#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2eh0 s SER 2 N 0.00 3.87 0.03 1.61 1.04 -1.26 -5.04 113.70 113.95 2eh0 s SER 2 Ca 0.00 -0.25 -0.26 0.00 0.48 0.00 0.00 55.95 55.92 2eh0 s SER 2 Cb 0.00 -0.81 -0.17 0.00 0.10 0.00 0.00 66.02 65.14 2eh0 s SER 2 CO 0.00 0.33 1.39 0.28 0.98 0.00 0.00 173.24 176.22 2eh0 h SER 3 N 5.45 -0.30 0.00 7.02 0.02 -2.08 -3.48 113.55 120.17 2eh0 h SER 3 Ca -0.45 -0.15 0.00 0.00 -0.84 0.00 0.00 61.79 60.35 2eh0 h SER 3 Cb 1.15 0.08 0.00 0.00 0.14 0.00 0.00 62.40 63.77 2eh0 h SER 3 CO 0.50 -0.01 0.00 0.61 -1.14 0.00 0.00 176.83 176.79 2eh0 n GLY 4 N -0.56 0.20 3.84 -3.77 0.00 -1.26 -5.03 105.19 98.61 2eh0 n GLY 4 Ca -0.09 0.15 -0.27 0.00 0.00 0.00 0.00 46.02 45.80 2eh0 n GLY 4 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2eh0 n SER 5 N 0.00 -3.39 0.04 1.61 2.88 -1.26 -4.88 113.62 108.62 2eh0 n SER 5 Ca 0.00 -0.80 -0.01 0.00 -1.33 0.00 0.00 58.87 56.73 2eh0 n SER 5 Cb 0.00 -3.91 -0.00 0.00 -0.75 0.00 0.00 64.21 59.54 2eh0 n SER 5 CO 0.00 0.00 0.00 -1.54 -1.23 0.00 0.00 175.04 172.27 2eh0 n SER 6 N -2.92 1.10 -4.75 -3.46 3.41 -1.26 -5.04 113.62 100.71 2eh0 n SER 6 Ca -0.09 0.14 -0.41 0.00 -0.26 0.00 0.00 58.87 58.25 2eh0 n SER 6 Cb 0.58 -0.35 -0.02 0.00 -0.26 0.00 0.00 64.21 64.16 2eh0 n SER 6 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 2eh0 s GLY 7 N -3.99 2.43 -0.01 5.00 0.00 -1.26 -5.01 107.32 104.48 2eh0 s GLY 7 Ca -0.02 1.26 0.02 0.00 0.00 0.00 0.00 44.72 45.98 2eh0 s GLY 7 CO 0.03 2.18 -0.06 -1.59 0.00 0.00 0.00 173.10 173.66 2eh0 s THR 8 N -0.10 0.47 0.22 0.90 2.01 -1.26 -4.44 115.64 113.45 2eh0 s THR 8 Ca 0.57 -0.24 -0.30 0.00 0.31 0.00 0.00 61.69 62.03 2eh0 s THR 8 Cb -0.40 -0.41 -0.09 0.00 0.01 0.00 0.00 72.50 71.61 2eh0 s THR 8 CO 0.43 0.14 1.29 -2.16 -0.69 0.00 0.00 174.62 173.63 2eh0 s PRO 9 N -0.06 4.41 0.04 4.92 0.04 -1.26 -4.67 135.00 138.42 2eh0 s PRO 9 Ca 0.01 2.05 -0.25 0.00 0.04 0.00 0.00 61.00 62.85 2eh0 s PRO 9 Cb -0.03 -3.18 0.06 0.00 0.04 0.00 0.00 34.50 31.39 2eh0 s PRO 9 CO -0.00 -0.20 0.59 -3.38 0.04 0.00 0.00 177.00 174.05 2eh0 s HIS 10 N -0.19 -0.53 -0.17 0.56 -3.43 -1.22 -0.64 115.29 109.68 2eh0 s HIS 10 Ca 0.54 0.65 -0.06 0.00 -0.80 0.00 0.00 55.06 55.39 2eh0 s HIS 10 Cb -0.36 0.42 -0.04 0.00 -1.43 0.00 0.00 32.58 31.17 2eh0 s HIS 10 CO 0.41 -0.68 0.03 -0.51 -2.00 0.00 0.00 174.74 171.98 2eh0 s LEU 11 N -1.90 3.62 -0.20 5.38 1.43 0.84 -2.21 118.68 125.64 2eh0 s LEU 11 Ca -0.06 0.02 -0.09 0.00 -1.03 0.00 0.00 54.13 52.97 2eh0 s LEU 11 Cb -0.01 -1.90 -0.05 0.00 0.03 0.00 0.00 46.19 44.27 2eh0 s LEU 11 CO -0.01 0.19 0.11 -0.69 0.23 0.00 0.00 176.35 176.18 2eh0 s VAL 12 N 0.27 5.18 -1.33 -1.59 1.01 -0.63 -0.70 120.40 122.61 2eh0 s VAL 12 Ca 0.01 0.11 -0.17 0.00 0.00 0.00 0.00 61.98 61.94 2eh0 s VAL 12 Cb -0.13 -3.37 0.08 0.00 0.00 0.00 0.00 36.38 32.96 2eh0 s VAL 12 CO 0.01 0.43 1.82 -3.20 0.00 0.00 0.00 175.10 174.16 2eh0 n ASN 13 N 3.66 4.75 0.00 3.32 5.15 0.65 -0.92 115.26 131.87 2eh0 n ASN 13 Ca -0.16 -2.91 0.06 0.00 -0.60 0.00 0.00 54.58 50.96 2eh0 n ASN 13 Cb 0.52 -1.71 0.34 0.00 -0.53 0.00 0.00 39.78 38.41 2eh0 n ASN 13 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2eh0 n LEU 14 N 7.54 0.00 -4.02 1.20 -0.00 -1.25 -4.88 117.00 115.59 2eh0 n LEU 14 Ca 0.48 0.00 -0.19 0.00 -0.00 0.00 0.00 56.01 56.31 2eh0 n LEU 14 Cb 0.44 0.00 0.14 0.00 -0.00 0.00 0.00 43.42 44.00 2eh0 n LEU 14 CO 0.79 0.00 -0.03 -0.46 -0.00 0.00 0.00 177.39 177.68 2eh0 n ASN 15 N -0.69 -2.97 -0.00 1.45 0.23 -1.25 -4.95 115.26 107.07 2eh0 n ASN 15 Ca 0.09 -0.37 0.06 0.00 -0.53 0.00 0.00 54.58 53.83 2eh0 n ASN 15 Cb 0.04 -0.77 -0.09 0.00 -2.08 0.00 0.00 39.78 36.89 2eh0 n ASN 15 CO 0.00 0.00 0.00 -1.84 -0.93 0.00 0.00 177.26 174.49 2eh0 n GLU 16 N -1.68 0.54 -0.96 -3.83 0.28 -1.26 -4.98 120.64 108.75 2eh0 n GLU 16 Ca 0.05 -0.10 -0.21 0.00 -0.16 0.00 0.00 57.16 56.74 2eh0 n GLU 16 Cb 0.36 -1.25 -0.12 0.00 1.43 0.00 0.00 31.44 31.87 2eh0 n GLU 16 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 2eh0 n ASP 17 N -1.85 -0.26 0.00 -1.84 8.00 -1.26 -4.67 116.55 114.67 2eh0 n ASP 17 Ca -0.02 -0.07 0.07 0.00 0.71 0.00 0.00 54.79 55.48 2eh0 n ASP 17 Cb 0.29 -0.49 0.36 0.00 -0.02 