#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2eh0 n SER 2 N 0.00 2.79 -1.34 1.61 2.88 -1.26 -4.75 113.62 113.55 2eh0 n SER 2 Ca 0.00 -3.37 0.05 0.00 -1.33 0.00 0.00 58.87 54.22 2eh0 n SER 2 Cb 0.00 -0.42 0.26 0.00 -0.75 0.00 0.00 64.21 63.30 2eh0 n SER 2 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2eh0 n SER 3 N -0.70 3.90 0.00 -3.46 3.41 -1.26 -4.79 113.62 110.73 2eh0 n SER 3 Ca 0.25 -2.51 0.00 0.00 -0.26 0.00 0.00 58.87 56.35 2eh0 n SER 3 Cb 0.87 -0.57 0.00 0.00 -0.26 0.00 0.00 64.21 64.24 2eh0 n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2eh0 n GLY 4 N 0.58 0.18 2.95 5.00 0.00 -1.26 -5.16 105.19 107.48 2eh0 n GLY 4 Ca 0.18 0.71 -0.14 0.00 0.00 0.00 0.00 46.02 46.77 2eh0 n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2eh0 s SER 5 N 0.00 0.54 0.03 1.61 0.01 -1.26 -5.05 113.70 109.58 2eh0 s SER 5 Ca 0.00 0.42 -0.33 0.00 1.31 0.00 0.00 55.95 57.35 2eh0 s SER 5 Cb 0.00 0.65 -0.12 0.00 0.21 0.00 0.00 66.02 66.77 2eh0 s SER 5 CO 0.00 -0.26 1.79 -1.20 0.41 0.00 0.00 173.24 173.99 2eh0 n SER 6 N 5.35 3.52 -4.55 2.44 7.64 -1.26 -4.81 113.62 121.94 2eh0 n SER 6 Ca -0.06 1.00 -0.61 0.00 1.01 0.00 0.00 58.87 60.22 2eh0 n SER 6 Cb 0.50 -1.43 -0.08 0.00 -1.01 0.00 0.00 64.21 62.18 2eh0 n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2eh0 n GLY 7 N 4.10 -0.17 2.87 0.23 0.00 -1.26 -4.96 105.19 106.01 2eh0 n GLY 7 Ca 0.20 0.81 -0.12 0.00 0.00 0.00 0.00 46.02 46.91 2eh0 n GLY 7 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2eh0 s THR 8 N 0.62 -0.00 -0.14 2.61 2.01 -1.26 -4.84 115.64 114.63 2eh0 s THR 8 Ca 0.94 0.02 -0.29 0.00 0.31 0.00 0.00 61.69 62.66 2eh0 s THR 8 Cb -1.31 -0.03 -0.04 0.00 0.01 0.00 0.00 72.50 71.14 2eh0 s THR 8 CO 0.62 0.01 1.56 -2.16 -0.69 0.00 0.00 174.62 173.95 2eh0 s PRO 9 N 0.09 4.05 0.04 4.92 0.04 -1.26 -4.83 135.00 138.06 2eh0 s PRO 9 Ca -0.01 1.88 0.00 0.00 0.04 0.00 0.00 61.00 62.92 2eh0 s PRO 9 Cb -0.01 -3.96 -0.03 0.00 0.04 0.00 0.00 34.50 30.54 2eh0 s PRO 9 CO -0.00 -0.98 -0.04 -3.38 0.04 0.00 0.00 177.00 172.64 2eh0 s HIS 10 N 4.34 0.44 -0.17 0.56 -3.43 -1.25 -1.58 115.29 114.21 2eh0 s HIS 10 Ca 0.69 -0.73 -0.11 0.00 -0.80 0.00 0.00 55.06 54.11 2eh0 s HIS 10 Cb -0.28 -0.31 -0.05 0.00 -1.43 0.00 0.00 32.58 30.52 2eh0 s HIS 10 CO 0.26 -0.23 0.19 -0.51 -2.00 0.00 0.00 174.74 172.45 2eh0 s LEU 11 N -2.06 4.26 -0.07 5.38 1.43 0.83 -2.72 118.68 125.73 2eh0 s LEU 11 Ca -0.06 0.38 0.01 0.00 -1.03 0.00 0.00 54.13 53.44 2eh0 s LEU 11 Cb -0.03 -2.18 -0.03 0.00 0.03 0.00 0.00 46.19 43.98 2eh0 s LEU 11 CO -0.04 0.21 -0.10 -0.69 0.23 0.00 0.00 176.35 175.96 2eh0 s VAL 12 N 0.07 3.42 -1.35 -1.59 1.01 -0.89 -0.43 120.40 120.64 2eh0 s VAL 12 Ca 0.12 -0.58 -0.16 0.00 0.00 0.00 0.00 61.98 61.37 2eh0 s VAL 12 Cb -0.12 -2.39 0.07 0.00 0.00 0.00 0.00 36.38 33.94 2eh0 s VAL 12 CO 0.01 0.58 1.91 0.59 0.00 0.00 0.00 175.10 178.19 2eh0 n ASN 13 N 2.47 4.57 0.00 3.32 4.13 0.19 -1.07 115.26 128.88 2eh0 n ASN 13 Ca -0.18 -2.90 0.14 0.00 1.68 0.00 0.00 54.58 53.32 2eh0 n ASN 13 Cb 0.53 -1.69 0.79 0.00 -1.54 0.00 0.00 39.78 37.87 2eh0 n ASN 13 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2eh0 n LEU 14 N 7.10 0.00 0.00 3.41 -0.00 -1.26 -4.84 117.00 121.41 2eh0 n LEU 14 Ca 0.49 0.07 -0.16 0.00 -0.00 0.00 0.00 56.01 56.40 2eh0 n LEU 14 Cb 0.43 -0.07 0.15 0.00 -0.00 0.00 0.00 43.42 43.93 2eh0 n LEU 14 CO 0.81 -0.01 0.22 -0.46 -0.00 0.00 0.00 177.39 177.96 2eh0 n ASN 15 N -1.07 -2.79 -0.00 1.45 6.94 -1.26 -5.00 115.26 113.53 2eh0 n ASN 15 Ca 0.19 -0.57 0.01 0.00 -0.02 0.00 0.00 54.58 54.19 2eh0 n ASN 15 Cb 0.13 -0.54 -0.01 0.00 -2.36 0.00 0.00 39.78 36.99 2eh0 n ASN 15 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 2eh0 n GLU 16 N -3.89 2.70 -0.95 -3.83 4.71 -1.26 -5.01 120.64 113.11 2eh0 n GLU 16 Ca 0.08 -0.01 -0.21 0.00 -0.01 0.00 0.00 57.16 57.00 2eh0 n GLU 16 Cb 0.32 -0.86 -0.12 0.00 -1.01 0.00 0.00 31.44 29.78 2eh0 n GLU 16 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 2eh0 n ASP 17 N -1.35 -0.26 0.00 1.62 8.00 -1.26 -4.66 116.55 118.63 2eh0 n ASP 17 Ca -0.00 -0.07 0.08 0.00 0.71 0.00 0.00 54.79 55.50 2eh0 n ASP 17 Cb 0.04 -0.48 0.42 0.00 -0.02 0.00 0.00 41.12 41.08 2eh0 n ASP 17 CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 