#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1za2 s ALA 11 N 0.00 -2.65 0.23 4.31 0.00 -1.26 -5.15 121.76 117.24 1za2 s ALA 11 Ca 0.00 0.08 -0.09 0.00 0.00 0.00 0.00 51.96 51.95 1za2 s ALA 11 Cb 0.00 -2.78 -0.07 0.00 0.00 0.00 0.00 23.12 20.27 1za2 s ALA 11 CO 0.00 -2.28 -0.03 0.44 0.00 0.00 0.00 175.76 173.88 1za2 n ILE 12 N 3.55 0.08 0.11 0.00 -5.35 -1.26 -4.87 119.36 111.63 1za2 n ILE 12 Ca 0.14 -0.24 -0.05 0.00 -0.27 0.00 0.00 62.75 62.33 1za2 n ILE 12 Cb 0.58 0.00 -0.02 0.00 -1.74 0.00 0.00 39.64 38.46 1za2 n ILE 12 CO 0.00 0.00 0.00 0.11 -1.76 0.00 0.00 176.55 174.90 1za2 h LYS 13 N 0.04 -0.29 -4.25 6.28 1.57 -1.96 -3.38 116.57 114.59 1za2 h LYS 13 Ca -0.19 0.02 -0.29 0.00 -1.87 0.00 0.00 60.65 58.32 1za2 h LYS 13 Cb 0.71 0.07 -0.26 0.00 0.08 0.00 0.00 32.23 32.82 1za2 h LYS 13 CO 0.21 -0.19 -0.74 -0.98 -0.57 0.00 0.00 179.45 177.18 1za2 s ARG 14 N -2.90 0.37 0.00 3.15 1.70 -1.26 -0.39 118.95 119.62 1za2 s ARG 14 Ca -0.04 -0.32 0.00 0.00 -0.47 0.00 0.00 55.73 54.90 1za2 s ARG 14 Cb 0.00 -0.28 0.00 0.00 -0.57 0.00 0.00 34.95 34.11 1za2 s ARG 14 CO 0.13 0.07 0.00 0.41 -1.08 0.00 0.00 175.30 174.83 1za2 n GLY 15 N 2.54 -0.28 3.40 3.88 0.00 0.99 -0.05 105.19 115.67 1za2 n GLY 15 Ca -0.16 -1.23 -0.29 0.00 0.00 0.00 0.00 46.02 44.34 1za2 n GLY 15 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1za2 s THR 16 N -3.00 2.35 -0.08 2.61 2.01 0.47 -0.86 115.64 119.13 1za2 s THR 16 Ca 0.00 -1.69 -0.01 0.00 0.31 0.00 0.00 61.69 60.30 1za2 s THR 16 Cb 0.00 -2.04 0.03 0.00 0.01 0.00 0.00 72.50 70.49 1za2 s THR 16 CO 0.00 0.11 -0.04 -0.69 -0.69 0.00 0.00 174.62 173.31 1za2 s VAL 17 N -1.06 0.65 -0.44 3.82 1.01 -0.05 -0.08 120.40 124.25 1za2 s VAL 17 Ca 0.15 -0.07 -0.11 0.00 0.00 0.00 0.00 61.98 61.94 1za2 s VAL 17 Cb -0.10 -0.73 0.08 0.00 0.00 0.00 0.00 36.38 35.63 1za2 s VAL 17 CO 0.06 0.30 0.31 -0.63 0.00 0.00 0.00 175.10 175.14 1za2 s ILE 18 N 1.69 4.52 0.29 2.22 1.01 0.11 0.62 121.20 131.65 1za2 s ILE 18 Ca 0.02 -1.36 0.06 0.00 0.00 0.00 0.00 60.65 59.36 1za2 s ILE 18 Cb -0.13 -3.78 -0.02 0.00 0.01 0.00 0.00 42.46 38.54 1za2 s ILE 18 CO -0.05 -0.57 0.42 -0.62 0.00 0.00 0.00 174.94 174.12 1za2 s ASP 19 N 2.37 6.15 -1.19 3.58 -1.08 0.21 -1.96 116.67 124.74 1za2 s ASP 19 Ca 0.04 -0.04 -0.04 0.00 -0.52 0.00 0.00 52.55 51.98 1za2 s ASP 19 Cb -0.24 -1.56 -0.02 0.00 -1.46 0.00 0.00 42.92 39.64 1za2 s ASP 19 CO 0.03 -0.26 0.85 1.41 0.52 0.00 0.00 175.17 177.72 1za2 n HIS 20 N -1.54 -2.12 -3.39 -5.34 8.25 -1.26 -0.79 115.22 109.03 1za2 n HIS 20 Ca -0.05 0.82 -0.39 0.00 -0.26 0.00 0.00 57.72 57.85 1za2 n HIS 20 Cb 0.57 -4.39 -0.09 0.00 1.12 0.00 0.00 29.99 27.20 1za2 n HIS 20 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1za2 s ILE 21 N -3.49 5.18 0.46 1.59 1.01 -0.96 -3.33 121.20 121.66 1za2 s ILE 21 Ca 0.18 0.59 -0.25 0.00 0.00 0.00 0.00 60.65 61.17 1za2 s ILE 21 Cb -0.04 -3.70 -0.08 0.00 0.01 0.00 0.00 42.46 38.65 1za2 s ILE 21 CO 0.78 0.17 1.42 -0.81 0.00 0.00 0.00 174.94 176.50 1za2 n PRO 22 N 5.22 2.16 -1.54 2.79 -0.04 -1.26 0.11 135.00 142.43 1za2 n PRO 22 Ca -0.08 0.77 -0.51 0.00 -0.04 0.00 0.00 63.50 63.64 1za2 n PRO 22 Cb 0.51 -2.62 -0.05 0.00 -0.04 0.00 