0.00 0.00 41.12 41.26 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 4.66 0.18 -0.51 -0.24 -0.04 -1.26 -2.13 135.00 135.66 2eh0 n PRO 18 Ca 0.43 0.16 0.06 0.00 -0.04 0.00 0.00 63.50 64.11 2eh0 n PRO 18 Cb 0.05 -1.50 0.25 0.00 -0.04 0.00 0.00 33.50 32.26 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 -1.31 3.98 -4.67 1.53 4.77 -1.26 -4.99 117.00 115.04 2eh0 n LEU 19 Ca 0.07 -3.14 -0.43 0.00 -0.03 0.00 0.00 56.01 52.48 2eh0 n LEU 19 Cb 0.12 -0.56 -0.02 0.00 -2.33 0.00 0.00 43.42 40.63 2eh0 n LEU 19 CO 0.11 0.76 0.89 0.00 -1.33 0.00 0.00 177.39 177.82 2eh0 s MET 20 N -2.90 4.32 0.00 3.23 0.23 -0.91 -4.89 119.30 118.39 2eh0 s MET 20 Ca 0.43 1.42 0.08 0.00 -1.03 0.00 0.00 55.69 56.58 2eh0 s MET 20 Cb 0.35 -3.61 -0.05 0.00 -1.53 0.00 0.00 34.83 30.00 2eh0 s MET 20 CO 0.08 -0.51 0.43 0.43 -2.03 0.00 0.00 175.02 173.42 2eh0 n SER 21 N 5.78 0.68 -4.88 -1.18 7.64 -1.26 -5.02 113.62 115.37 2eh0 n SER 21 Ca 0.11 -0.84 -0.30 0.00 1.01 0.00 0.00 58.87 58.85 2eh0 n SER 21 Cb 0.47 0.76 0.04 0.00 -1.01 0.00 0.00 64.21 64.47 2eh0 n SER 21 CO 0.00 0.00 0.00 -1.61 -3.01 0.00 0.00 175.04 170.42 2eh0 s GLU 22 N -1.48 2.99 0.70 1.43 2.02 -1.26 -4.99 118.70 118.11 2eh0 s GLU 22 Ca 0.05 0.48 -0.17 0.00 0.02 0.00 0.00 54.97 55.35 2eh0 s GLU 22 Cb 0.06 -2.04 -0.14 0.00 0.10 0.00 0.00 34.13 32.10 2eh0 s GLU 22 CO 0.26 -0.94 -0.43 0.00 0.02 0.00 0.00 175.26 174.18 2eh0 h LEU 24 N -0.45 0.00 -8.32 0.00 -0.00 -1.94 -3.47 115.31 101.12 2eh0 h LEU 24 Ca -0.40 0.00 -0.14 0.00 -0.00 0.00 0.00 57.88 57.34 2eh0 h LEU 24 Cb 1.31 0.00 -0.12 0.00 -0.00 0.00 0.00 40.66 41.85 2eh0 h LEU 24 CO 0.31 0.97 -0.37 -1.48 -0.00 0.00 0.00 178.44 177.87 2eh0 s LEU 25 N -6.50 0.87 -0.03 1.67 0.05 -1.26 -0.25 118.68 113.23 2eh0 s LEU 25 Ca -0.01 -1.08 0.00 0.00 0.05 0.00 0.00 54.13 53.10 2eh0 s LEU 25 Cb 0.09 1.06 0.03 0.00 -2.05 0.00 0.00 46.19 45.32 2eh0 s LEU 25 CO 0.82 -0.95 0.01 -0.31 -0.55 0.00 0.00 176.35 175.37 2eh0 s TYR 26 N -4.05 0.26 -0.10 3.48 2.02 0.12 -4.98 117.35 114.10 2eh0 s TYR 26 Ca 0.26 0.04 -0.21 0.00 -0.37 0.00 0.00 57.07 56.79 2eh0 s TYR 26 Cb 0.03 -0.40 -0.04 0.00 -0.40 0.00 0.00 41.96 41.16 2eh0 s TYR 26 CO 0.07 -0.14 0.62 0.71 -1.57 0.00 0.00 175.55 175.24 2eh0 s TYR 27 N 1.17 3.54 -0.18 2.71 2.02 -1.26 -0.11 117.35 125.23 2eh0 s TYR 27 Ca -0.08 1.10 -0.18 0.00 -0.37 0.00 0.00 57.07 57.55 2eh0 s TYR 27 Cb -0.13 -2.72 -0.04 0.00 -0.40 0.00 0.00 41.96 38.67 2eh0 s TYR 27 CO -0.02 0.09 0.48 0.42 -1.57 0.00 0.00 175.55 174.95 2eh0 s ILE 28 N 0.85 5.15 0.42 2.71 1.01 0.18 -4.97 121.20 126.55 2eh0 s ILE 28 Ca 0.33 0.89 0.03 0.00 0.00 0.00 0.00 60.65 61.90 2eh0 s ILE 28 Cb -0.17 -3.81 -0.00 0.00 0.01 0.00 0.00 42.46 38.49 2eh0 s ILE 28 CO 0.15 0.23 0.61 -1.59 0.00 0.00 0.00 174.94 174.33 2eh0 s LYS 29 N 1.35 3.04 -0.25 2.79 0.00 -1.26 -4.47 119.74 120.95 2eh0 s LYS 29 Ca 0.23 -0.70 -0.28 0.00 0.00 0.00 0.00 55.97 55.22 2eh0 s LYS 29 Cb -0.15 -2.65 -0.04 0.00 0.00 0.00 0.00 37.83 34.99 2eh0 s LYS 29 CO 0.09 -0.19 2.12 0.34 0.00 0.00 0.00 175.35 177.72 2eh0 s ASP 30 N -4.22 5.55 0.00 0.03 2.15 -1.26 -4.55 116.67 114.37 2eh0 s ASP 30 Ca 0.48 1.75 0.00 0.00 0.43 0.00 0.00 52.55 55.21 2eh0 s ASP 30 Cb -0.10 -2.51 0.00 0.00 -0.30 0.00 0.00 42.92 40.01 2eh0 s ASP 30 CO 0.35 -1.91 0.00 0.61 -0.17 0.00 0.00 175.17 174.05 2eh0 n GLY 31 N 5.69 0.03 2.96 2.66 0.00 -1.22 -5.02 105.19 110.30 2eh0 n GLY 31 Ca 0.28 -0.57 -0.26 0.00 0.00 0.00 0.00 46.02 45.47 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 -0.04 1.11 -0.47 -0.61 1.09 -1.26 -1.58 121.20 119.45 2eh0 s ILE 32 Ca 0.00 -0.39 -0.06 0.00 -1.10 0.00 0.00 60.65 59.11 2eh0 s ILE 32 Cb 0.00 -1.08 0.12 0.00 -1.06 0.00 0.00 42.46 40.45 2eh0 s ILE 32 CO 0.00 0.37 0.30 -0.89 -0.10 0.00 0.00 174.94 174.62 2eh0 s THR 33 N 1.30 3.78 -0.00 2.92 2.01 0.28 -4.94 115.64 120.98 2eh0 s THR 33 Ca -0.02 -2.06 -0.30 0.00 0.31 0.00 0.00 61.69 59.62 2eh0 s THR 33 Cb -0.14 -3.52 -0.06 0.00 0.01 0.00 0.00 72.50 68.79 2eh0 s THR 33 CO -0.04 -0.76 1.43 -0.13 -0.69 0.00 0.00 174.62 174.43 2eh0 s ARG 34 N 1.07 4.27 -0.45 4.92 1.81 -1.26 -1.45 118.95 127.86 2eh0 s ARG 34 Ca 0.08 2.00 -0.09 0.00 -1.72 0.00 0.00 55.73 56.00 