2eh0 n PRO 18 N 4.63 0.36 -0.03 -0.24 -0.04 -1.26 -2.18 135.00 136.24 2eh0 n PRO 18 Ca 0.42 0.07 0.03 0.00 -0.04 0.00 0.00 63.50 63.98 2eh0 n PRO 18 Cb 0.05 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 31.88 2eh0 n PRO 18 CO 0.00 0.00 0.00 1.28 -0.04 0.00 0.00 175.50 176.74 2eh0 n LEU 19 N -1.13 0.00 -3.81 1.53 4.77 -1.26 -5.00 117.00 112.10 2eh0 n LEU 19 Ca 0.09 0.00 -0.55 0.00 -0.03 0.00 0.00 56.01 55.53 2eh0 n LEU 19 Cb 0.08 0.12 -0.08 0.00 -2.33 0.00 0.00 43.42 41.21 2eh0 n LEU 19 CO 0.10 0.12 0.92 1.15 -1.33 0.00 0.00 177.39 178.34 2eh0 n MET 20 N -2.22 0.00 -0.14 3.23 0.00 -0.93 -4.81 117.12 112.26 2eh0 n MET 20 Ca -0.10 0.00 0.07 0.00 0.00 0.00 0.00 57.70 57.67 2eh0 n MET 20 Cb 0.60 -1.20 0.14 0.00 0.00 0.00 0.00 33.22 32.76 2eh0 n MET 20 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 175.97 174.84 2eh0 n SER 21 N 3.19 2.76 -4.92 3.17 3.41 -1.26 -5.00 113.62 114.98 2eh0 n SER 21 Ca 0.25 -1.85 -0.27 0.00 -0.26 0.00 0.00 58.87 56.73 2eh0 n SER 21 Cb -0.05 -0.18 -0.03 0.00 -0.26 0.00 0.00 64.21 63.69 2eh0 n SER 21 CO 0.00 0.00 0.00 -1.83 -0.16 0.00 0.00 175.04 173.05 2eh0 s GLU 22 N -1.03 3.57 0.99 4.33 -1.05 -1.26 -5.05 118.70 119.21 2eh0 s GLU 22 Ca 0.23 -0.15 -0.17 0.00 -0.15 0.00 0.00 54.97 54.74 2eh0 s GLU 22 Cb 0.13 -2.70 -0.15 0.00 -0.44 0.00 0.00 34.13 30.98 2eh0 s GLU 22 CO 0.18 0.25 -0.80 0.00 0.95 0.00 0.00 175.26 175.83 2eh0 h LEU 24 N -0.99 0.55 -7.99 0.00 -0.00 -1.96 -3.46 115.31 101.46 2eh0 h LEU 24 Ca -0.44 -0.47 -0.10 0.00 -0.00 0.00 0.00 57.88 56.87 2eh0 h LEU 24 Cb 1.29 -0.17 -0.13 0.00 -0.00 0.00 0.00 40.66 41.64 2eh0 h LEU 24 CO 0.23 1.29 -0.39 -1.48 -0.00 0.00 0.00 178.44 178.09 2eh0 s LEU 25 N -7.63 1.32 -0.02 1.67 0.05 -1.26 0.58 118.68 113.39 2eh0 s LEU 25 Ca -0.06 -0.80 0.01 0.00 0.05 0.00 0.00 54.13 53.33 2eh0 s LEU 25 Cb 0.08 1.00 0.01 0.00 -2.05 0.00 0.00 46.19 45.23 2eh0 s LEU 25 CO 0.88 -0.79 -0.04 -0.31 -0.55 0.00 0.00 176.35 175.54 2eh0 s TYR 26 N -3.92 0.48 -0.07 3.48 2.02 0.43 -4.95 117.35 114.81 2eh0 s TYR 26 Ca 0.11 -0.09 -0.16 0.00 -0.37 0.00 0.00 57.07 56.56 2eh0 s TYR 26 Cb 0.05 -0.39 -0.05 0.00 -0.40 0.00 0.00 41.96 41.16 2eh0 s TYR 26 CO -0.06 -0.07 0.43 0.71 -1.57 0.00 0.00 175.55 174.99 2eh0 s TYR 27 N 0.37 3.60 -0.19 2.71 2.02 -1.26 -0.12 117.35 124.48 2eh0 s TYR 27 Ca -0.04 0.91 -0.10 0.00 -0.37 0.00 0.00 57.07 57.47 2eh0 s TYR 27 Cb -0.07 -2.43 -0.05 0.00 -0.40 0.00 0.00 41.96 39.01 2eh0 s TYR 27 CO -0.00 0.36 0.15 0.42 -1.57 0.00 0.00 175.55 174.91 2eh0 s ILE 28 N -0.08 5.40 0.77 2.71 1.01 -0.61 -4.99 121.20 125.41 2eh0 s ILE 28 Ca 0.24 0.24 -0.09 0.00 0.00 0.00 0.00 60.65 61.04 2eh0 s ILE 28 Cb -0.16 -3.49 0.10 0.00 0.01 0.00 0.00 42.46 38.92 2eh0 s ILE 28 CO 0.11 0.45 1.10 -1.59 0.00 0.00 0.00 174.94 175.01 2eh0 s LYS 29 N 0.25 1.83 -0.75 2.79 0.00 -1.26 -4.63 119.74 117.97 2eh0 s LYS 29 Ca 0.10 -0.28 -0.26 0.00 0.00 0.00 0.00 55.97 55.53 2eh0 s LYS 29 Cb -0.11 -2.08 0.04 0.00 0.00 0.00 0.00 37.83 35.68 2eh0 s LYS 29 CO -0.01 -1.54 1.22 -0.51 0.00 0.00 0.00 175.35 174.52 2eh0 s ASP 30 N -4.62 6.20 0.00 0.03 1.11 -1.26 -4.44 116.67 113.69 2eh0 s ASP 30 Ca 0.63 -0.67 0.00 0.00 0.18 0.00 0.00 52.55 52.70 2eh0 s ASP 30 Cb -0.09 -2.53 0.00 0.00 1.07 0.00 0.00 42.92 41.37 2eh0 s ASP 30 CO 0.47 -1.72 0.00 0.61 1.18 0.00 0.00 175.17 175.71 2eh0 n GLY 31 N 5.48 -0.55 2.96 0.21 0.00 0.10 -4.94 105.19 108.46 2eh0 n GLY 31 Ca 0.04 0.07 -0.27 0.00 0.00 0.00 0.00 46.02 45.86 2eh0 n GLY 31 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2eh0 s ILE 32 N 0.00 1.17 -0.38 -0.61 -1.09 -1.26 -0.18 121.20 118.85 2eh0 s ILE 32 Ca 0.00 -0.41 -0.04 0.00 -2.23 0.00 0.00 60.65 57.96 2eh0 s ILE 32 Cb 0.00 -1.14 0.08 0.00 -1.58 0.00 0.00 42.46 39.83 2eh0 s ILE 32 CO 0.00 0.38 0.16 -0.89 -1.23 0.00 0.00 174.94 173.36 2eh0 s THR 33 N 1.37 3.47 -0.54 2.92 2.01 0.68 -4.94 115.64 120.62 2eh0 s THR 33 Ca -0.01 -1.66 -0.28 0.00 0.31 0.00 0.00 61.69 60.05 2eh0 s THR 33 Cb -0.14 -3.19 0.03 0.00 0.01 0.00 0.00 72.50 69.22 2eh0 s THR 33 CO -0.05 -0.46 1.15 -0.13 -0.69 0.00 0.00 174.62 174.44 2eh0 s ARG 34 N 1.26 3.58 -0.24 4.92 0.52 -1.26 -1.02 118.95 126.71 2eh0 s ARG 34 Ca 0.03 0.34 -0.20 0.00 -0.52 