0.00 60.65 61.46 2eea s ILE 99 Cb -0.30 -3.70 -0.02 0.00 1.25 0.00 0.00 42.46 39.70 2eea s ILE 99 CO 0.50 -0.39 1.81 -2.16 0.24 0.00 0.00 174.94 174.94 2eea s PRO 100 N -3.54 2.88 0.00 0.37 0.04 -1.26 -2.73 135.00 130.76 2eea s PRO 100 Ca 0.51 0.84 0.00 0.00 0.04 0.00 0.00 61.00 62.38 2eea s PRO 100 Cb -0.10 -4.31 0.00 0.00 0.04 0.00 0.00 34.50 30.13 2eea s PRO 100 CO 0.27 -2.42 0.00 0.41 0.04 0.00 0.00 177.00 175.31 2eea n GLY 101 N 5.58 1.27 3.90 0.56 0.00 -1.26 -5.02 105.19 110.21 2eea n GLY 101 Ca 0.21 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.95 2eea n GLY 101 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2eea s SER 102 N -0.27 6.11 0.26 1.61 0.01 -1.11 -4.11 113.70 116.20 2eea s SER 102 Ca 0.00 1.00 -0.29 0.00 1.31 0.00 0.00 55.95 57.96 2eea s SER 102 Cb 0.00 -2.19 -0.09 0.00 0.21 0.00 0.00 66.02 63.95 2eea s SER 102 CO 0.00 -0.75 1.26 -2.16 0.41 0.00 0.00 173.24 172.00 2eea s PRO 103 N -4.89 4.43 0.50 12.44 0.04 -1.26 -4.94 135.00 141.31 2eea s PRO 103 Ca 0.50 2.05 -0.18 0.00 0.04 0.00 0.00 61.00 63.41 2eea s PRO 103 Cb -0.10 -3.15 -0.08 0.00 0.04 0.00 0.00 34.50 31.20 2eea s PRO 103 CO 0.47 -0.13 0.99 -0.06 0.04 0.00 0.00 177.00 178.31 2eea s PHE 104 N -0.58 3.28 -0.35 0.56 0.08 -0.93 -4.88 117.98 115.16 2eea s PHE 104 Ca 0.51 1.53 0.01 0.00 0.12 0.00 0.00 56.93 59.10 2eea s PHE 104 Cb -0.37 -2.88 0.09 0.00 -0.57 0.00 0.00 43.02 39.30 2eea s PHE 104 CO 0.44 -0.46 0.09 0.99 -0.10 0.00 0.00 175.22 176.17 2eea s THR 105 N -2.37 2.72 -0.10 0.64 2.01 -1.26 -2.70 115.64 114.58 2eea s THR 105 Ca 0.62 -2.07 -0.17 0.00 0.31 0.00 0.00 61.69 60.38 2eea s THR 105 Cb -0.11 -2.86 -0.05 0.00 0.01 0.00 0.00 72.50 69.49 2eea s THR 105 CO 0.25 -0.53 0.45 0.00 -0.69 0.00 0.00 174.62 174.10 2eea s ALA 106 N 1.05 3.52 -0.87 7.40 0.00 -1.22 -4.84 121.76 126.80 2eea s ALA 106 Ca 0.06 -0.21 -0.18 0.00 0.00 0.00 0.00 51.96 51.63 2eea s ALA 106 Cb -0.21 -2.59 0.14 0.00 0.00 0.00 0.00 23.12 20.47 2eea s ALA 106 CO -0.06 0.09 1.01 0.21 0.00 0.00 0.00 175.76 177.02 2eea s LYS 107 N 0.32 3.54 -0.04 0.00 2.20 -0.10 -3.44 119.74 122.22 2eea s LYS 107 Ca 0.25 -1.83 -0.12 0.00 -0.36 0.00 0.00 55.97 53.91 2eea s LYS 107 Cb -0.15 -4.73 -0.05 0.00 -1.51 0.00 0.00 37.83 31.38 2eea s LYS 107 CO 0.10 -1.66 0.32 0.42 -0.36 0.00 0.00 175.35 174.17 2eea s ILE 108 N 2.23 5.19 0.37 5.43 1.01 -1.25 -3.28 121.20 130.89 2eea s ILE 108 Ca 0.28 0.62 0.05 0.00 0.00 0.00 0.00 60.65 61.60 2eea s ILE 108 Cb -0.08 -3.61 -0.03 0.00 0.01 0.00 0.00 42.46 38.76 2eea s ILE 108 CO -0.07 0.59 0.19 0.28 0.00 0.00 0.00 174.94 175.93 2eea s THR 109 N -1.06 0.33 -0.12 2.92 -1.32 -1.09 -2.79 115.64 112.50 2eea s THR 109 Ca 0.21 -2.00 0.01 0.00 -1.21 0.00 0.00 61.69 58.70 2eea s THR 109 Cb -0.15 -2.41 0.02 0.00 -1.51 0.00 0.00 72.50 68.45 2eea s THR 109 CO 0.10 0.00 -0.14 -0.62 -2.21 0.00 0.00 174.62 171.76 2eea s ASP 110 N -3.49 2.46 -0.11 8.08 2.15 -1.26 -0.33 116.67 124.17 2eea s ASP 110 Ca 0.31 -0.42 -0.07 0.00 0.43 0.00 0.00 52.55 52.80 2eea s ASP 110 Cb 0.03 -1.07 -0.27 0.00 -0.30 0.00 0.00 42.92 41.31 2eea s ASP 110 CO 0.20 -0.03 0.40 -0.78 -0.17 0.00 0.00 175.17 174.79 2eea h ASP 111 N 7.75 0.43 -0.64 -0.34 1.82 -1.90 -3.32 116.42 120.22 2eea h ASP 111 Ca -0.34 -0.95 0.11 0.00 -0.39 0.00 0.00 57.03 55.47 2eea h ASP 111 Cb 1.15 -0.14 -0.12 0.00 0.68 0.00 0.00 39.33 40.90 2eea h ASP 111 CO 0.49 1.85 -0.35 -1.28 -1.61 0.00 0.00 179.24 178.34 2eea h SER 112 N 0.08 -1.21 -0.70 2.28 0.87 -1.95 0.22 113.55 113.14 2eea h SER 112 Ca -0.41 0.24 -0.02 0.00 -1.23 0.00 0.00 61.79 60.36 2eea h SER 112 Cb 2.04 0.60 -0.03 0.00 -0.44 0.00 0.00 62.40 64.57 2eea h SER 112 CO 0.10 -0.30 0.36 -0.09 -0.53 0.00 0.00 176.83 176.36 2eea h ARG 113 N -0.15 1.01 -7.17 2.24 9.65 -2.01 -3.42 114.38 114.54 2eea h ARG 113 Ca 0.24 -0.13 -0.48 0.00 -1.10 0.00 0.00 59.98 58.51 2eea h ARG 113 Cb 0.56 -0.19 0.04 0.00 -1.39 0.00 0.00 29.97 28.98 2eea h ARG 113 CO -0.72 0.77 0.38 1.03 2.80 0.00 0.00 179.97 184.23 2eea s ARG 114 N -5.60 3.66 0.00 0.20 0.52 0.76 -5.19 118.95 113.30 2eea s ARG 114 Ca -0.11 1.14 0.00 0.00 -0.52 0.00 0.00 55.73 56.24 2eea s ARG 114 Cb 0.17 -2.08 0.00 0.00 0.52 0.00 0.00 34.95 33.55 2eea s ARG 114 CO 0.80 -0.53 0.46 0.00 0.02 0.00 0.00 175.30 176.06