2eh0 s ARG 34 Cb -0.24 -3.60 0.10 0.00 -0.45 0.00 0.00 34.95 30.76 2eh0 s ARG 34 CO -0.03 -0.61 0.30 0.08 -0.68 0.00 0.00 175.30 174.37 2eh0 s VAL 35 N 2.54 4.20 0.00 3.52 1.01 -0.16 -1.95 120.40 129.55 2eh0 s VAL 35 Ca 0.65 -1.63 0.00 0.00 0.00 0.00 0.00 61.98 61.00 2eh0 s VAL 35 Cb -0.32 -3.68 0.00 0.00 0.00 0.00 0.00 36.38 32.38 2eh0 s VAL 35 CO 0.27 -0.66 0.00 0.61 0.00 0.00 0.00 175.10 175.32 2eh0 n GLY 36 N 4.90 2.91 3.96 4.51 0.00 -0.86 -1.91 105.19 118.71 2eh0 n GLY 36 Ca -0.09 0.06 -0.19 0.00 0.00 0.00 0.00 46.02 45.80 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 4.02 2.68 0.07 1.61 -1.52 -1.20 -2.60 119.66 122.71 2eh0 s GLN 37 Ca 0.00 -1.38 0.24 0.00 -1.95 0.00 0.00 55.36 52.27 2eh0 s GLN 37 Cb 0.00 -2.60 0.32 0.00 -0.22 0.00 0.00 33.01 30.51 2eh0 s GLN 37 CO 0.00 -0.28 1.28 0.00 -0.25 0.00 0.00 175.29 176.04 2eh0 n ALA 38 N -1.76 3.22 0.31 6.09 0.00 -1.26 -3.80 120.51 123.31 2eh0 n ALA 38 Ca 0.07 -0.31 0.11 0.00 0.00 0.00 0.00 53.44 53.30 2eh0 n ALA 38 Cb 0.60 -1.11 0.00 0.00 0.00 0.00 0.00 19.45 18.95 2eh0 n ALA 38 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2eh0 n ASP 39 N -1.90 0.62 -4.34 0.00 2.03 -1.26 -4.80 116.55 106.90 2eh0 n ASP 39 Ca 0.04 0.06 -0.39 0.00 0.52 0.00 0.00 54.79 55.01 2eh0 n ASP 39 Cb 0.41 0.77 0.02 0.00 -0.72 0.00 0.00 41.12 41.60 2eh0 n ASP 39 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2eh0 n ALA 40 N -2.02 -2.32 -0.27 -1.67 0.00 -1.25 -4.80 120.51 108.18 2eh0 n ALA 40 Ca 0.00 -0.02 0.08 0.00 0.00 0.00 0.00 53.44 53.51 2eh0 n ALA 40 Cb 0.50 -1.58 0.21 0.00 0.00 0.00 0.00 19.45 18.58 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 0.14 0.21 -4.78 0.00 4.11 -1.93 -3.36 114.58 108.98 2eh0 h GLU 41 Ca -0.42 -0.01 -0.67 0.00 0.07 0.00 0.00 59.36 58.33 2eh0 h GLU 41 Cb 1.43 -0.05 -0.19 0.00 0.50 0.00 0.00 28.75 30.44 2eh0 h GLU 41 CO 0.44 0.14 -0.51 0.50 0.07 0.00 0.00 179.01 179.66 2eh0 s ARG 42 N -6.02 3.58 -0.93 1.06 3.52 -1.26 -4.99 118.95 113.91 2eh0 s ARG 42 Ca -0.13 -0.58 -0.23 0.00 -0.13 0.00 0.00 55.73 54.67 2eh0 s ARG 42 Cb 0.23 -3.71 -0.24 0.00 -1.56 0.00 0.00 34.95 29.67 2eh0 s ARG 42 CO 0.76 -0.37 2.46 -2.13 -0.81 0.00 0.00 175.30 175.22 2eh0 n ARG 43 N 5.06 0.16 -2.12 5.12 0.63 -1.26 -4.82 116.66 119.44 2eh0 n ARG 43 Ca -0.13 -0.07 -0.42 0.00 -0.92 0.00 0.00 57.85 56.31 2eh0 n ARG 43 Cb 0.50 -1.71 -0.03 0.00 0.45 0.00 0.00 32.46 31.67 2eh0 n ARG 43 CO 0.00 0.00 0.00 -0.65 -2.51 0.00 0.00 177.63 174.47 2eh0 s GLN 44 N 8.24 4.29 0.07 -0.14 -1.52 -1.26 -4.93 119.66 124.41 2eh0 s GLN 44 Ca 1.27 2.13 -0.25 0.00 -1.95 0.00 0.00 55.36 56.56 2eh0 s GLN 44 Cb -0.92 -3.31 -0.11 0.00 -0.22 0.00 0.00 33.01 28.45 2eh0 s GLN 44 CO 0.46 -0.51 1.40 -0.44 -0.25 0.00 0.00 175.29 175.95 2eh0 h ASP 45 N 7.09 -1.10 -2.91 5.90 3.32 -1.71 -3.41 116.42 123.59 2eh0 h ASP 45 Ca -0.42 0.11 -0.63 0.00 0.02 0.00 0.00 57.03 56.11 2eh0 h ASP 45 Cb 1.20 0.39 -0.08 0.00 0.22 0.00 0.00 39.33 41.07 2eh0 h ASP 45 CO 0.88 -0.44 -0.38 -0.63 -1.72 0.00 0.00 179.24 176.95 2eh0 s ILE 46 N -5.02 5.34 -0.06 0.35 1.01 -0.94 -5.02 121.20 116.87 2eh0 s ILE 46 Ca -0.12 0.42 0.04 0.00 0.00 0.00 0.00 60.65 61.00 2eh0 s ILE 46 Cb 0.04 -3.53 -0.00 0.00 0.01 0.00 0.00 42.46 38.98 2eh0 s ILE 46 CO 0.44 0.55 -0.20 -0.69 0.00 0.00 0.00 174.94 175.04 2eh0 s VAL 47 N -0.64 1.65 0.39 2.92 1.01 -1.26 -2.02 120.40 122.45 2eh0 s VAL 47 Ca 0.17 -0.82 0.08 0.00 0.00 0.00 0.00 61.98 61.40 2eh0 s VAL 47 Cb -0.13 -1.43 -0.02 0.00 0.00 0.00 0.00 36.38 34.81 2eh0 s VAL 47 CO 0.06 0.47 0.40 -0.76 0.00 0.00 0.00 175.10 175.27 2eh0 s LEU 48 N 0.15 3.55 0.00 3.92 2.01 -1.07 -5.01 118.68 122.23 2eh0 s LEU 48 Ca -0.08 -0.56 0.07 0.00 0.01 0.00 0.00 54.13 53.56 2eh0 s LEU 48 Cb -0.14 -2.28 0.10 0.00 0.01 0.00 0.00 46.19 43.88 2eh0 s LEU 48 CO 0.04 -0.57 0.78 -0.24 1.01 0.00 0.00 176.35 177.37 2eh0 n SER 49 N -1.57 1.82 0.00 2.29 2.88 -1.26 -4.91 113.62 112.88 2eh0 n SER 49 Ca 0.03 -2.35 0.00 0.00 -1.33 0.00 0.00 58.87 55.21 2eh0 n SER 49 Cb 0.60 -0.43 0.00 0.00 -0.75 0.00 0.00 64.21 63.63 2eh0 n SER 49 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2eh0 n GLY 50 N -1.65 -2.26 0.28 0.46 0.00 -1.26 -4.61 105.19 96.16 2eh0 