0.00 33.50 31.30 1za2 n PRO 22 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1za2 n ALA 23 N -0.33 -1.51 -1.06 0.55 0.00 -1.26 -2.00 120.51 114.89 1za2 n ALA 23 Ca 0.06 0.49 -0.02 0.00 0.00 0.00 0.00 53.44 53.96 1za2 n ALA 23 Cb 0.42 -1.94 -0.01 0.00 0.00 0.00 0.00 19.45 17.92 1za2 n ALA 23 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1za2 n GLN 24 N 1.66 -0.31 -0.01 0.00 1.13 -1.26 -4.87 117.38 113.72 1za2 n GLN 24 Ca 0.16 0.41 0.02 0.00 -1.94 0.00 0.00 57.00 55.64 1za2 n GLN 24 Cb 0.22 -3.90 -0.04 0.00 0.11 0.00 0.00 30.24 26.62 1za2 n GLN 24 CO 0.00 0.00 0.00 -0.89 -1.44 0.00 0.00 177.06 174.73 1za2 n ILE 25 N -2.86 0.08 -0.37 5.09 2.08 -0.85 -4.51 119.36 118.02 1za2 n ILE 25 Ca -0.02 -0.14 -0.01 0.00 0.56 0.00 0.00 62.75 63.13 1za2 n ILE 25 Cb 0.11 0.11 0.12 0.00 -0.75 0.00 0.00 39.64 39.23 1za2 n ILE 25 CO 0.00 0.00 0.00 1.23 0.56 0.00 0.00 176.55 178.34 1za2 h GLY 26 N 1.00 1.42 0.55 7.39 0.00 -1.90 -0.94 103.07 110.60 1za2 h GLY 26 Ca -0.03 -0.52 -0.00 0.00 0.00 0.00 0.00 47.33 46.78 1za2 h GLY 26 CO 0.00 0.48 -0.00 -2.75 0.00 0.00 0.00 176.54 174.28 1za2 h PHE 27 N 1.32 0.01 -0.52 5.60 3.57 -1.96 -2.42 116.94 122.55 1za2 h PHE 27 Ca 0.38 -0.00 0.10 0.00 3.53 0.00 0.00 57.97 61.98 1za2 h PHE 27 Cb -0.11 -0.00 -0.10 0.00 2.79 0.00 0.00 35.95 38.53 1za2 h PHE 27 CO -0.00 0.46 -0.22 0.87 -2.23 0.00 0.00 178.31 177.19 1za2 h LYS 28 N -0.45 -0.09 -0.63 1.11 1.57 -1.73 0.15 116.57 116.50 1za2 h LYS 28 Ca 0.00 0.01 0.09 0.00 -1.87 0.00 0.00 60.65 58.87 1za2 h LYS 28 Cb 0.45 0.02 -0.07 0.00 0.08 0.00 0.00 32.23 32.72 1za2 h LYS 28 CO 0.00 -0.06 0.28 -0.07 -0.57 0.00 0.00 179.45 179.02 1za2 h LEU 29 N -0.10 0.33 -1.12 2.94 3.38 -1.14 0.35 115.31 119.95 1za2 h LEU 29 Ca 0.24 0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.26 1za2 h LEU 29 Cb 0.47 0.02 -0.04 0.00 0.09 0.00 0.00 40.66 41.20 1za2 h LEU 29 CO -0.58 0.19 0.41 -0.07 0.09 0.00 0.00 178.44 178.48 1za2 h LEU 30 N 0.49 0.91 0.17 1.67 3.38 -0.47 -2.25 115.31 119.21 1za2 h LEU 30 Ca 0.31 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.20 1za2 h LEU 30 Cb 0.35 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.87 1za2 h LEU 30 CO -0.28 0.73 -0.08 0.28 0.09 0.00 0.00 178.44 179.18 1za2 h SER 31 N 1.03 -0.19 -1.00 -0.43 0.02 0.13 -2.59 113.55 110.50 1za2 h SER 31 Ca 0.26 0.01 0.15 0.00 -0.84 0.00 0.00 61.79 61.37 1za2 h SER 31 Cb 0.02 0.05 -0.09 0.00 0.14 0.00 0.00 62.40 62.51 1za2 h SER 31 CO -0.04 -0.01 0.62 -0.07 -1.14 0.00 0.00 176.83 176.19 1za2 h LEU 32 N -0.48 0.86 -2.96 5.07 3.38 -0.48 -2.54 115.31 118.17 1za2 h LEU 32 Ca -0.02 0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.02 1za2 h LEU 32 Cb 0.17 -0.10 0.00 0.00 0.09 0.00 0.00 40.66 40.83 1za2 h LEU 32 CO 0.04 0.39 0.00 0.49 0.09 0.00 0.00 178.44 179.45 1za2 n PHE 33 N -4.68 0.98 -4.17 1.13 3.01 -0.85 -4.86 117.46 108.01 1za2 n PHE 33 Ca 0.21 -0.57 -0.29 0.00 1.01 0.00 0.00 57.45 57.81 1za2 n PHE 33 Cb 0.46 -0.11 -0.07 0.00 -0.01 0.00 0.00 39.48 39.75 1za2 n PHE 33 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 1za2 n LYS 34 N 0.95 -1.87 0.24 -1.08 5.02 -0.96 -4.84 118.16 115.64 1za2 n LYS 34 Ca 0.21 0.21 0.13 