0.00 0.00 55.73 55.38 2eh0 s ARG 34 Cb -0.22 -3.97 -0.02 0.00 0.52 0.00 0.00 34.95 31.26 2eh0 s ARG 34 CO -0.01 -1.54 0.61 0.08 0.02 0.00 0.00 175.30 174.46 2eh0 s VAL 35 N 4.67 5.01 0.00 3.52 1.01 0.92 -3.03 120.40 132.50 2eh0 s VAL 35 Ca 0.44 1.11 0.00 0.00 0.00 0.00 0.00 61.98 63.53 2eh0 s VAL 35 Cb -0.08 -3.92 0.00 0.00 0.00 0.00 0.00 36.38 32.38 2eh0 s VAL 35 CO 0.28 0.07 0.00 0.61 0.00 0.00 0.00 175.10 176.05 2eh0 n GLY 36 N 4.06 1.54 3.82 4.51 0.00 -1.02 -1.61 105.19 116.49 2eh0 n GLY 36 Ca -0.01 0.21 -0.23 0.00 0.00 0.00 0.00 46.02 45.99 2eh0 n GLY 36 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2eh0 s GLN 37 N 4.01 2.38 0.17 1.61 -0.21 -1.22 -2.45 119.66 123.94 2eh0 s GLN 37 Ca 0.00 -1.71 0.17 0.00 0.02 0.00 0.00 55.36 53.84 2eh0 s GLN 37 Cb 0.00 -2.18 -0.03 0.00 1.00 0.00 0.00 33.01 31.80 2eh0 s GLN 37 CO 0.00 -0.19 1.10 0.00 -2.12 0.00 0.00 175.29 174.07 2eh0 h ALA 38 N 1.18 0.65 -0.47 6.09 0.00 -1.91 -3.33 119.26 121.47 2eh0 h ALA 38 Ca -0.42 -0.55 0.01 0.00 0.00 0.00 0.00 54.91 53.95 2eh0 h ALA 38 Cb 1.26 0.11 -0.02 0.00 0.00 0.00 0.00 17.79 19.14 2eh0 h ALA 38 CO 0.63 0.64 0.31 0.22 0.00 0.00 0.00 179.25 181.05 2eh0 h ASP 39 N 0.00 0.53 -0.99 0.00 1.82 -1.96 -3.43 116.42 112.40 2eh0 h ASP 39 Ca -0.08 -0.01 -0.48 0.00 -0.39 0.00 0.00 57.03 56.07 2eh0 h ASP 39 Cb 1.40 -0.13 0.10 0.00 0.68 0.00 0.00 39.33 41.38 2eh0 h ASP 39 CO 0.04 0.39 -0.54 0.00 -1.61 0.00 0.00 179.24 177.51 2eh0 n ALA 40 N -2.47 -2.48 -0.32 -0.78 0.00 -1.25 -4.74 120.51 108.48 2eh0 n ALA 40 Ca 0.04 0.20 0.17 0.00 0.00 0.00 0.00 53.44 53.85 2eh0 n ALA 40 Cb 0.06 -1.14 0.36 0.00 0.00 0.00 0.00 19.45 18.74 2eh0 n ALA 40 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 2eh0 h GLU 41 N 0.49 0.39 -4.89 0.00 4.11 -1.94 -3.34 114.58 109.40 2eh0 h GLU 41 Ca -0.24 -0.02 -0.67 0.00 0.07 0.00 0.00 59.36 58.50 2eh0 h GLU 41 Cb 1.06 -0.09 -0.30 0.00 0.50 0.00 0.00 28.75 29.92 2eh0 h GLU 41 CO 0.38 0.26 -0.71 1.03 0.07 0.00 0.00 179.01 180.04 2eh0 s ARG 42 N -5.81 2.93 -0.10 1.06 1.81 -1.26 -5.06 118.95 112.52 2eh0 s ARG 42 Ca -0.11 -0.93 -0.31 0.00 -1.72 0.00 0.00 55.73 52.66 2eh0 s ARG 42 Cb 0.27 -3.08 -0.15 0.00 -0.45 0.00 0.00 34.95 31.54 2eh0 s ARG 42 CO 0.78 -0.40 0.91 -2.13 -0.68 0.00 0.00 175.30 173.78 2eh0 n ARG 43 N 4.73 0.00 -3.33 3.54 3.00 -1.26 -4.88 116.66 118.47 2eh0 n ARG 43 Ca -0.16 0.00 -0.38 0.00 -0.00 0.00 0.00 57.85 57.31 2eh0 n ARG 43 Cb 0.47 -1.12 -0.06 0.00 0.00 0.00 0.00 32.46 31.76 2eh0 n ARG 43 CO 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 177.63 176.98 2eh0 s GLN 44 N 0.61 4.18 0.00 -0.14 -1.52 -1.26 -5.01 119.66 116.52 2eh0 s GLN 44 Ca 0.71 0.59 0.00 0.00 -1.95 0.00 0.00 55.36 54.71 2eh0 s GLN 44 Cb -1.00 -3.30 0.00 0.00 -0.22 0.00 0.00 33.01 28.50 2eh0 s GLN 44 CO 0.48 0.49 0.95 -3.47 -0.25 0.00 0.00 175.29 173.49 2eh0 n ASP 45 N 2.38 0.00 -4.55 5.90 -0.08 -1.17 -4.22 116.55 114.81 2eh0 n ASP 45 Ca -0.10 0.95 -0.38 0.00 -1.51 0.00 0.00 54.79 53.75 2eh0 n ASP 45 Cb 0.51 -0.45 -0.11 0.00 2.34 0.00 0.00 41.12 43.41 2eh0 n ASP 45 CO 0.00 0.00 0.00 -0.63 0.12 0.00 0.00 177.20 176.69 2eh0 s ILE 46 N -2.79 5.15 -0.31 5.18 1.01 -1.26 -5.06 121.20 123.11 2eh0 s ILE 46 Ca 0.00 0.01 -0.09 0.00 0.00 0.00 0.00 60.65 60.57 2eh0 s ILE 46 Cb 0.00 -3.50 0.00 0.00 0.01 0.00 0.00 42.46 38.97 2eh0 s ILE 46 CO 0.00 0.19 0.13 -0.69 0.00 0.00 0.00 174.94 174.57 2eh0 s VAL 47 N 1.73 4.37 0.63 2.92 1.01 -1.26 -2.44 120.40 127.35 2eh0 s VAL 47 Ca 0.07 -0.54 -0.07 0.00 0.00 0.00 0.00 61.98 61.43 2eh0 s VAL 47 Cb -0.16 -3.24 0.02 0.00 0.00 0.00 0.00 36.38 32.99 2eh0 s VAL 47 CO 0.10 0.06 0.95 -0.76 0.00 0.00 0.00 175.10 175.45 2eh0 s LEU 48 N 1.57 3.12 -0.38 3.92 2.01 -1.03 -5.01 118.68 122.88 2eh0 s LEU 48 Ca 0.04 0.76 0.04 0.00 0.01 0.00 0.00 54.13 54.97 2eh0 s LEU 48 Cb -0.17 -3.56 0.11 0.00 0.01 0.00 0.00 46.19 42.58 2eh0 s LEU 48 CO 0.05 -1.18 0.10 -0.44 1.01 0.00 0.00 176.35 175.89 2eh0 s SER 49 N -4.34 4.72 0.06 2.29 0.01 -1.26 -4.88 113.70 110.30 2eh0 s SER 49 Ca 0.55 -2.32 -0.02 0.00 1.31 0.00 0.00 55.95 55.47 2eh0 s SER 49 Cb -0.11 -1.65 0.01 0.00 0.21 0.00 0.00 66.02 64.49 2eh0 s SER 49 CO 0.46 -0.36 0.13 0.61 0.41 0.00 0.00 173.24 174.49 2eh0 n GLY 50 N 4.05 