n GLY 50 Ca 0.15 -1.53 0.04 0.00 0.00 0.00 0.00 46.02 44.68 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 -0.91 2.55 1.87 4.61 0.00 -1.26 -4.47 120.51 122.89 2eh0 n ALA 51 Ca 0.00 -0.52 0.14 0.00 0.00 0.00 0.00 53.44 53.06 2eh0 n ALA 51 Cb 0.00 -0.27 0.76 0.00 0.00 0.00 0.00 19.45 19.93 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 0.01 -3.63 0.00 -0.00 -1.26 -4.84 115.22 105.75 2eh0 n HIS 52 Ca 0.04 -0.01 -0.27 0.00 -0.00 0.00 0.00 57.72 57.49 2eh0 n HIS 52 Cb 0.19 0.00 -0.03 0.00 -0.00 0.00 0.00 29.99 30.15 2eh0 n HIS 52 CO 0.00 0.00 0.00 0.42 -0.00 0.00 0.00 176.34 176.76 2eh0 s ILE 53 N -1.99 5.17 0.15 1.59 -1.09 -1.26 -4.41 121.20 119.37 2eh0 s ILE 53 Ca 0.41 -0.33 0.10 0.00 -2.23 0.00 0.00 60.65 58.60 2eh0 s ILE 53 Cb 0.20 -3.74 -0.04 0.00 -1.58 0.00 0.00 42.46 37.29 2eh0 s ILE 53 CO 0.32 -0.22 -0.20 -0.54 -1.23 0.00 0.00 174.94 173.08 2eh0 s LYS 54 N -3.43 1.70 0.40 2.79 -0.14 -1.26 -4.98 119.74 114.81 2eh0 s LYS 54 Ca 0.39 -1.33 0.19 0.00 -1.36 0.00 0.00 55.97 53.86 2eh0 s LYS 54 Cb -0.11 -2.01 1.11 0.00 -1.68 0.00 0.00 37.83 35.15 2eh0 s LYS 54 CO 0.30 0.44 1.78 0.93 -0.76 0.00 0.00 175.35 178.04 2eh0 h GLU 55 N 3.44 0.37 -0.86 1.68 3.07 -1.92 -1.16 114.58 119.21 2eh0 h GLU 55 Ca -0.48 -0.02 -0.49 0.00 -0.50 0.00 0.00 59.36 57.86 2eh0 h GLU 55 Cb 1.19 -0.08 -0.42 0.00 -0.84 0.00 0.00 28.75 28.59 2eh0 h GLU 55 CO 0.47 0.25 -0.88 0.39 -1.40 0.00 0.00 179.01 177.83 2eh0 n GLU 56 N -4.60 3.08 -0.24 2.33 1.02 -1.26 -3.26 120.64 117.70 2eh0 n GLU 56 Ca 0.25 -4.06 -0.06 0.00 -0.02 0.00 0.00 57.16 53.27 2eh0 n GLU 56 Cb 0.87 -2.09 -0.06 0.00 -0.02 0.00 0.00 31.44 30.15 2eh0 n GLU 56 CO 0.00 0.00 0.00 1.58 1.18 0.00 0.00 177.13 179.89 2eh0 n HIS 57 N -0.60 -0.26 -3.85 -0.32 -0.00 -0.44 -4.48 115.22 105.27 2eh0 n HIS 57 Ca 0.34 0.72 -0.10 0.00 0.46 0.00 0.00 57.72 59.15 2eh0 n HIS 57 Cb 0.87 -0.54 -0.01 0.00 -0.12 0.00 0.00 29.99 30.19 2eh0 n HIS 57 CO 0.00 0.00 0.00 0.00 0.46 0.00 0.00 176.34 176.80 2eh0 s ILE 59 N -2.63 0.17 -0.21 0.00 1.01 -0.14 -0.99 121.20 118.41 2eh0 s ILE 59 Ca 0.19 -1.42 -0.01 0.00 0.00 0.00 0.00 60.65 59.41 2eh0 s ILE 59 Cb -0.01 -1.36 0.06 0.00 0.01 0.00 0.00 42.46 41.15 2eh0 s ILE 59 CO 0.14 -0.78 -0.00 -0.36 0.00 0.00 0.00 174.94 173.93 2eh0 s PHE 60 N -3.75 1.60 -0.23 3.97 0.08 -0.53 -0.27 117.98 118.85 2eh0 s PHE 60 Ca 0.05 -1.23 -0.10 0.00 0.12 0.00 0.00 56.93 55.77 2eh0 s PHE 60 Cb 0.05 -1.26 -0.05 0.00 -0.57 0.00 0.00 43.02 41.20 2eh0 s PHE 60 CO -0.10 -0.68 0.13 0.50 -0.10 0.00 0.00 175.22 174.98 2eh0 s ARG 61 N 1.66 4.00 -0.36 0.44 3.52 -0.78 -0.56 118.95 126.88 2eh0 s ARG 61 Ca -0.03 -0.31 -0.04 0.00 -0.13 0.00 0.00 55.73 55.23 2eh0 s ARG 61 Cb -0.18 -3.47 0.07 0.00 -1.56 0.00 0.00 34.95 29.82 2eh0 s ARG 61 CO -0.07 0.05 0.12 0.45 -0.81 0.00 0.00 175.30 175.04 2eh0 s SER 62 N 1.05 5.16 0.01 -2.12 0.15 -0.61 -1.61 113.70 115.73 2eh0 s SER 62 Ca 0.07 -1.56 0.03 0.00 0.70 0.00 0.00 55.95 55.18 2eh0 s SER 62 Cb -0.14 -1.81 -0.01 0.00 -1.71 0.00 0.00 66.02 62.36 2eh0 s SER 62 CO 0.04 -0.40 -0.08 -0.70 1.20 0.00 0.00 173.24 173.29 2eh0 s GLU 63 N 1.25 0.64 -0.35 5.44 2.56 -0.72 -3.39 118.70 124.13 2eh0 s GLU 63 Ca 0.01 -0.43 -0.27 0.00 0.00 0.00 0.00 54.97 54.28 2eh0 s GLU 63 Cb -0.21 -0.58 0.01 0.00 2.00 0.00 0.00 34.13 35.35 2eh0 s GLU 63 CO -0.01 0.15 0.98 0.50 -0.56 0.00 0.00 175.26 176.31 2eh0 s ARG 64 N -0.59 3.94 1.04 4.30 3.52 -1.26 -1.35 118.95 128.55 2eh0 s ARG 64 Ca 0.00 0.78 -0.15 0.00 -0.13 0.00 0.00 55.73 56.23 2eh0 s ARG 64 Cb -0.05 -3.77 0.09 0.00 -1.56 0.00 0.00 34.95 29.66 2eh0 s ARG 64 CO 0.00 -0.92 0.32 0.45 -0.81 0.00 0.00 175.30 174.34 2eh0 n SER 65 N 6.80 -2.06 0.18 -2.12 2.88 0.43 -4.70 113.62 115.03 2eh0 n SER 65 Ca 0.09 0.09 0.18 0.00 -1.33 0.00 0.00 58.87 57.90 2eh0 n SER 65 Cb 0.48 -1.12 0.81 0.00 -0.75 0.00 0.00 64.21 63.63 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 -1.90 0.00 0.85 -3.46 -0.26 -1.95 0.24 115.58 109.10 2eh0 h ASN 66 Ca -0.49 0.00 -0.10 0.00 -0.56 0.00 0.00 56.30 55.15 2eh0 h ASN 66 Cb 1.32 0.00 -0.01 0.00 -1.06 0.00 0.00 38.32 38.57 2eh0 h ASN 66 CO 0.38 0.00 -0.47 -1.28 -1.06 0.00 0.00 177.43 175.00 2eh0 h SER 67 N 0.00 0.00 