0.00 -2.02 0.00 0.00 58.31 56.84 1za2 n LYS 34 Cb 0.67 -3.95 0.57 0.00 -0.02 0.00 0.00 35.03 32.30 1za2 n LYS 34 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 1za2 h LEU 35 N -1.81 0.00 -1.18 -0.35 3.38 -1.70 -2.87 115.31 110.78 1za2 h LEU 35 Ca -0.65 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.32 1za2 h LEU 35 Cb 1.39 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.14 1za2 h LEU 35 CO 0.68 0.14 0.00 0.35 0.09 0.00 0.00 178.44 179.70 1za2 n THR 36 N -3.33 0.43 -2.15 0.22 -2.24 -1.26 -4.48 114.28 101.48 1za2 n THR 36 Ca 0.00 -0.43 -0.38 0.00 -2.27 0.00 0.00 64.05 60.97 1za2 n THR 36 Cb 0.37 0.21 0.00 0.00 -2.10 0.00 0.00 70.33 68.81 1za2 n THR 36 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1za2 n GLU 37 N 0.44 4.33 -4.13 -0.78 1.02 -1.09 -4.92 120.64 115.51 1za2 n GLU 37 Ca 0.11 -3.75 -0.16 0.00 -0.02 0.00 0.00 57.16 53.33 1za2 n GLU 37 Cb 0.27 -2.45 -0.05 0.00 -0.02 0.00 0.00 31.44 29.19 1za2 n GLU 37 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 1za2 s THR 38 N -3.06 0.00 -0.46 2.62 -4.23 -1.26 -5.04 115.64 104.21 1za2 s THR 38 Ca 0.49 -1.69 0.22 0.00 -1.18 0.00 0.00 61.69 59.53 1za2 s THR 38 Cb 0.25 -2.62 -0.28 0.00 1.34 0.00 0.00 72.50 71.19 1za2 s THR 38 CO -0.17 0.00 0.68 0.47 -0.54 0.00 0.00 174.62 175.06 1za2 n ASP 39 N -1.48 0.45 -4.77 3.99 8.00 -1.26 -4.97 116.55 116.50 1za2 n ASP 39 Ca 0.02 -0.42 -0.41 0.00 0.71 0.00 0.00 54.79 54.69 1za2 n ASP 39 Cb 0.62 1.52 -0.01 0.00 -0.02 0.00 0.00 41.12 43.23 1za2 n ASP 39 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1za2 s GLN 40 N -3.29 4.20 0.06 -1.24 -1.52 -1.26 -4.91 119.66 111.70 1za2 s GLN 40 Ca -0.01 2.44 -0.30 0.00 -1.95 0.00 0.00 55.36 55.54 1za2 s GLN 40 Cb 0.15 -3.02 -0.09 0.00 -0.22 0.00 0.00 33.01 29.83 1za2 s GLN 40 CO 0.89 -0.43 1.85 0.50 -0.25 0.00 0.00 175.29 177.85 1za2 s ARG 41 N -1.69 4.15 -0.02 2.91 3.52 -1.26 -4.86 118.95 121.71 1za2 s ARG 41 Ca 0.53 2.54 0.05 0.00 -0.13 0.00 0.00 55.73 58.72 1za2 s ARG 41 Cb -0.44 -3.87 -0.03 0.00 -1.56 0.00 0.00 34.95 29.05 1za2 s ARG 41 CO 0.57 -0.88 -0.16 0.42 -0.81 0.00 0.00 175.30 174.44 1za2 s ILE 42 N 3.57 2.91 -0.09 4.11 1.01 -1.26 -2.44 121.20 129.01 1za2 s ILE 42 Ca 0.83 -0.90 0.02 0.00 0.00 0.00 0.00 60.65 60.60 1za2 s ILE 42 Cb -0.43 -2.16 0.01 0.00 0.01 0.00 0.00 42.46 39.89 1za2 s ILE 42 CO 0.37 0.50 -0.15 -0.89 0.00 0.00 0.00 174.94 174.78 1za2 s THR 43 N -0.79 1.43 0.03 2.92 2.01 -0.31 -4.99 115.64 115.93 1za2 s THR 43 Ca 0.13 -0.63 0.06 0.00 0.31 0.00 0.00 61.69 61.56 1za2 s THR 43 Cb -0.11 -1.30 -0.02 0.00 0.01 0.00 0.00 72.50 71.09 1za2 s THR 43 CO 0.02 0.42 -0.19 -0.63 -0.69 0.00 0.00 174.62 173.56 1za2 s ILE 44 N 0.78 1.49 -0.10 1.82 1.01 -1.26 0.09 121.20 125.03 1za2 s ILE 44 Ca -0.11 -1.05 -0.02 0.00 0.00 0.00 0.00 60.65 59.47 1za2 s ILE 44 Cb -0.16 -1.29 0.03 0.00 0.01 0.00 0.00 42.46 41.05 1za2 s ILE 44 CO 0.02 0.21 -0.00 -0.83 0.00 0.00 0.00 174.94 174.34 1za2 s GLY 45 N -0.98 0.57 -0.08 6.18 0.00 0.16 -4.98 107.32 108.18 1za2 s GLY 45 Ca 0.06 -0.30 0.02 0.00 0.00 0.00 0.00 44.72 44.50 1za2 s GLY 45 CO 0.01 1.16 -0.14 1.08 0.00 0.00 0.00 173.10 175.21 1za2 s LEU 46 N 1.92 2.71 -1.29 0.66 