1.75 0.05 3.44 0.00 -1.26 -5.02 105.19 108.20 2eh0 n GLY 50 Ca 0.04 -1.04 0.00 0.00 0.00 0.00 0.00 46.02 45.03 2eh0 n GLY 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2eh0 n ALA 51 N -2.63 2.19 -0.13 4.61 0.00 -1.26 -4.57 120.51 118.72 2eh0 n ALA 51 Ca -0.03 -0.83 0.00 0.00 0.00 0.00 0.00 53.44 52.58 2eh0 n ALA 51 Cb 0.09 -0.04 0.00 0.00 0.00 0.00 0.00 19.45 19.51 2eh0 n ALA 51 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 2eh0 n HIS 52 N -0.25 0.00 -2.26 0.00 8.25 -1.26 -5.06 115.22 114.65 2eh0 n HIS 52 Ca 0.01 -0.03 -0.34 0.00 -0.26 0.00 0.00 57.72 57.10 2eh0 n HIS 52 Cb 0.18 -0.00 -0.00 0.00 1.12 0.00 0.00 29.99 31.28 2eh0 n HIS 52 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2eh0 s ILE 53 N -0.06 3.47 0.04 1.59 -1.09 -1.26 -4.76 121.20 119.13 2eh0 s ILE 53 Ca 0.00 0.85 0.09 0.00 -2.23 0.00 0.00 60.65 59.36 2eh0 s ILE 53 Cb 0.00 -3.33 -0.03 0.00 -1.58 0.00 0.00 42.46 37.52 2eh0 s ILE 53 CO 0.00 -0.26 -0.26 -0.54 -1.23 0.00 0.00 174.94 172.66 2eh0 s LYS 54 N -3.48 1.87 0.34 2.79 -0.14 -1.26 -4.96 119.74 114.89 2eh0 s LYS 54 Ca 0.69 -1.08 0.13 0.00 -1.36 0.00 0.00 55.97 54.35 2eh0 s LYS 54 Cb -0.20 -2.01 1.08 0.00 -1.68 0.00 0.00 37.83 35.02 2eh0 s LYS 54 CO 0.28 0.52 1.53 -1.91 -0.76 0.00 0.00 175.35 175.01 2eh0 n GLU 55 N 1.84 -0.07 -2.21 1.68 2.13 -1.26 0.27 120.64 123.02 2eh0 n GLU 55 Ca -0.17 1.39 -0.25 0.00 0.66 0.00 0.00 57.16 58.79 2eh0 n GLU 55 Cb 0.52 -2.37 0.01 0.00 0.27 0.00 0.00 31.44 29.87 2eh0 n GLU 55 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 2eh0 n GLU 56 N -5.30 3.53 0.00 5.31 -0.58 -1.26 -3.40 120.64 118.94 2eh0 n GLU 56 Ca 0.31 -4.30 0.00 0.00 -0.42 0.00 0.00 57.16 52.75 2eh0 n GLU 56 Cb 1.05 -2.27 0.00 0.00 -0.57 0.00 0.00 31.44 29.65 2eh0 n GLU 56 CO 0.00 0.00 0.00 1.58 -0.48 0.00 0.00 177.13 178.23 2eh0 n HIS 57 N -0.61 0.00 -4.22 -0.32 -0.00 0.14 -4.60 115.22 105.60 2eh0 n HIS 57 Ca 0.42 0.00 -0.18 0.00 -0.00 0.00 0.00 57.72 57.96 2eh0 n HIS 57 Cb 0.84 -0.38 -0.06 0.00 -0.00 0.00 0.00 29.99 30.38 2eh0 n HIS 57 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2eh0 s ILE 59 N -3.21 0.16 -0.09 0.00 1.01 -0.96 -0.05 121.20 118.05 2eh0 s ILE 59 Ca 0.37 -1.42 -0.02 0.00 0.00 0.00 0.00 60.65 59.58 2eh0 s ILE 59 Cb 0.01 -1.46 0.03 0.00 0.01 0.00 0.00 42.46 41.06 2eh0 s ILE 59 CO 0.27 -0.73 0.02 -0.36 0.00 0.00 0.00 174.94 174.13 2eh0 s PHE 60 N -3.89 0.62 -0.47 3.97 0.40 -0.19 -0.46 117.98 117.95 2eh0 s PHE 60 Ca 0.07 -0.23 -0.16 0.00 -0.60 0.00 0.00 56.93 56.02 2eh0 s PHE 60 Cb 0.06 -0.79 0.07 0.00 0.51 0.00 0.00 43.02 42.87 2eh0 s PHE 60 CO -0.10 -0.36 0.40 0.50 0.70 0.00 0.00 175.22 176.36 2eh0 s ARG 61 N 1.99 2.98 -0.73 0.44 3.52 -0.50 -0.23 118.95 126.42 2eh0 s ARG 61 Ca 0.04 -1.33 -0.10 0.00 -0.13 0.00 0.00 55.73 54.21 2eh0 s ARG 61 Cb -0.13 -4.13 0.19 0.00 -1.56 0.00 0.00 34.95 29.32 2eh0 s ARG 61 CO -0.06 -1.02 0.63 0.45 -0.81 0.00 0.00 175.30 174.49 2eh0 s SER 62 N 2.58 6.17 0.06 -2.12 0.15 0.74 -2.04 113.70 119.24 2eh0 s SER 62 Ca 0.04 -2.69 0.07 0.00 0.70 0.00 0.00 55.95 54.08 2eh0 s SER 62 Cb -0.24 -2.08 -0.03 0.00 -1.71 0.00 0.00 66.02 61.96 2eh0 s SER 62 CO 0.07 -0.52 -0.19 -0.70 1.20 0.00 0.00 173.24 173.10 2eh0 s GLU 63 N 0.18 1.19 -0.63 5.44 2.56 -0.82 0.03 118.70 126.66 2eh0 s GLU 63 Ca 0.16 -0.96 -0.28 0.00 0.00 0.00 0.00 54.97 53.90 2eh0 s GLU 63 Cb -0.15 -1.31 0.03 0.00 2.00 0.00 0.00 34.13 34.70 2eh0 s GLU 63 CO -0.06 0.32 1.21 0.50 -0.56 0.00 0.00 175.26 176.67 2eh0 s ARG 64 N -1.40 3.41 1.00 4.30 3.52 -1.26 -1.06 118.95 127.46 2eh0 s ARG 64 Ca 0.05 0.08 -0.19 0.00 -0.13 0.00 0.00 55.73 55.55 2eh0 s ARG 64 Cb -0.09 -4.07 -0.13 0.00 -1.56 0.00 0.00 34.95 29.10 2eh0 s ARG 64 CO 0.02 -1.82 -0.79 0.45 -0.81 0.00 0.00 175.30 172.36 2eh0 n SER 65 N 8.69 -4.97 -0.13 -2.12 2.88 0.50 -4.56 113.62 113.91 2eh0 n SER 65 Ca 0.07 0.15 0.20 0.00 -1.33 0.00 0.00 58.87 57.96 2eh0 n SER 65 Cb 0.49 -0.77 0.61 0.00 -0.75 0.00 0.00 64.21 63.79 2eh0 n SER 65 CO 0.00 0.00 0.00 0.78 -1.23 0.00 0.00 175.04 174.59 2eh0 h ASN 66 N -1.09 0.19 0.74 -3.46 2.35 -1.94 0.43 115.58 112.79 2eh0 h ASN 66 Ca -0.43 0.01 -0.04 0.00 -0.55 0.00 0.00 56.30 55.29 2eh0 h ASN 66 Cb 1.32 -0.02 -0.01 0.00 0.05 0.00 0.00 38.32 