0.00 5.81 0.87 -2.02 -3.47 113.55 114.74 2eh0 h SER 67 Ca 0.11 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.67 2eh0 h SER 67 Cb 0.65 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.61 2eh0 h SER 67 CO -0.00 0.47 0.00 0.61 -0.53 0.00 0.00 176.83 177.38 2eh0 n GLY 68 N 0.36 1.48 3.47 5.77 0.00 0.84 -5.11 105.19 112.01 2eh0 n GLY 68 Ca -0.00 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.68 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 -0.05 3.41 -0.19 1.61 -1.05 -1.25 -4.85 118.70 116.33 2eh0 s GLU 69 Ca 0.00 -0.58 -0.29 0.00 -0.15 0.00 0.00 54.97 53.95 2eh0 s GLU 69 Cb 0.00 -2.76 -0.03 0.00 -0.44 0.00 0.00 34.13 30.90 2eh0 s GLU 69 CO 0.00 0.31 1.53 0.08 0.95 0.00 0.00 175.26 178.13 2eh0 s VAL 70 N 0.14 3.82 0.09 1.83 1.01 -1.26 -0.43 120.40 125.60 2eh0 s VAL 70 Ca -0.03 0.95 0.09 0.00 0.00 0.00 0.00 61.98 62.98 2eh0 s VAL 70 Cb -0.14 -3.76 -0.04 0.00 0.00 0.00 0.00 36.38 32.44 2eh0 s VAL 70 CO 0.04 -0.25 -0.22 -0.63 0.00 0.00 0.00 175.10 174.04 2eh0 s ILE 71 N 4.63 2.57 -0.05 2.22 -1.09 -0.46 -4.89 121.20 124.12 2eh0 s ILE 71 Ca 0.67 -1.46 0.06 0.00 -2.23 0.00 0.00 60.65 57.69 2eh0 s ILE 71 Cb -0.25 -2.11 -0.01 0.00 -1.58 0.00 0.00 42.46 38.51 2eh0 s ILE 71 CO 0.26 0.20 -0.24 -0.69 -1.23 0.00 0.00 174.94 173.24 2eh0 s VAL 72 N -1.01 1.99 -0.06 2.92 1.01 -1.26 -1.75 120.40 122.24 2eh0 s VAL 72 Ca 0.15 -1.04 0.04 0.00 0.00 0.00 0.00 61.98 61.14 2eh0 s VAL 72 Cb -0.10 -1.68 -0.00 0.00 0.00 0.00 0.00 36.38 34.59 2eh0 s VAL 72 CO 0.06 0.55 -0.20 -0.89 0.00 0.00 0.00 175.10 174.63 2eh0 s THR 73 N -0.18 1.69 -0.29 3.92 2.01 -0.63 -1.67 115.64 120.49 2eh0 s THR 73 Ca -0.03 -0.84 -0.19 0.00 0.31 0.00 0.00 61.69 60.95 2eh0 s THR 73 Cb -0.13 -1.45 -0.02 0.00 0.01 0.00 0.00 72.50 70.91 2eh0 s THR 73 CO 0.03 0.48 0.55 -0.22 -0.69 0.00 0.00 174.62 174.77 2eh0 s LEU 74 N 0.15 4.13 -0.92 4.42 2.96 0.26 -1.86 118.68 127.81 2eh0 s LEU 74 Ca -0.09 0.40 -0.03 0.00 -0.22 0.00 0.00 54.13 54.19 2eh0 s LEU 74 Cb -0.14 -2.70 0.23 0.00 0.50 0.00 0.00 46.19 44.08 2eh0 s LEU 74 CO 0.04 -0.38 0.83 -1.61 -1.32 0.00 0.00 176.35 173.91 2eh0 s GLU 75 N 2.43 3.42 0.82 1.98 0.41 0.63 -2.63 118.70 125.75 2eh0 s GLU 75 Ca 0.22 -3.25 -0.14 0.00 -0.41 0.00 0.00 54.97 51.39 2eh0 s GLU 75 Cb -0.15 -4.05 0.20 0.00 -1.78 0.00 0.00 34.13 28.35 2eh0 s GLU 75 CO 0.11 -1.26 0.73 -0.35 -0.49 0.00 0.00 175.26 174.00 2eh0 n PRO 76 N 2.43 -2.45 -3.89 0.39 -0.04 -1.26 -0.97 135.00 129.21 2eh0 n PRO 76 Ca 0.21 -1.16 -0.26 0.00 -0.04 0.00 0.00 63.50 62.25 2eh0 n PRO 76 Cb 0.37 -1.09 -0.01 0.00 -0.04 0.00 0.00 33.50 32.74 2eh0 n PRO 76 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2eh0 n GLU 78 N -1.77 0.15 -1.00 0.00 0.28 -1.26 -4.15 120.64 112.88 2eh0 n GLU 78 Ca -0.02 -0.01 -0.02 0.00 -0.16 0.00 0.00 57.16 56.95 2eh0 n GLU 78 Cb 0.64 -1.54 0.16 0.00 1.43 0.00 0.00 31.44 32.13 2eh0 n GLU 78 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 2eh0 n ARG 79 N -1.73 2.11 -4.27 3.44 1.74 -1.26 -5.03 116.66 111.66 2eh0 n ARG 79 Ca 0.03 -3.52 -0.19 0.00 -0.77 0.00 0.00 57.85 53.39 2eh0 n ARG 79 Cb 0.39 -1.78 -0.11 0.00 -1.02 0.00 0.00 32.46 29.94 2eh0 n ARG 79 CO 0.00 0.00 0.00 -1.54 -1.52 0.00 0.00 177.63 174.57 2eh0 s SER 80 N -3.32 2.21 -1.18 0.55 1.04 -1.26 -4.99 113.70 106.75 2eh0 s SER 80 Ca 0.41 -0.82 -0.04 0.00 0.48 0.00 0.00 55.95 55.99 2eh0 s SER 80 Cb 0.38 -0.10 0.23 0.00 0.10 0.00 0.00 66.02 66.63 2eh0 s SER 80 CO -0.04 -0.10 1.99 -0.62 0.98 0.00 0.00 173.24 175.45 2eh0 n GLU 81 N 0.50 4.78 -3.23 4.02 1.02 -1.26 -4.88 120.64 121.58 2eh0 n GLU 81 Ca -0.15 -4.07 -0.39 0.00 -0.02 0.00 0.00 57.16 52.54 2eh0 n GLU 81 Cb 0.57 -2.59 -0.06 0.00 -0.02 0.00 0.00 31.44 29.34 2eh0 n GLU 81 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 2eh0 s THR 82 N -2.36 4.76 -0.07 2.62 2.01 -1.26 -3.38 115.64 117.96 2eh0 s THR 82 Ca 0.43 1.26 -0.04 0.00 0.31 0.00 0.00 61.69 63.65 2eh0 s THR 82 Cb 0.16 -3.92 0.03 0.00 0.01 0.00 0.00 72.50 68.78 2eh0 s THR 82 CO -0.07 0.52 0.17 -0.31 -0.69 0.00 0.00 174.62 174.24 2eh0 s TYR 83 N -0.87 -0.21 0.09 4.92 1.51 -0.76 -2.07 117.35 119.97 2eh0 s TYR 83 Ca 0.30 0.54 0.10 0.00 -1.01 0.00 0.00 57.07 57.00 2eh0 s TYR 