1.43 -1.26 0.82 118.68 123.66 1za2 s LEU 46 Ca 0.04 -0.26 -0.02 0.00 -1.03 0.00 0.00 54.13 52.85 1za2 s LEU 46 Cb -0.13 -1.57 0.00 0.00 0.03 0.00 0.00 46.19 44.52 1za2 s LEU 46 CO -0.06 0.27 0.31 0.59 0.23 0.00 0.00 176.35 177.68 1za2 n ASN 47 N 2.84 -5.06 -4.83 2.29 3.02 -1.25 -4.97 115.26 107.31 1za2 n ASN 47 Ca -0.18 -0.15 -0.33 0.00 -0.03 0.00 0.00 54.58 53.90 1za2 n ASN 47 Cb 0.52 -4.00 -0.06 0.00 -0.61 0.00 0.00 39.78 35.64 1za2 n ASN 47 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1za2 s LEU 48 N -5.12 3.85 -0.04 3.41 1.43 -0.94 -4.66 118.68 116.61 1za2 s LEU 48 Ca 0.15 1.63 -0.30 0.00 -1.03 0.00 0.00 54.13 54.59 1za2 s LEU 48 Cb -0.07 -4.51 -0.05 0.00 0.03 0.00 0.00 46.19 41.60 1za2 s LEU 48 CO 0.19 -0.42 1.45 -2.16 0.23 0.00 0.00 176.35 175.63 1za2 s PRO 49 N -3.45 4.24 -0.13 1.29 0.04 -1.25 -0.29 135.00 135.44 1za2 s PRO 49 Ca 0.61 1.98 -0.07 0.00 0.04 0.00 0.00 61.00 63.55 1za2 s PRO 49 Cb -0.09 -3.71 -0.25 0.00 0.04 0.00 0.00 34.50 30.48 1za2 s PRO 49 CO 0.19 -0.67 0.33 0.45 0.04 0.00 0.00 177.00 177.33 1za2 n SER 50 N 6.05 2.11 0.00 6.66 2.88 0.19 -4.89 113.62 126.62 1za2 n SER 50 Ca 0.14 0.21 0.00 0.00 -1.33 0.00 0.00 58.87 57.89 1za2 n SER 50 Cb 0.44 -0.85 0.00 0.00 -0.75 0.00 0.00 64.21 63.05 1za2 n SER 50 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1za2 n GLY 51 N 1.97 1.83 1.41 0.46 0.00 -1.26 -4.89 105.19 104.73 1za2 n GLY 51 Ca -0.33 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 45.52 1za2 n GLY 51 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1za2 n GLU 52 N 0.00 0.00 0.00 1.61 0.00 -1.26 -4.79 120.64 116.20 1za2 n GLU 52 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.16 57.16 1za2 n GLU 52 Cb 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 31.44 31.28 1za2 n GLU 52 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 177.13 177.01 1za2 n MET 53 N -2.25 0.78 0.00 3.44 0.00 -1.26 -4.89 117.12 112.93 1za2 n MET 53 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.70 1za2 n MET 53 Cb 0.02 -1.25 0.00 0.00 0.00 0.00 0.00 33.22 31.99 1za2 n MET 53 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1za2 n GLY 54 N 0.17 0.89 3.39 -5.12 0.00 -1.26 -4.65 105.19 98.61 1za2 n GLY 54 Ca 0.00 0.46 -0.24 0.00 0.00 0.00 0.00 46.02 46.24 1za2 n GLY 54 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1za2 s ARG 55 N 0.00 1.43 -0.02 1.61 0.52 -1.25 0.55 118.95 121.80 1za2 s ARG 55 Ca 0.00 -1.51 -0.27 0.00 -0.52 0.00 0.00 55.73 53.43 1za2 s ARG 55 Cb 0.00 -1.61 0.06 0.00 0.52 0.00 0.00 34.95 33.92 1za2 s ARG 55 CO 0.00 0.33 0.60 -1.59 0.02 0.00 0.00 175.30 174.66 1za2 s LYS 56 N -2.84 1.01 0.47 3.54 0.00 0.60 -4.34 119.74 118.18 1za2 s LYS 56 Ca 0.20 0.08 -0.11 0.00 0.00 0.00 0.00 55.97 56.13 1za2 s LYS 56 Cb -0.07 0.47 -0.06 0.00 0.00 0.00 0.00 37.83 38.17 1za2 s LYS 56 CO 0.09 -0.33 0.85 -0.51 0.00 0.00 0.00 175.35 175.46 1za2 s ASP 57 N -1.41 6.48 -0.07 0.03 1.01 0.29 -2.21 116.67 120.79 1za2 s ASP 57 Ca -0.10 1.24 -0.03 0.00 0.71 0.00 0.00 52.55 54.37 1za2 s ASP 57 Cb -0.01 -2.37 0.04 0.00 1.01 0.00 0.00 42.92 41.59 1za2 s ASP 57 CO 0.06 -0.52 0.16 -0.22 0.21 0.00 0.00 175.17 174.86 1za2 s LEU 58 N -4.17 