39.66 2eh0 h ASN 66 CO 0.24 0.09 -0.20 0.77 -1.65 0.00 0.00 177.43 176.69 2eh0 h SER 67 N 0.19 0.00 0.00 5.81 4.64 -2.02 -3.46 113.55 118.71 2eh0 h SER 67 Ca 0.36 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.68 2eh0 h SER 67 Cb 1.14 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.23 2eh0 h SER 67 CO -0.07 0.20 0.00 0.61 -0.87 0.00 0.00 176.83 176.70 2eh0 n GLY 68 N -0.12 1.30 3.49 -0.77 0.00 0.15 -5.10 105.19 104.14 2eh0 n GLY 68 Ca -0.01 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.67 2eh0 n GLY 68 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 2eh0 s GLU 69 N -0.25 3.68 0.24 1.61 -1.05 -1.25 -4.81 118.70 116.87 2eh0 s GLU 69 Ca 0.00 -0.50 -0.31 0.00 -0.15 0.00 0.00 54.97 54.02 2eh0 s GLU 69 Cb 0.00 -3.05 -0.11 0.00 -0.44 0.00 0.00 34.13 30.53 2eh0 s GLU 69 CO 0.00 0.12 1.61 0.08 0.95 0.00 0.00 175.26 178.01 2eh0 s VAL 70 N 0.72 2.23 -0.04 1.83 1.01 -1.26 -0.37 120.40 124.53 2eh0 s VAL 70 Ca -0.00 0.18 0.02 0.00 0.00 0.00 0.00 61.98 62.19 2eh0 s VAL 70 Cb -0.14 -3.12 0.01 0.00 0.00 0.00 0.00 36.38 33.13 2eh0 s VAL 70 CO 0.02 0.02 -0.10 -0.63 0.00 0.00 0.00 175.10 174.42 2eh0 s ILE 71 N 0.57 0.88 -0.26 2.22 -1.09 -0.22 -4.87 121.20 118.42 2eh0 s ILE 71 Ca 0.67 -0.38 0.00 0.00 -2.23 0.00 0.00 60.65 58.71 2eh0 s ILE 71 Cb -0.47 -0.79 0.05 0.00 -1.58 0.00 0.00 42.46 39.66 2eh0 s ILE 71 CO 0.39 0.28 -0.07 -0.69 -1.23 0.00 0.00 174.94 173.62 2eh0 s VAL 72 N 0.36 2.58 -0.18 2.92 1.01 -1.25 -1.94 120.40 123.90 2eh0 s VAL 72 Ca -0.07 -1.38 -0.03 0.00 0.00 0.00 0.00 61.98 60.50 2eh0 s VAL 72 Cb -0.11 -2.43 -0.02 0.00 0.00 0.00 0.00 36.38 33.82 2eh0 s VAL 72 CO 0.01 0.03 -0.04 -0.89 0.00 0.00 0.00 175.10 174.21 2eh0 s THR 73 N 1.21 3.64 -0.33 3.92 2.01 -0.86 -2.31 115.64 122.91 2eh0 s THR 73 Ca -0.05 -0.43 -0.27 0.00 0.31 0.00 0.00 61.69 61.25 2eh0 s THR 73 Cb -0.19 -2.61 0.01 0.00 0.01 0.00 0.00 72.50 69.72 2eh0 s THR 73 CO -0.04 0.46 0.95 -0.22 -0.69 0.00 0.00 174.62 175.09 2eh0 s LEU 74 N 0.82 3.99 -0.94 4.42 2.96 0.23 -1.41 118.68 128.75 2eh0 s LEU 74 Ca -0.01 0.80 -0.04 0.00 -0.22 0.00 0.00 54.13 54.66 2eh0 s LEU 74 Cb -0.15 -3.33 0.23 0.00 0.50 0.00 0.00 46.19 43.44 2eh0 s LEU 74 CO 0.02 -0.81 0.86 -1.61 -1.32 0.00 0.00 176.35 173.48 2eh0 s GLU 75 N 3.42 3.50 0.75 1.98 0.41 0.39 -1.63 118.70 127.53 2eh0 s GLU 75 Ca 0.40 -3.23 -0.13 0.00 -0.41 0.00 0.00 54.97 51.61 2eh0 s GLU 75 Cb -0.13 -4.11 0.19 0.00 -1.78 0.00 0.00 34.13 28.30 2eh0 s GLU 75 CO 0.16 -1.26 0.67 -0.35 -0.49 0.00 0.00 175.26 173.99 2eh0 n PRO 76 N 2.49 -2.31 -4.69 0.39 -0.04 -1.26 -2.27 135.00 127.31 2eh0 n PRO 76 Ca 0.21 -1.07 -0.31 0.00 -0.04 0.00 0.00 63.50 62.30 2eh0 n PRO 76 Cb 0.38 -1.00 -0.08 0.00 -0.04 0.00 0.00 33.50 32.76 2eh0 n PRO 76 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2eh0 h GLU 78 N 1.46 0.33 -0.83 0.00 4.11 -1.91 -3.34 114.58 114.41 2eh0 h GLU 78 Ca -0.41 -0.56 -0.05 0.00 0.07 0.00 0.00 59.36 58.41 2eh0 h GLU 78 Cb 1.31 0.21 -0.03 0.00 0.50 0.00 0.00 28.75 30.74 2eh0 h GLU 78 CO 0.68 1.27 0.06 0.54 0.07 0.00 0.00 179.01 181.63 2eh0 n ARG 79 N -3.61 2.71 -3.84 1.06 5.12 -1.26 -4.89 116.66 111.95 2eh0 n ARG 79 Ca -0.27 -1.57 -0.25 0.00 -1.93 0.00 0.00 57.85 53.83 2eh0 n ARG 79 Cb 1.04 -1.83 -0.01 0.00 -1.16 0.00 0.00 32.46 30.50 2eh0 n ARG 79 CO 0.00 0.00 0.00 -1.54 -1.93 0.00 0.00 177.63 174.16 2eh0 s SER 80 N -0.34 4.68 -0.47 0.55 1.04 -1.25 -4.94 113.70 112.97 2eh0 s SER 80 Ca 0.28 -1.16 0.07 0.00 0.48 0.00 0.00 55.95 55.61 2eh0 s SER 80 Cb 0.21 0.23 0.39 0.00 0.10 0.00 0.00 66.02 66.95 2eh0 s SER 80 CO 0.07 -1.02 1.01 1.21 0.98 0.00 0.00 173.24 175.50 2eh0 n GLU 81 N -1.71 2.97 -3.47 4.02 2.13 -1.26 -4.94 120.64 118.37 2eh0 n GLU 81 Ca -0.00 -4.44 -0.33 0.00 0.66 0.00 0.00 57.16 53.05 2eh0 n GLU 81 Cb 0.64 -2.11 -0.05 0.00 0.27 0.00 0.00 31.44 30.19 2eh0 n GLU 81 CO 0.00 0.00 0.00 0.99 -0.41 0.00 0.00 177.13 177.71 2eh0 s THR 82 N -4.70 4.98 -0.15 6.31 2.01 -1.26 -3.21 115.64 119.62 2eh0 s THR 82 Ca 0.46 0.46 -0.12 0.00 0.31 0.00 0.00 61.69 62.81 2eh0 s THR 82 Cb 0.36 -3.64 0.04 0.00 0.01 0.00 0.00 72.50 69.27 2eh0 s THR 82 CO -0.14 0.06 0.38 -0.31 -0.69 0.00 0.00 174.62 173.92 2eh0 s TYR 83 N -1.67 -0.47 0.05 4.92 1.51 -0.85 -2.67 117.35 