83 Cb -0.19 -0.01 -0.03 0.00 -0.11 0.00 0.00 41.96 41.61 2eh0 s TYR 83 CO 0.19 -0.16 -0.26 0.08 -1.11 0.00 0.00 175.55 174.29 2eh0 s VAL 84 N 0.90 2.12 -0.39 0.71 1.01 0.37 -0.38 120.40 124.75 2eh0 s VAL 84 Ca -0.07 -1.58 -0.01 0.00 0.00 0.00 0.00 61.98 60.32 2eh0 s VAL 84 Cb -0.08 -1.86 0.01 0.00 0.00 0.00 0.00 36.38 34.44 2eh0 s VAL 84 CO -0.05 0.17 0.04 0.59 0.00 0.00 0.00 175.10 175.85 2eh0 n ASN 85 N 1.27 -1.90 0.00 3.32 5.03 -0.55 0.17 115.26 122.60 2eh0 n ASN 85 Ca -0.18 0.33 0.00 0.00 0.87 0.00 0.00 54.58 55.60 2eh0 n ASN 85 Cb 0.53 -1.71 0.00 0.00 -1.02 0.00 0.00 39.78 37.57 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 -0.62 2.87 3.94 7.41 0.00 -1.26 -4.95 105.19 112.58 2eh0 n GLY 86 Ca -0.04 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.74 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 -0.12 2.19 0.44 1.61 -2.85 0.46 -5.03 119.74 116.44 2eh0 s LYS 87 Ca 0.00 -0.40 -0.16 0.00 -1.00 0.00 0.00 55.97 54.41 2eh0 s LYS 87 Cb 0.00 -2.23 -0.09 0.00 -2.06 0.00 0.00 37.83 33.46 2eh0 s LYS 87 CO 0.00 -1.19 0.89 0.50 0.10 0.00 0.00 175.35 175.65 2eh0 s ARG 88 N -5.17 4.00 -0.25 1.78 3.52 -1.26 0.14 118.95 121.71 2eh0 s ARG 88 Ca 0.60 0.85 -0.03 0.00 -0.13 0.00 0.00 55.73 57.02 2eh0 s ARG 88 Cb -0.10 -2.25 0.08 0.00 -1.56 0.00 0.00 34.95 31.12 2eh0 s ARG 88 CO 0.44 -0.09 0.10 0.54 -0.81 0.00 0.00 175.30 175.47 2eh0 s VAL 89 N -2.35 0.20 -0.44 7.11 0.11 -0.88 -4.60 120.40 119.55 2eh0 s VAL 89 Ca 0.57 -0.68 0.04 0.00 -2.93 0.00 0.00 61.98 58.98 2eh0 s VAL 89 Cb -0.10 -1.01 0.05 0.00 -1.53 0.00 0.00 36.38 33.80 2eh0 s VAL 89 CO 0.24 -0.51 0.77 -1.54 -3.33 0.00 0.00 175.10 170.73 2eh0 n SER 90 N 5.15 1.63 -4.26 3.54 3.41 -1.26 -4.56 113.62 117.27 2eh0 n SER 90 Ca -0.06 -1.42 -0.14 0.00 -0.26 0.00 0.00 58.87 56.99 2eh0 n SER 90 Cb 0.45 -0.03 -0.10 0.00 -0.26 0.00 0.00 64.21 64.27 2eh0 n SER 90 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 2eh0 s GLN 91 N -0.53 1.16 -0.33 4.33 1.11 -1.26 -4.75 119.66 119.38 2eh0 s GLN 91 Ca 0.06 -1.56 -0.29 0.00 0.01 0.00 0.00 55.36 53.58 2eh0 s GLN 91 Cb 0.04 -0.35 -0.01 0.00 -1.01 0.00 0.00 33.01 31.67 2eh0 s GLN 91 CO 0.05 -0.12 1.68 -1.25 0.01 0.00 0.00 175.29 175.67 2eh0 s PRO 92 N -3.90 3.46 0.05 2.91 0.04 -1.26 -4.53 135.00 131.77 2eh0 s PRO 92 Ca 0.25 1.36 0.02 0.00 0.04 0.00 0.00 61.00 62.66 2eh0 s PRO 92 Cb 0.06 -4.13 -0.03 0.00 0.04 0.00 0.00 34.50 30.44 2eh0 s PRO 92 CO 0.05 -1.70 -0.07 0.14 0.04 0.00 0.00 177.00 175.46 2eh0 s VAL 93 N 6.29 0.48 0.17 -0.36 -7.23 -1.08 -4.94 120.40 113.72 2eh0 s VAL 93 Ca 0.74 -1.21 -0.30 0.00 -1.81 0.00 0.00 61.98 59.41 2eh0 s VAL 93 Cb -0.21 -0.75 -0.07 0.00 0.56 0.00 0.00 36.38 35.91 2eh0 s VAL 93 CO 0.33 -0.50 1.09 -1.10 -0.31 0.00 0.00 175.10 174.61 2eh0 s GLN 94 N -1.99 4.60 0.98 4.82 -0.21 -1.26 -0.57 119.66 126.03 2eh0 s GLN 94 Ca -0.07 1.69 -0.16 0.00 0.02 0.00 0.00 55.36 56.83 2eh0 s GLN 94 Cb -0.07 -3.29 0.21 0.00 1.00 0.00 0.00 33.01 30.86 2eh0 s GLN 94 CO -0.01 0.08 1.31 -0.51 -2.12 0.00 0.00 175.29 174.04 2eh0 s LEU 95 N -0.29 2.56 0.21 2.90 2.01 -0.67 -4.91 118.68 120.49 2eh0 s LEU 95 Ca 0.49 0.29 0.10 0.00 0.01 0.00 0.00 54.13 55.02 2eh0 s LEU 95 Cb -0.29 -2.30 -0.05 0.00 0.01 0.00 0.00 46.19 43.56 2eh0 s LEU 95 CO 0.34 -2.85 -0.18 -0.13 1.01 0.00 0.00 176.35 174.54 2eh0 s ARG 96 N -5.86 1.44 -0.95 1.70 1.81 -1.26 -4.90 118.95 110.93 2eh0 s ARG 96 Ca 0.74 -1.58 -0.22 0.00 -1.72 0.00 0.00 55.73 52.95 2eh0 s ARG 96 Cb -0.04 -1.45 -0.12 0.00 -0.45 0.00 0.00 34.95 32.88 2eh0 s ARG 96 CO 0.53 0.28 1.93 0.45 -0.68 0.00 0.00 175.30 177.80 2eh0 n SER 97 N -0.19 2.82 0.00 0.23 2.88 -1.26 -2.36 113.62 115.74 2eh0 n SER 97 Ca -0.09 -2.70 0.00 0.00 -1.33 0.00 0.00 58.87 54.75 2eh0 n SER 97 Cb 0.59 -1.37 0.00 0.00 -0.75 0.00 0.00 64.21 62.68 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 5.01 1.43 3.83 0.46 0.00 -0.44 -4.89 105.19 110.59 2eh0 n GLY 98 Ca 0.48 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 46.14 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 -1.43 6.92 -0.34 1.61 2.20 -0.99 -4.85 114.94 118.05 2eh0 s ASN 99 Ca 0.00 1.19 -0.20 0.00 -0.94 0.00 0.00 52.86 52.92 2eh0 s ASN 99 Cb 0.00 -2.33 -0.00 0.00 -2.00 0.00 0.00 41.25 36.91 2eh0 s ASN 99 CO 0.00 0.11 0.60 -0.13 -2.94 0.00 0.00 177.10 174.73 2eh0 s ARG 100 N -1.84 3.74 -0.23 3.55 3.00 -1.26 -3.51 118.95 122.39 2eh0 s ARG 100 Ca 0.38 0.07 -0.05 0.00 0.00 0.00 0.00 55.73 56.13 2eh0 s ARG 100 Cb -0.16 -3.78 -0.01 0.00 0.00 0.00 0.00 34.95 30.99 2eh0 s ARG 100 CO 0.20 -0.65 -0.01 0.42 0.00 0.00 0.00 175.30 175.26 2eh0 s ILE 101 N 2.58 3.66 -0.26 1.52 1.01 -1.02 -1.49 121.20 127.21 2eh0 s ILE 101 Ca 0.23 -0.40 -0.08 0.00 0.00 0.00 0.00 60.65 60.40 2eh0 s ILE 101 Cb -0.15 -2.69 -0.03 0.00 0.01 0.00 0.00 42.46 39.61 2eh0 s ILE 101 CO 0.13 0.39 0.09 -0.63 0.00 0.00 0.00 174.94 174.93 2eh0 s ILE 102 N 1.52 4.44 -0.34 2.92 1.01 0.49 -1.39 121.20 129.85 2eh0 s ILE 102 Ca 0.06 -0.20 0.02 0.00 0.00 0.00 0.00 60.65 60.53 2eh0 s ILE 102 Cb -0.15 -3.12 0.09 0.00 0.01 0.00 0.00 42.46 39.30 2eh0 s ILE 102 CO -0.01 0.28 0.05 -0.04 0.00 0.00 0.00 174.94 175.22 2eh0 s MET 103 N 1.62 1.75 0.00 2.79 -1.94 -0.37 -1.83 119.30 121.33 2eh0 s MET 103 Ca 0.06 -1.75 0.00 0.00 -1.71 0.00 0.00 55.69 52.28 2eh0 s MET 103 Cb -0.16 -3.23 0.00 0.00 2.01 0.00 0.00 34.83 33.45 2eh0 s MET 103 CO 0.05 -0.89 0.00 0.41 -0.01 0.00 0.00 175.02 174.57 2eh0 n GLY 104 N 4.36 0.53 0.36 -0.03 0.00 -1.22 -4.32 105.19 104.88 2eh0 n GLY 104 Ca -0.01 -1.21 -0.01 0.00 0.00 0.00 0.00 46.02 44.79 2eh0 n GLY 104 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2eh0 n LYS 105 N 0.00 0.07 -3.12 1.61 3.00 -1.26 -4.75 118.16 113.71 2eh0 n LYS 105 Ca 0.00 0.03 -0.24 0.00 -0.00 0.00 0.00 58.31 58.10 2eh0 n LYS 105 Cb 0.00 -0.49 -0.05 0.00 0.00 0.00 0.00 35.03 34.49 2eh0 n LYS 105 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.40 177.67 2eh0 n ASN 106 N -2.83 2.93 -3.63 3.14 0.23 -1.26 -4.98 115.26 108.85 2eh0 n ASN 106 Ca -0.02 -3.36 -0.29 0.00 -0.53 0.00 0.00 54.58 50.38 2eh0 n ASN 106 Cb 0.07 -0.60 -0.13 0.00 -2.08 0.00 0.00 39.78 37.04 2eh0 n ASN 106 CO 0.00 0.00 0.00 -1.00 -0.93 0.00 0.00 177.26 175.33 2eh0 s HIS 107 N -2.77 1.63 0.28 -2.53 3.76 -1.26 -4.65 115.29 109.74 2eh0 s HIS 107 Ca 0.43 -2.22 0.01 0.00 -0.15 0.00 0.00 55.06 53.13 2eh0 s HIS 107 Cb 0.26 -1.58 -0.04 0.00 1.11 0.00 0.00 32.58 32.33 2eh0 s HIS 107 CO -0.10 -0.79 0.46 0.08 -0.85 0.00 0.00 174.74 173.54 2eh0 s VAL 108 N 0.48 5.16 -0.04 -0.90 1.01 -1.26 -1.23 120.40 123.62 2eh0 s VAL 108 Ca 0.19 -0.52 -0.06 0.00 0.00 0.00 0.00 61.98 61.59 2eh0 s VAL 108 Cb -0.22 -3.82 0.01 0.00 0.00 0.00 0.00 36.38 32.36 2eh0 s VAL 108 CO -0.01 -0.38 0.15 -0.36 0.00 0.00 0.00 175.10 174.50 2eh0 s PHE 109 N -2.10 -0.10 -0.29 5.22 0.08 -0.49 -3.75 117.98 116.56 2eh0 s PHE 109 Ca 0.38 0.25 -0.07 0.00 0.12 0.00 0.00 56.93 57.61 2eh0 s PHE 109 Cb -0.10 0.02 -0.00 0.00 -0.57 0.00 0.00 43.02 42.37 2eh0 s PHE 109 CO 0.32 -0.15 0.09 0.50 -0.10 0.00 0.00 175.22 175.88 2eh0 s ARG 110 N -0.41 3.29 -0.44 0.44 6.06 -0.09 -2.43 118.95 125.37 2eh0 s ARG 110 Ca -0.05 -0.73 -0.29 0.00 -2.50 0.00 0.00 55.73 52.16 2eh0 s ARG 110 Cb -0.03 -3.39 0.03 0.00 0.06 0.00 0.00 34.95 31.61 2eh0 s ARG 110 CO 0.01 -0.37 1.14 0.12 -2.50 0.00 0.00 175.30 173.69 2eh0 s PHE 111 N 1.55 2.87 -0.44 5.12 5.36 -1.23 -1.61 117.98 129.61 2eh0 s PHE 111 Ca 0.04 0.81 -0.12 0.00 -0.96 0.00 0.00 56.93 56.71 2eh0 s PHE 111 Cb -0.17 -4.28 0.07 0.00 -0.34 0.00 0.00 43.02 38.31 2eh0 s PHE 111 CO 0.03 -1.20 0.31 -0.80 -1.46 0.00 0.00 175.22 172.11 2eh0 s ASN 112 N 2.34 5.85 -0.88 6.13 -0.87 -0.94 -1.33 114.94 125.25 2eh0 s ASN 112 Ca 0.48 -1.42 -0.01 0.00 -1.57 0.00 0.00 52.86 50.34 2eh0 s ASN 112 Cb -0.08 -2.07 0.23 0.00 -0.02 0.00 0.00 41.25 39.31 2eh0 s ASN 112 CO 0.28 -0.58 0.86 1.57 -2.57 0.00 0.00 177.10 176.66 2eh0 n HIS 113 N 5.04 3.88 -0.02 2.20 -0.00 -1.26 -3.37 115.22 121.68 2eh0 n HIS 113 Ca -0.11 -3.95 -0.08 0.00 0.46 0.00 0.00 57.72 54.03 2eh0 n HIS 113 Cb 0.43 -1.05 0.08 0.00 -0.12 0.00 0.00 29.99 29.33 2eh0 n HIS 113 CO 0.00 0.00 0.00 -1.00 0.46 0.00 0.00 176.34 175.80 2eh0 h PRO 114 N 5.63 0.61 -0.77 1.57 0.13 -1.93 -2.08 132.00 135.15 2eh0 h PRO 114 Ca 0.17 -0.32 0.15 0.00 -0.87 0.00 0.00 66.00 65.14 2eh0 h PRO 114 Cb 0.76 0.01 -0.10 0.00 0.13 0.00 0.00 31.00 31.80 2eh0 h PRO 114 CO 0.91 0.91 