0.62 -0.05 1.23 1.98 0.24 -2.27 118.68 116.27 1za2 s LEU 58 Ca 0.53 0.32 0.05 0.00 -2.89 0.00 0.00 54.13 52.14 1za2 s LEU 58 Cb -0.10 0.38 -0.01 0.00 0.66 0.00 0.00 46.19 47.13 1za2 s LEU 58 CO 0.36 -0.16 -0.19 -0.63 -1.89 0.00 0.00 176.35 173.84 1za2 s ILE 59 N 1.29 1.57 -0.08 6.68 1.01 -0.83 0.36 121.20 131.20 1za2 s ILE 59 Ca -0.08 -0.80 0.04 0.00 0.00 0.00 0.00 60.65 59.81 1za2 s ILE 59 Cb -0.12 -1.34 0.00 0.00 0.01 0.00 0.00 42.46 41.01 1za2 s ILE 59 CO -0.06 0.45 -0.20 -0.54 0.00 0.00 0.00 174.94 174.58 1za2 s LYS 60 N -0.03 2.49 -0.26 2.79 1.02 0.11 0.04 119.74 125.91 1za2 s LYS 60 Ca -0.03 -0.73 -0.02 0.00 0.02 0.00 0.00 55.97 55.21 1za2 s LYS 60 Cb -0.12 -1.96 0.08 0.00 -0.52 0.00 0.00 37.83 35.31 1za2 s LYS 60 CO 0.02 0.17 0.07 0.42 -0.92 0.00 0.00 175.35 175.12 1za2 s ILE 61 N 0.32 0.68 0.53 2.17 1.01 0.89 -1.17 121.20 125.64 1za2 s ILE 61 Ca -0.14 -1.03 -0.20 0.00 0.00 0.00 0.00 60.65 59.28 1za2 s ILE 61 Cb -0.16 -1.38 -0.06 0.00 0.01 0.00 0.00 42.46 40.87 1za2 s ILE 61 CO 0.06 -0.49 1.14 -1.61 0.00 0.00 0.00 174.94 174.04 1za2 s GLU 62 N 1.74 3.40 -1.31 2.79 2.02 -1.02 -0.40 118.70 125.92 1za2 s GLU 62 Ca 0.05 1.66 -0.06 0.00 0.02 0.00 0.00 54.97 56.65 1za2 s GLU 62 Cb -0.17 -2.07 0.04 0.00 0.10 0.00 0.00 34.13 32.02 1za2 s GLU 62 CO -0.20 -0.82 0.39 0.09 0.02 0.00 0.00 175.26 174.73 1za2 n ASN 63 N -1.17 -4.42 -3.72 -0.19 3.02 0.92 -4.62 115.26 105.08 1za2 n ASN 63 Ca 0.11 -0.21 -0.12 0.00 -0.03 0.00 0.00 54.58 54.33 1za2 n ASN 63 Cb 0.50 -3.65 -0.13 0.00 -0.61 0.00 0.00 39.78 35.90 1za2 n ASN 63 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 1za2 s THR 64 N -2.92 -0.05 0.15 3.41 2.01 -1.22 -5.00 115.64 112.03 1za2 s THR 64 Ca 0.27 0.14 0.06 0.00 0.31 0.00 0.00 61.69 62.47 1za2 s THR 64 Cb -0.13 -0.42 -0.04 0.00 0.01 0.00 0.00 72.50 71.92 1za2 s THR 64 CO 0.33 0.06 -0.12 -0.36 -0.69 0.00 0.00 174.62 173.83 1za2 s PHE 65 N 1.31 1.41 0.03 4.92 0.40 -1.26 -2.22 117.98 122.56 1za2 s PHE 65 Ca -0.09 -0.65 0.08 0.00 -0.60 0.00 0.00 56.93 55.67 1za2 s PHE 65 Cb -0.10 -0.70 -0.03 0.00 0.51 0.00 0.00 43.02 42.70 1za2 s PHE 65 CO -0.09 0.17 -0.23 -0.51 0.70 0.00 0.00 175.22 175.26 1za2 s LEU 66 N -2.96 2.35 0.84 -0.37 1.43 -1.26 -5.09 118.68 113.62 1za2 s LEU 66 Ca 0.15 -0.49 -0.12 0.00 -1.03 0.00 0.00 54.13 52.65 1za2 s LEU 66 Cb -0.01 -1.39 0.09 0.00 0.03 0.00 0.00 46.19 44.91 1za2 s LEU 66 CO 0.03 0.27 1.11 -0.94 0.23 0.00 0.00 176.35 177.05 1za2 s SER 67 N -1.20 4.14 0.26 2.29 1.04 -1.26 -4.83 113.70 114.14 1za2 s SER 67 Ca 0.13 1.22 0.23 0.00 0.48 0.00 0.00 55.95 58.01 1za2 s SER 67 Cb -0.10 -1.91 0.99 0.00 0.10 0.00 0.00 66.02 65.10 1za2 s SER 67 CO 0.03 -2.18 1.69 -1.84 0.98 0.00 0.00 173.24 171.92 1za2 n GLU 68 N -3.56 0.18 0.09 4.02 0.28 -1.26 -1.53 120.64 118.86 1za2 n GLU 68 Ca 0.07 0.44 -0.23 0.00 -0.16 0.00 0.00 57.16 57.28 1za2 n GLU 68 Cb 0.57 -1.87 -0.15 0.00 1.43 0.00 0.00 31.44 31.42 1za2 n GLU 68 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 177.13 176.53 1za2 h ASP 69 N 0.00 0.65 -0.46 -1.84 5.19 -1.98 -1.45 116.42 116.53 1za2 h ASP 69 Ca 0.00 -0.92 -0.03 0.00 -0.62 0.00 0.00 57.03 55.46 1za2 h ASP 69 Cb 0.32 -0.21 -0.02 0.00 