118.17 2eh0 s TYR 83 Ca 0.42 1.09 0.04 0.00 -1.01 0.00 0.00 57.07 57.62 2eh0 s TYR 83 Cb -0.12 0.17 -0.02 0.00 -0.11 0.00 0.00 41.96 41.87 2eh0 s TYR 83 CO 0.21 -0.24 -0.13 0.08 -1.11 0.00 0.00 175.55 174.36 2eh0 s VAL 84 N 0.61 1.00 -1.45 0.71 1.01 0.12 -0.98 120.40 121.42 2eh0 s VAL 84 Ca -0.03 -1.10 -0.00 0.00 0.00 0.00 0.00 61.98 60.84 2eh0 s VAL 84 Cb -0.05 -0.95 0.00 0.00 0.00 0.00 0.00 36.38 35.38 2eh0 s VAL 84 CO -0.04 -0.14 0.02 0.59 0.00 0.00 0.00 175.10 175.53 2eh0 n ASN 85 N 1.63 -5.01 0.00 3.32 5.03 -0.74 -0.03 115.26 119.46 2eh0 n ASN 85 Ca -0.20 0.07 0.00 0.00 0.87 0.00 0.00 54.58 55.32 2eh0 n ASN 85 Cb 0.55 -4.20 0.00 0.00 -1.02 0.00 0.00 39.78 35.11 2eh0 n ASN 85 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2eh0 n GLY 86 N -0.93 0.67 3.73 7.41 0.00 -1.26 -4.99 105.19 109.82 2eh0 n GLY 86 Ca -0.20 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.53 2eh0 n GLY 86 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2eh0 s LYS 87 N -0.29 2.14 0.31 1.61 -2.85 0.96 -5.12 119.74 116.50 2eh0 s LYS 87 Ca 0.00 -2.18 -0.27 0.00 -1.00 0.00 0.00 55.97 52.53 2eh0 s LYS 87 Cb 0.00 -1.71 -0.10 0.00 -2.06 0.00 0.00 37.83 33.97 2eh0 s LYS 87 CO 0.00 -0.26 0.94 0.50 0.10 0.00 0.00 175.35 176.63 2eh0 s ARG 88 N -3.88 4.62 -0.27 1.78 6.06 -1.26 0.12 118.95 126.12 2eh0 s ARG 88 Ca 0.23 1.34 -0.01 0.00 -2.50 0.00 0.00 55.73 54.80 2eh0 s ARG 88 Cb 0.04 -2.86 0.08 0.00 0.06 0.00 0.00 34.95 32.27 2eh0 s ARG 88 CO 0.13 0.31 0.06 0.54 -2.50 0.00 0.00 175.30 173.84 2eh0 s VAL 89 N -1.56 0.83 -0.21 7.11 0.11 -1.09 -4.67 120.40 120.91 2eh0 s VAL 89 Ca 0.49 -1.11 0.14 0.00 -2.93 0.00 0.00 61.98 58.56 2eh0 s VAL 89 Cb -0.20 -1.48 -0.20 0.00 -1.53 0.00 0.00 36.38 32.98 2eh0 s VAL 89 CO 0.25 -0.47 0.39 -0.24 -3.33 0.00 0.00 175.10 171.70 2eh0 n SER 90 N 4.90 1.43 -4.70 3.54 2.88 -1.26 -4.57 113.62 115.83 2eh0 n SER 90 Ca -0.05 -0.25 -0.23 0.00 -1.33 0.00 0.00 58.87 57.00 2eh0 n SER 90 Cb 0.44 1.45 -0.07 0.00 -0.75 0.00 0.00 64.21 65.28 2eh0 n SER 90 CO 0.00 0.00 0.00 -1.10 -1.23 0.00 0.00 175.04 172.71 2eh0 s GLN 91 N -2.77 2.33 -0.30 -1.46 -0.21 -1.26 -4.35 119.66 111.65 2eh0 s GLN 91 Ca -0.02 -1.53 -0.29 0.00 0.02 0.00 0.00 55.36 53.55 2eh0 s GLN 91 Cb 0.09 -2.15 -0.02 0.00 1.00 0.00 0.00 33.01 31.93 2eh0 s GLN 91 CO 0.58 0.18 1.66 -1.25 -2.12 0.00 0.00 175.29 174.35 2eh0 s PRO 92 N -3.79 3.56 0.04 2.91 0.04 -1.26 -4.42 135.00 132.09 2eh0 s PRO 92 Ca 0.36 1.45 0.07 0.00 0.04 0.00 0.00 61.00 62.92 2eh0 s PRO 92 Cb -0.03 -4.10 -0.02 0.00 0.04 0.00 0.00 34.50 30.38 2eh0 s PRO 92 CO 0.22 -1.58 -0.21 0.14 0.04 0.00 0.00 177.00 175.60 2eh0 s VAL 93 N 5.97 1.69 -0.50 -0.36 -7.23 -0.65 -4.94 120.40 114.39 2eh0 s VAL 93 Ca 0.74 -1.20 -0.29 0.00 -1.81 0.00 0.00 61.98 59.42 2eh0 s VAL 93 Cb -0.22 -1.47 0.03 0.00 0.56 0.00 0.00 36.38 35.28 2eh0 s VAL 93 CO 0.32 0.22 1.15 -1.58 -0.31 0.00 0.00 175.10 174.90 2eh0 s GLN 94 N -1.16 3.69 0.61 4.82 0.74 -1.26 -0.60 119.66 126.50 2eh0 s GLN 94 Ca 0.08 0.51 -0.17 0.00 0.05 0.00 0.00 55.36 55.82 2eh0 s GLN 94 Cb -0.09 -3.93 -0.08 0.00 1.10 0.00 0.00 33.01 30.01 2eh0 s GLN 94 CO 0.02 -1.44 0.41 1.28 -0.55 0.00 0.00 175.29 175.01 2eh0 n LEU 95 N 7.95 0.08 -4.37 3.68 7.99 -0.98 -4.96 117.00 126.40 2eh0 n LEU 95 Ca 0.11 0.67 -0.33 0.00 -0.01 0.00 0.00 56.01 56.46 2eh0 n LEU 95 Cb 0.49 -1.13 -0.14 0.00 -0.11 0.00 0.00 43.42 42.52 2eh0 n LEU 95 CO 0.72 -3.36 -0.47 -0.60 -1.51 0.00 0.00 177.39 172.17 2eh0 s ARG 96 N -2.13 3.09 -0.54 3.23 6.06 -1.26 -4.91 118.95 122.49 2eh0 s ARG 96 Ca 0.66 -0.72 -0.39 0.00 -2.50 0.00 0.00 55.73 52.77 2eh0 s ARG 96 Cb -0.42 -2.51 -0.17 0.00 0.06 0.00 0.00 34.95 31.92 2eh0 s ARG 96 CO 0.57 0.31 2.26 0.45 -2.50 0.00 0.00 175.30 176.39 2eh0 n SER 97 N 3.21 1.10 -0.11 -2.12 2.88 -1.26 -0.76 113.62 116.56 2eh0 n SER 97 Ca -0.18 0.48 0.00 0.00 -1.33 0.00 0.00 58.87 57.84 2eh0 n SER 97 Cb 0.53 -1.03 0.00 0.00 -0.75 0.00 0.00 64.21 62.96 2eh0 n SER 97 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2eh0 n GLY 98 N 7.03 1.10 3.61 0.46 0.00 -1.15 -5.06 105.19 111.18 2eh0 n GLY 98 Ca 0.53 -0.20 -0.33 0.00 0.00 0.00 0.00 46.02 46.01 2eh0 n GLY 98 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2eh0 s ASN 99 N -2.28 4.78 -0.04 1.61 2.20 0.06 -4.96 114.94 116.31 2eh0 s ASN 99 Ca 0.00 -0.03 -0.20 0.00 -0.94 0.00 0.00 52.86 51.69 2eh0 s ASN 99 Cb 0.00 -1.20 -0.05 0.00 -2.00 0.00 0.00 41.25 38.00 2eh0 s ASN 99 CO 0.00 0.33 0.57 -0.13 -2.94 0.00 0.00 177.10 174.93 2eh0 s ARG 100 N -1.10 4.31 -0.10 3.55 1.81 -1.26 -3.16 118.95 123.01 2eh0 s ARG 100 Ca 0.15 0.66 0.01 0.00 -1.72 0.00 0.00 55.73 54.82 2eh0 s ARG 100 Cb -0.11 -3.37 0.02 0.00 -0.45 0.00 0.00 34.95 31.04 2eh0 s ARG 100 CO 0.04 0.30 -0.11 0.42 -0.68 0.00 0.00 175.30 175.28 2eh0 s ILE 101 N 0.08 1.19 -0.19 1.52 1.01 -0.79 -1.79 121.20 122.23 2eh0 s ILE 101 Ca 0.30 -0.43 -0.05 0.00 0.00 0.00 0.00 60.65 60.46 2eh0 s ILE 101 Cb -0.17 -1.14 -0.03 0.00 0.01 0.00 0.00 42.46 41.13 2eh0 s ILE 101 CO 0.15 0.39 0.00 -0.63 0.00 0.00 0.00 174.94 174.85 2eh0 s ILE 102 N 1.27 4.11 -0.32 2.92 1.01 -0.15 -1.50 121.20 128.54 2eh0 s ILE 102 Ca -0.02 -0.27 0.02 0.00 0.00 0.00 0.00 60.65 60.38 2eh0 s ILE 102 Cb -0.14 -2.85 0.10 0.00 0.01 0.00 0.00 42.46 39.58 2eh0 s ILE 102 CO -0.04 0.45 0.07 -0.04 0.00 0.00 0.00 174.94 175.38 2eh0 s MET 103 N 0.73 1.14 0.00 2.79 -1.94 -0.38 -2.00 119.30 119.63 2eh0 s MET 103 Ca 0.00 -1.51 0.00 0.00 -1.71 0.00 0.00 55.69 52.48 2eh0 s MET 103 Cb -0.14 -2.66 0.00 0.00 2.01 0.00 0.00 34.83 34.04 2eh0 s MET 103 CO 0.02 -0.95 0.00 0.41 -0.01 0.00 0.00 175.02 174.49 2eh0 n GLY 104 N 4.52 1.23 0.66 -0.03 0.00 -1.20 -4.21 105.19 106.18 2eh0 n GLY 104 Ca 0.01 -0.83 0.00 0.00 0.00 0.00 0.00 46.02 45.21 2eh0 n GLY 104 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2eh0 n LYS 105 N 0.00 0.00 0.00 1.61 4.76 -1.26 -4.91 118.16 118.36 2eh0 n LYS 105 Ca 0.00 0.00 0.02 0.00 -2.87 0.00 0.00 58.31 55.46 2eh0 n LYS 105 Cb 0.00 0.00 0.02 0.00 -1.84 0.00 0.00 35.03 33.21 2eh0 n LYS 105 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 2eh0 n ASN 106 N -1.96 1.29 -4.43 4.39 4.13 -1.26 -4.90 115.26 112.52 2eh0 n ASN 106 Ca 0.00 -1.14 -0.27 0.00 1.68 0.00 0.00 54.58 54.85 2eh0 n ASN 106 Cb 0.00 0.05 -0.08 0.00 -1.54 0.00 0.00 39.78 38.21 2eh0 n ASN 106 CO 0.00 0.00 0.00 1.41 0.28 0.00 0.00 177.26 178.95 2eh0 n HIS 107 N 0.17 2.04 -3.82 3.10 8.25 -1.26 -4.90 115.22 118.80 2eh0 n HIS 107 Ca 0.02 -1.11 -0.20 0.00 -0.26 0.00 0.00 57.72 56.16 2eh0 n HIS 107 Cb 0.10 -2.44 -0.02 0.00 1.12 0.00 0.00 29.99 28.75 2eh0 n HIS 107 CO 0.00 0.00 0.00 0.08 0.64 0.00 0.00 176.34 177.06 2eh0 s VAL 108 N 11.93 4.65 0.17 1.59 1.01 -1.26 -1.25 120.40 137.24 2eh0 s VAL 108 Ca 0.71 -1.08 -0.21 0.00 0.00 0.00 0.00 61.98 61.40 2eh0 s VAL 108 Cb 0.01 -3.61 0.06 0.00 0.00 0.00 0.00 36.38 32.83 2eh0 s VAL 108 CO 0.16 -0.27 0.58 -0.36 0.00 0.00 0.00 175.10 175.22 2eh0 s PHE 109 N -2.09 -0.42 -0.02 5.22 0.40 -0.56 -4.46 117.98 116.05 2eh0 s PHE 109 Ca 0.38 0.15 0.03 0.00 -0.60 0.00 0.00 56.93 56.90 2eh0 s PHE 109 Cb -0.09 0.53 -0.03 0.00 0.51 0.00 0.00 43.02 43.94 2eh0 s PHE 109 CO 0.29 -0.88 -0.11 0.50 0.70 0.00 0.00 175.22 175.71 2eh0 s ARG 110 N -3.79 2.50 -0.14 0.44 3.52 -0.23 -1.89 118.95 119.36 2eh0 s ARG 110 Ca 0.03 -0.72 -0.20 0.00 -0.13 0.00 0.00 55.73 54.71 2eh0 s ARG 110 Cb -0.01 -2.43 -0.03 0.00 -1.56 0.00 0.00 34.95 30.91 2eh0 s ARG 110 CO -0.10 0.61 0.58 0.12 -0.81 0.00 0.00 175.30 175.70 2eh0 s PHE 111 N -0.86 3.46 -0.17 5.12 5.36 -1.19 -2.11 117.98 127.61 2eh0 s PHE 111 Ca 0.14 0.96 -0.04 0.00 -0.96 0.00 0.00 56.93 57.03 2eh0 s PHE 111 Cb -0.11 -2.70 -0.02 0.00 -0.34 0.00 0.00 43.02 39.85 2eh0 s PHE 111 CO 0.04 0.01 -0.04 1.21 -1.46 0.00 0.00 175.22 174.97 2eh0 s ASN 112 N 0.91 4.68 -0.42 6.13 3.84 -1.10 -2.93 114.94 126.05 2eh0 s ASN 112 Ca 0.29 -0.19 0.07 0.00 0.21 0.00 0.00 52.86 53.24 2eh0 s ASN 112 Cb -0.16 -1.77 0.23 0.00 -0.55 0.00 0.00 41.25 39.00 2eh0 s ASN 112 CO 0.12 0.13 0.50 1.57 -2.79 0.00 0.00 177.10 176.63 2eh0 n HIS 113 N 3.78 -0.14 0.77 0.43 -0.00 -1.26 -3.76 115.22 115.03 2eh0 n HIS 113 Ca -0.17 -3.56 0.07 0.00 0.46 0.00 0.00 57.72 54.52 2eh0 n HIS 113 Cb 0.52 -0.24 0.39 0.00 -0.12 0.00 0.00 29.99 30.55 2eh0 n HIS 113 CO 0.00 0.00 0.00 -0.35 0.46 0.00 0.00 176.34 176.45 2eh0 n PRO 114 N 1.68 0.28 -0.06 1.57 -0.04 -1.26 -1.89 135.00 135.29 2eh0 n PRO 114 Ca 0.23 0.11 -0.16 0.00 -0.04 0.00 0.00 63.50 63.64 2eh0 n