0.30 1.49 -0.23 0.00 0.00 178.00 181.39 2eh0 h GLU 115 N 0.50 0.41 0.07 0.86 4.81 -1.89 0.30 114.58 119.64 2eh0 h GLU 115 Ca 0.04 -0.02 -0.12 0.00 -0.13 0.00 0.00 59.36 59.13 2eh0 h GLU 115 Cb 0.93 -0.09 0.01 0.00 0.63 0.00 0.00 28.75 30.23 2eh0 h GLU 115 CO 0.08 0.27 -0.55 0.37 -0.73 0.00 0.00 179.01 178.46 2eh0 h GLN 116 N 0.42 0.16 0.00 1.92 5.75 -1.89 -3.27 115.11 118.19 2eh0 h GLN 116 Ca 0.43 -0.27 0.00 0.00 -0.15 0.00 0.00 58.65 58.67 2eh0 h GLN 116 Cb 0.69 0.10 0.00 0.00 1.07 0.00 0.00 27.48 29.34 2eh0 h GLN 116 CO -0.43 1.13 0.11 0.00 -2.65 0.00 0.00 178.83 176.99 2eh0 h ALA 117 N 0.01 1.10 -0.41 3.38 0.00 -0.94 -0.85 119.26 121.54 2eh0 h ALA 117 Ca -0.11 0.00 -0.14 0.00 0.00 0.00 0.00 54.91 54.66 2eh0 h ALA 117 Cb 1.37 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.15 2eh0 h ALA 117 CO 0.06 -0.10 -0.31 0.07 0.00 0.00 0.00 179.25 178.97 2eh0 h ARG 118 N 0.00 0.92 -1.26 0.00 0.11 -0.47 -2.96 114.38 110.71 2eh0 h ARG 118 Ca 0.00 -0.44 0.37 0.00 0.10 0.00 0.00 59.98 60.01 2eh0 h ARG 118 Cb 0.23 -0.01 -0.05 0.00 1.11 0.00 0.00 29.97 31.25 2eh0 h ARG 118 CO 0.00 1.09 1.06 0.00 0.10 0.00 0.00 179.97 182.22 2eh0 h ALA 119 N 0.87 3.16 -0.62 0.08 0.00 -1.29 1.00 119.26 122.45 2eh0 h ALA 119 Ca 0.08 -0.04 -0.09 0.00 0.00 0.00 0.00 54.91 54.86 2eh0 h ALA 119 Cb 0.89 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.75 2eh0 h ALA 119 CO 0.08 -1.71 0.05 1.05 0.00 0.00 0.00 179.25 178.73 2eh0 h GLU 120 N 0.00 1.06 0.07 0.00 4.11 -1.69 -2.15 114.58 115.97 2eh0 h GLU 120 Ca 0.60 -0.30 -0.32 0.00 0.07 0.00 0.00 59.36 59.41 2eh0 h GLU 120 Cb 2.71 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 31.82 2eh0 h GLU 120 CO -0.01 1.00 -1.73 0.00 0.07 0.00 0.00 179.01 178.34 2eh0 h ARG 121 N 0.98 0.15 0.00 1.06 3.08 0.72 -3.31 114.38 117.06 2eh0 h ARG 121 Ca 0.19 -0.25 0.00 0.00 0.07 0.00 0.00 59.98 59.98 2eh0 h ARG 121 Cb 0.49 0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.63 2eh0 h ARG 121 CO 0.02 0.89 0.00 0.39 -1.07 0.00 0.00 179.97 180.20 2eh0 n GLU 122 N -3.30 0.75 0.05 0.04 -0.58 0.40 -3.66 120.64 114.35 2eh0 n GLU 122 Ca -0.21 0.00 -0.03 0.00 -0.42 0.00 0.00 57.16 56.50 2eh0 n GLU 122 Cb 1.05 -1.28 -0.02 0.00 -0.57 0.00 0.00 31.44 30.62 2eh0 n GLU 122 CO 0.00 0.00 0.00 -0.22 -0.48 0.00 0.00 177.13 176.43 2eh0 h LYS 123 N 0.00 -0.21 0.00 3.49 3.64 -1.48 -3.29 116.57 118.72 2eh0 h LYS 123 Ca 0.00 0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 2eh0 h LYS 123 Cb 0.00 0.05 0.00 0.00 -0.41 0.00 0.00 32.23 31.87 2eh0 h LYS 123 CO 0.00 -0.14 0.00 0.00 -2.27 0.00 0.00 179.45 177.04 2eh0 h THR 124 N -0.88 0.00 -3.73 1.00 1.03 -1.79 -3.42 112.91 105.11 2eh0 h THR 124 Ca -0.02 -0.10 -0.49 0.00 -0.01 0.00 0.00 66.41 65.78 2eh0 h THR 124 Cb 0.17 0.93 -0.03 0.00 -1.07 0.00 0.00 68.15 68.15 2eh0 h THR 124 CO 0.04 0.00 0.16 -0.94 -0.01 0.00 0.00 175.52 174.77 2eh0 s SER 125 N -4.83 6.97 0.36 0.00 1.04 -1.24 -5.08 113.70 110.91 2eh0 s SER 125 Ca -0.02 1.45 0.05 0.00 0.48 0.00 0.00 55.95 57.91 2eh0 s SER 125 Cb 0.10 -2.44 -0.07 0.00 0.10 0.00 0.00 66.02 63.72 2eh0 s SER 125 CO 0.37 -0.12 0.04 -0.83 0.98 0.00 0.00 173.24 173.68 2eh0 s GLY 126 N -1.95 2.24 0.95 7.32 0.00 -1.26 -4.95 107.32 109.66 2eh0 s GLY 126 Ca 0.51 -2.12 -0.12 0.00 0.00 0.00 0.00 44.72 42.99 2eh0 s GLY 126 CO 0.19 -1.92 1.09 2.56 0.00 0.00 0.00 173.10 175.03 2eh0 s PRO 127 N -3.83 0.86 0.05 2.90 0.04 -1.26 -5.06 135.00 128.70 2eh0 s PRO 127 Ca 0.36 0.67 0.04 0.00 0.04 0.00 0.00 61.00 62.11 2eh0 s PRO 127 Cb 0.09 -1.77 -0.04 0.00 0.04 0.00 0.00 34.50 32.82 2eh0 s PRO 127 CO 0.16 -2.48 -0.04 -1.54 0.04 0.00 0.00 177.00 173.15 2eh0 s SER 128 N -3.44 4.82 0.22 6.66 1.04 -1.26 -5.12 113.70 116.63 2eh0 s SER 128 Ca 0.64 -0.18 -0.23 0.00 0.48 0.00 0.00 55.95 56.67 2eh0 s SER 128 Cb -0.18 -1.13 0.04 0.00 0.10 0.00 0.00 66.02 64.86 2eh0 s SER 128 CO 0.57 0.22 0.85 -0.44 0.98 0.00 0.00 173.24 175.42 2eh0 s SER 129 N -1.91 -0.20 0.00 7.02 0.01 -1.26 -5.19 113.70 112.17 2eh0 s SER 129 Ca 0.22 -0.54 0.00 0.00 1.31 0.00 0.00 55.95 56.93 2eh0 s SER 129 Cb -0.11 0.61 0.00 0.00 0.21 0.00 0.00 66.02 66.73 2eh0 s SER 129 CO 0.13 -1.14 0.00 0.61 0.41 0.00 0.00 173.24 173.25