0.18 0.00 0.00 39.33 39.59 1za2 h ASP 69 CO 0.00 1.71 0.20 1.56 -3.12 0.00 0.00 179.24 179.59 1za2 h GLN 70 N 0.02 0.72 -0.08 3.56 4.20 -1.68 -2.18 115.11 119.67 1za2 h GLN 70 Ca -0.30 -0.10 -0.11 0.00 0.06 0.00 0.00 58.65 58.20 1za2 h GLN 70 Cb 2.04 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 29.69 1za2 h GLN 70 CO 0.19 0.60 -0.38 0.28 -0.67 0.00 0.00 178.83 178.85 1za2 h VAL 71 N 0.72 1.40 -0.59 -0.54 2.07 -1.34 -3.10 116.25 114.87 1za2 h VAL 71 Ca 0.17 -1.76 0.17 0.00 0.82 0.00 0.00 66.70 66.10 1za2 h VAL 71 Cb 0.15 2.28 -0.02 0.00 -1.52 0.00 0.00 31.29 32.17 1za2 h VAL 71 CO -0.02 0.51 0.45 0.44 0.02 0.00 0.00 177.57 178.97 1za2 h ASP 72 N -0.06 0.00 0.19 0.57 5.19 -0.89 0.22 116.42 121.65 1za2 h ASP 72 Ca -0.02 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.39 1za2 h ASP 72 Cb 1.03 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.54 1za2 h ASP 72 CO 0.08 0.00 0.00 0.00 -3.12 0.00 0.00 179.24 176.20 1za2 n GLN 73 N -4.25 0.11 0.06 3.56 1.13 -0.85 -1.55 117.38 115.58 1za2 n GLN 73 Ca 0.11 0.23 0.11 0.00 -1.94 0.00 0.00 57.00 55.51 1za2 n GLN 73 Cb 0.68 -1.50 -0.04 0.00 0.11 0.00 0.00 30.24 29.50 1za2 n GLN 73 CO 0.00 0.00 0.00 1.28 -1.44 0.00 0.00 177.06 176.90 1za2 n LEU 74 N -1.32 0.59 -0.37 1.08 4.77 0.79 -4.53 117.00 118.00 1za2 n LEU 74 Ca 0.04 0.19 -0.01 0.00 -0.03 0.00 0.00 56.01 56.20 1za2 n LEU 74 Cb 0.08 -0.05 0.04 0.00 -2.33 0.00 0.00 43.42 41.16 1za2 n LEU 74 CO 0.07 -0.10 0.57 0.00 -1.33 0.00 0.00 177.39 176.60 1za2 n ALA 75 N -2.14 -0.11 0.15 -1.18 0.00 -0.59 0.12 120.51 116.75 1za2 n ALA 75 Ca -0.01 0.97 0.04 0.00 0.00 0.00 0.00 53.44 54.44 1za2 n ALA 75 Cb 0.54 -0.44 0.45 0.00 0.00 0.00 0.00 19.45 20.00 1za2 n ALA 75 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 1za2 h LEU 76 N 0.00 0.17 0.02 0.00 3.38 -1.81 -2.81 115.31 114.26 1za2 h LEU 76 Ca 0.34 -0.03 -0.33 0.00 0.09 0.00 0.00 57.88 57.95 1za2 h LEU 76 Cb 0.58 -0.04 -0.04 0.00 0.09 0.00 0.00 40.66 41.25 1za2 h LEU 76 CO -0.97 0.28 -1.83 -1.22 0.09 0.00 0.00 178.44 174.79 1za2 n TYR 77 N -4.34 0.69 -3.51 1.13 4.01 -0.19 -4.77 117.16 110.16 1za2 n TYR 77 Ca -0.01 0.26 -0.27 0.00 -0.16 0.00 0.00 57.90 57.72 1za2 n TYR 77 Cb 0.21 -1.07 -0.10 0.00 -0.31 0.00 0.00 39.34 38.07 1za2 n TYR 77 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1za2 n ALA 78 N -3.58 3.16 -0.13 -0.72 0.00 0.12 -4.80 120.51 114.56 1za2 n ALA 78 Ca -0.40 -3.89 -0.09 0.00 0.00 0.00 0.00 53.44 49.06 1za2 n ALA 78 Cb 0.82 -0.87 -0.01 0.00 0.00 0.00 0.00 19.45 19.39 1za2 n ALA 78 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1za2 h PRO 79 N 4.98 0.55 0.00 0.00 0.13 -1.64 -2.63 132.00 133.40 1za2 h PRO 79 Ca 0.18 -0.09 0.00 0.00 -0.87 0.00 0.00 66.00 65.22 1za2 h PRO 79 Cb 0.81 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 31.85 1za2 h PRO 79 CO 0.58 0.51 0.00 1.04 -0.23 0.00 0.00 178.00 179.90 1za2 n GLN 80 N -4.69 0.42 -0.72 0.86 1.13 -1.26 -4.48 117.38 108.63 1za2 n GLN 80 Ca -0.00 0.03 -0.32 0.00 -1.94 0.00 0.00 57.00 54.77 1za2 n GLN 80 Cb 0.13 -1.50 0.15 0.00 0.11 0.00 0.00 30.24 29.13 1za2 n GLN 80 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1za2 n ALA 81 N -1.26 -2.23 -3.79 -1.58 0.00 -0.99 -4.89 120.51 105.77 1za2 n ALA 81 Ca 0.13 -0.70 -0.24 0.00 0.00 0.00 0.00 53.44 52.63 1za2 n ALA 81 Cb 0.20 -1.91 -0.17 0.00 0.00 0.00 0.00 19.45 17.57 1za2 n ALA 81 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1za2 s THR 82 N -2.46 0.48 -0.21 0.00 2.01 0.03 -4.32 115.64 111.17 1za2 s THR 82 Ca 0.61 0.00 -0.16 0.00 0.31 0.00 0.00 61.69 62.44 1za2 s THR 82 Cb -0.21 -0.65 -0.04 0.00 0.01 0.00 0.00 72.50 71.61 1za2 s THR 82 CO 0.64 0.23 0.43 -0.69 -0.69 0.00 0.00 174.62 174.55 1za2 s VAL 83 N 1.92 5.17 -0.17 3.82 1.01 -0.06 -0.62 120.40 131.47 1za2 s VAL 83 Ca 0.04 0.76 -0.03 0.00 0.00 0.00 0.00 61.98 62.75 1za2 s VAL 83 Cb -0.13 -3.76 -0.02 0.00 0.00 0.00 0.00 36.38 32.48 1za2 s VAL 83 CO -0.06 0.21 -0.06 0.20 0.00 0.00 0.00 175.10 175.40 1za2 s ASN 84 N 1.16 4.46 -0.25 3.32 0.01 0.20 -1.35 114.94 122.50 1za2 s ASN 84 Ca 0.20 -0.27 -0.18 0.00 -0.71 0.00 0.00 52.86 51.90 1za2 s ASN 84 Cb -0.15 -1.73 -0.03 0.00 0.41 0.00 0.00 41.25 39.75 1za2 s ASN 84 CO 0.09 0.10 0.54 -0.13 -1.51 0.00 0.00 177.10 176.18 1za2 s ARG 85 N 0.77 4.10 -0.19 -0.60 0.52 0.88 -0.87 118.95 123.56 1za2 s ARG 85 Ca -0.02 0.38 0.01 0.00 -0.52 0.00 0.00 55.73 55.58 1za2 s ARG 85 Cb -0.15 -3.63 0.02 0.00 0.52 0.00 0.00 34.95 31.72 1za2 s ARG 85 CO 0.02 -0.32 -0.19 0.42 0.02 0.00 0.00 175.30 175.25 1za2 s ILE 86 N 2.20 2.07 -0.05 1.52 1.09 -0.04 -1.64 121.20 126.34 1za2 s ILE 86 Ca 0.23 -1.01 0.03 0.00 -1.10 0.00 0.00 60.65 58.79 1za2 s ILE 86 Cb -0.16 -1.90 0.01 0.00 -1.06 0.00 0.00 42.46 39.35 1za2 s ILE 86 CO 0.09 0.48 -0.13 -0.62 -0.10 0.00 0.00 174.94 174.66 1za2 s ASP 87 N 1.27 1.72 -1.11 3.58 3.68 -0.75 -0.01 116.67 125.06 1za2 s ASP 87 Ca 0.03 -0.28 -0.17 0.00 2.13 0.00 0.00 52.55 54.27 1za2 s ASP 87 Cb -0.14 -0.61 -0.03 0.00 -1.45 0.00 0.00 42.92 40.69 1za2 s ASP 87 CO -0.12 0.08 0.83 -3.20 0.13 0.00 0.00 175.17 172.89 1za2 n ASN 88 N 3.47 -5.70 0.00 -0.34 4.05 -0.99 -2.20 115.26 113.56 1za2 n ASN 88 Ca -0.20 -0.93 0.00 0.00 0.45 0.00 0.00 54.58 53.90 1za2 n ASN 88 Cb 0.53 -3.92 0.00 0.00 1.23 0.00 0.00 39.78 37.61 1za2 n ASN 88 CO 0.00 0.00 0.00 -1.22 -3.05 0.00 0.00 177.26 172.99 1za2 n TYR 89 N -3.91 0.00 -4.69 1.20 4.02 0.48 -4.92 117.16 109.34 1za2 n TYR 89 Ca -0.09 0.00 -0.33 0.00 -0.01 0.00 0.00 57.90 57.47 1za2 n TYR 89 Cb 0.60 -1.03 -0.12 0.00 -0.02 0.00 0.00 39.34 38.76 1za2 n TYR 89 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 176.86 174.64 1za2 s GLU 90 N -0.20 2.94 -0.67 -0.72 0.41 -0.93 -5.02 118.70 114.51 1za2 s GLU 90 Ca 0.00 -0.61 -0.24 0.00 -0.41 0.00 0.00 54.97 53.72 1za2 s GLU 90 Cb 0.00 -2.59 -0.19 0.00 -1.78 0.00 0.00 34.13 29.57 1za2 s GLU 90 CO 0.00 0.51 1.87 0.28 -0.49 0.00 0.00 175.26 177.43 1za2 n VAL 91 N 2.69 1.51 0.00 2.63 0.31 -1.26 -1.80 118.33 122.41 1za2 n VAL 91 Ca -0.18 -1.34 0.00 0.00 -0.01 0.00 0.00 64.34 62.81 1za2 n VAL 91 Cb 0.53 -2.26 0.00 0.00 -0.91 0.00 0.00 33.84 31.20 1za2 n VAL 91 CO 0.00 0.00 0.00 0.55 -1.32 0.00 0.00 176.83 176.06 1za2 n VAL 92 N 6.30 0.00 -4.25 2.52 3.14 -0.65 -4.73 118.33 120.66 1za2 n VAL 92 Ca 0.49 1.21 -0.27 0.00 -2.96 0.00 0.00 64.34 62.80 1za2 n VAL 92 Cb 0.41 -1.87 -0.09 0.00 -1.06 