PRO 114 Cb 0.51 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.34 2eh0 n PRO 114 CO 0.00 0.00 0.00 0.93 -0.04 0.00 0.00 175.50 176.39 2eh0 h GLU 115 N 0.00 0.05 0.15 0.54 5.08 -1.92 -3.31 114.58 115.16 2eh0 h GLU 115 Ca 0.00 -0.08 -0.26 0.00 -1.00 0.00 0.00 59.36 58.02 2eh0 h GLU 115 Cb 0.10 0.03 0.01 0.00 0.50 0.00 0.00 28.75 29.39 2eh0 h GLU 115 CO 0.00 1.04 -1.28 0.37 -1.00 0.00 0.00 179.01 178.14 2eh0 h GLN 116 N -0.90 0.31 0.00 2.33 5.75 -1.90 -3.30 115.11 117.41 2eh0 h GLN 116 Ca -0.06 -0.54 0.00 0.00 -0.15 0.00 0.00 58.65 57.90 2eh0 h GLN 116 Cb 1.13 0.20 0.00 0.00 1.07 0.00 0.00 27.48 29.88 2eh0 h GLN 116 CO 0.00 1.26 0.39 0.00 -2.65 0.00 0.00 178.83 177.83 2eh0 h ALA 117 N 0.03 1.35 0.11 3.38 0.00 -1.57 0.41 119.26 122.97 2eh0 h ALA 117 Ca -0.25 0.00 -0.27 0.00 0.00 0.00 0.00 54.91 54.38 2eh0 h ALA 117 Cb 1.81 0.00 0.01 0.00 0.00 0.00 0.00 17.79 19.61 2eh0 h ALA 117 CO 0.13 -0.35 -1.18 0.07 0.00 0.00 0.00 179.25 177.91 2eh0 h ARG 118 N 0.00 0.39 0.00 0.00 0.11 -1.65 -3.16 114.38 110.07 2eh0 h ARG 118 Ca 0.00 -0.56 0.00 0.00 0.10 0.00 0.00 59.98 59.52 2eh0 h ARG 118 Cb 0.78 0.19 0.00 0.00 1.11 0.00 0.00 29.97 32.06 2eh0 h ARG 118 CO 0.00 1.24 0.00 0.00 0.10 0.00 0.00 179.97 181.31 2eh0 n ALA 119 N -2.58 2.14 -0.28 0.08 0.00 0.14 -3.90 120.51 116.12 2eh0 n ALA 119 Ca -0.10 -0.10 0.27 0.00 0.00 0.00 0.00 53.44 53.52 2eh0 n ALA 119 Cb 0.97 -1.38 0.50 0.00 0.00 0.00 0.00 19.45 19.54 2eh0 n ALA 119 CO 0.00 0.00 0.00 -0.85 0.00 0.00 0.00 177.50 176.65 2eh0 n GLU 120 N -1.39 -0.05 -0.13 0.00 0.28 -1.11 -0.30 120.64 117.94 2eh0 n GLU 120 Ca 0.08 1.15 -0.19 0.00 -0.16 0.00 0.00 57.16 58.05 2eh0 n GLU 120 Cb 0.23 -2.08 -0.11 0.00 1.43 0.00 0.00 31.44 30.91 2eh0 n GLU 120 CO 0.00 0.00 0.00 -2.13 -0.16 0.00 0.00 177.13 174.84 2eh0 n ARG 121 N -4.85 0.62 0.16 3.44 0.63 -1.25 -4.33 116.66 111.07 2eh0 n ARG 121 Ca 0.32 0.16 0.18 0.00 -0.92 0.00 0.00 57.85 57.59 2eh0 n ARG 121 Cb 1.10 -1.50 0.69 0.00 0.45 0.00 0.00 32.46 33.21 2eh0 n ARG 121 CO 0.00 0.00 0.00 0.93 -2.51 0.00 0.00 177.63 176.05 2eh0 h GLU 122 N -0.12 0.00 -6.95 -0.14 4.39 -1.11 -3.42 114.58 107.23 2eh0 h GLU 122 Ca -0.58 0.00 -0.53 0.00 0.34 0.00 0.00 59.36 58.59 2eh0 h GLU 122 Cb 1.83 0.00 0.20 0.00 -0.10 0.00 0.00 28.75 30.69 2eh0 h GLU 122 CO -0.13 0.00 -0.23 0.36 -1.16 0.00 0.00 179.01 177.85 2eh0 n LYS 123 N -3.32 -0.20 -1.45 2.33 2.85 0.59 -4.66 118.16 114.32 2eh0 n LYS 123 Ca 0.05 -0.00 -0.45 0.00 -1.05 0.00 0.00 58.31 56.86 2eh0 n LYS 123 Cb 0.66 -2.06 -0.12 0.00 -0.65 0.00 0.00 35.03 32.85 2eh0 n LYS 123 CO 0.00 0.00 0.00 2.41 -0.05 0.00 0.00 177.40 179.76 2eh0 n THR 124 N -3.57 0.01 -2.27 0.58 -1.04 -1.26 -4.80 114.28 101.92 2eh0 n THR 124 Ca 0.09 -0.12 -0.41 0.00 -2.04 0.00 0.00 64.05 61.58 2eh0 n THR 124 Cb 0.52 -0.87 -0.03 0.00 -1.82 0.00 0.00 70.33 68.13 2eh0 n THR 124 CO 0.00 0.00 0.00 -0.55 -0.64 0.00 0.00 175.07 173.88 2eh0 s SER 125 N 8.59 5.89 0.09 8.00 0.15 -1.26 -4.90 113.70 130.26 2eh0 s SER 125 Ca 1.26 0.37 -0.05 0.00 0.70 0.00 0.00 55.95 58.23 2eh0 s SER 125 Cb -1.15 -2.54 0.02 0.00 -1.71 0.00 0.00 66.02 60.64 2eh0 s SER 125 CO 0.50 -1.88 0.25 0.61 1.20 0.00 0.00 173.24 173.92 2eh0 n GLY 126 N 5.39 1.50 3.55 9.45 0.00 -1.26 -5.10 105.19 118.73 2eh0 n GLY 126 Ca 0.15 -1.05 -0.37 0.00 0.00 0.00 0.00 46.02 44.75 2eh0 n GLY 126 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2eh0 s PRO 127 N -2.02 2.61 -0.23 1.61 0.04 -1.26 -4.93 135.00 130.82 2eh0 s PRO 127 Ca 0.05 0.52 -0.02 0.00 0.04 0.00 0.00 61.00 61.60 2eh0 s PRO 127 Cb -0.01 -4.46 0.07 0.00 0.04 0.00 0.00 34.50 30.14 2eh0 s PRO 127 CO 0.03 -2.80 0.05 0.45 0.04 0.00 0.00 177.00 174.76 2eh0 s SER 128 N 8.12 3.33 0.39 6.66 0.15 -1.26 -5.13 113.70 125.96 2eh0 s SER 128 Ca 0.68 -1.09 0.06 0.00 0.70 0.00 0.00 55.95 56.29 2eh0 s SER 128 Cb -0.12 -0.72 0.06 0.00 -1.71 0.00 0.00 66.02 63.53 2eh0 s SER 128 CO 0.19 -0.33 0.47 -1.54 1.20 0.00 0.00 173.24 173.22 2eh0 n SER 129 N 4.96 1.66 0.00 5.45 3.41 -1.26 -5.26 113.62 122.59 2eh0 n SER 129 Ca -0.07 -2.12 0.00 0.00 -0.26 0.00 0.00 58.87 56.41 2eh0 n SER 129 Cb 0.45 -0.21 0.00 0.00 -0.26 0.00 0.00 64.21 64.19 2eh0 n SER 129 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49