0.00 0.00 33.84 31.23 1za2 n VAL 92 CO 0.00 0.00 0.00 -0.83 -6.46 0.00 0.00 176.83 169.54 1za2 s GLY 93 N -0.41 1.74 -0.04 7.55 0.00 -1.21 -4.99 107.32 109.96 1za2 s GLY 93 Ca 0.00 -1.39 -0.03 0.00 0.00 0.00 0.00 44.72 43.30 1za2 s GLY 93 CO 0.00 -1.40 0.10 -1.59 0.00 0.00 0.00 173.10 170.21 1za2 s LYS 94 N -2.73 0.09 0.10 2.90 -2.85 -1.26 -0.08 119.74 115.91 1za2 s LYS 94 Ca 0.25 0.18 -0.01 0.00 -1.00 0.00 0.00 55.97 55.40 1za2 s LYS 94 Cb -0.09 -0.02 -0.04 0.00 -2.06 0.00 0.00 37.83 35.62 1za2 s LYS 94 CO 0.16 -0.06 0.01 -1.54 0.10 0.00 0.00 175.35 174.03 1za2 s SER 95 N 0.36 0.48 -0.06 0.03 1.04 -0.45 -5.00 113.70 110.10 1za2 s SER 95 Ca -0.03 -1.11 0.04 0.00 0.48 0.00 0.00 55.95 55.33 1za2 s SER 95 Cb -0.04 0.24 -0.02 0.00 0.10 0.00 0.00 66.02 66.29 1za2 s SER 95 CO -0.01 -0.65 -0.15 -0.60 0.98 0.00 0.00 173.24 172.80 1za2 s ARG 96 N -3.98 2.56 0.03 4.02 6.06 -1.26 -0.88 118.95 125.50 1za2 s ARG 96 Ca 0.17 -0.71 -0.36 0.00 -2.50 0.00 0.00 55.73 52.32 1za2 s ARG 96 Cb 0.07 -2.38 -0.15 0.00 0.06 0.00 0.00 34.95 32.56 1za2 s ARG 96 CO -0.03 0.58 1.54 -2.30 -2.50 0.00 0.00 175.30 172.59 1za2 n PRO 97 N 2.44 1.59 -4.15 5.12 -0.02 -1.26 -4.95 135.00 133.77 1za2 n PRO 97 Ca -0.17 0.58 -0.35 0.00 -2.02 0.00 0.00 63.50 61.53 1za2 n PRO 97 Cb 0.52 -2.29 -0.08 0.00 -0.02 0.00 0.00 33.50 31.63 1za2 n PRO 97 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 1za2 s SER 98 N 1.53 5.72 0.13 2.55 0.01 -1.26 -4.82 113.70 117.56 1za2 s SER 98 Ca 0.86 0.26 -0.35 0.00 1.31 0.00 0.00 55.95 58.03 1za2 s SER 98 Cb -0.85 -1.71 -0.15 0.00 0.21 0.00 0.00 66.02 63.52 1za2 s SER 98 CO 0.47 0.37 1.53 -0.11 0.41 0.00 0.00 173.24 175.92 1za2 n LEU 99 N 1.91 2.74 -4.83 2.44 7.94 -1.26 -4.34 117.00 121.59 1za2 n LEU 99 Ca -0.18 1.09 -0.30 0.00 -1.11 0.00 0.00 56.01 55.50 1za2 n LEU 99 Cb 0.54 -1.36 0.07 0.00 0.53 0.00 0.00 43.42 43.19 1za2 n LEU 99 CO 0.31 -0.47 0.72 -2.16 -1.11 0.00 0.00 177.39 174.68 1za2 s PRO 100 N 0.95 2.56 0.01 1.96 0.04 -1.26 -5.00 135.00 134.26 1za2 s PRO 100 Ca 0.81 0.66 -0.16 0.00 0.04 0.00 0.00 61.00 62.35 1za2 s PRO 100 Cb -0.75 -1.97 -0.34 0.00 0.04 0.00 0.00 34.50 31.47 1za2 s PRO 100 CO 0.41 -1.29 0.92 1.49 0.04 0.00 0.00 177.00 178.57 1za2 h GLU 101 N -0.85 0.49 -4.53 4.56 4.81 -1.92 -3.42 114.58 113.73 1za2 h GLU 101 Ca -0.46 -0.84 -0.19 0.00 -0.13 0.00 0.00 59.36 57.74 1za2 h GLU 101 Cb 1.25 0.31 -0.15 0.00 0.63 0.00 0.00 28.75 30.79 1za2 h GLU 101 CO 0.60 1.40 -0.69 1.03 -0.73 0.00 0.00 179.01 180.62 1za2 s ARG 102 N -2.58 0.77 -0.17 1.92 0.52 -1.26 -0.77 118.95 117.39 1za2 s ARG 102 Ca -0.11 -1.31 -0.03 0.00 -0.52 0.00 0.00 55.73 53.77 1za2 s ARG 102 Cb 0.04 -0.07 0.05 0.00 0.52 0.00 0.00 34.95 35.49 1za2 s ARG 102 CO 0.92 -0.05 0.03 0.42 0.02 0.00 0.00 175.30 176.64 1za2 s ILE 103 N -3.72 0.45 0.30 1.52 1.01 -0.69 -4.93 121.20 115.14 1za2 s ILE 103 Ca 0.11 -0.39 0.09 0.00 0.00 0.00 0.00 60.65 60.46 1za2 s ILE 103 Cb 0.06 -0.90 -0.04 0.00 0.01 0.00 0.00 42.46 41.59 1za2 s ILE 103 CO -0.06 -0.12 0.07 -1.81 0.00 0.00 0.00 174.94 173.02 1za2 s ASP 104 N 1.90 4.64 0.00 3.58 1.01 -1.26 -1.67 116.67 124.87 1za2 s ASP 104 Ca 0.01 -0.69 0.00 0.00 0.71 0.00 0.00 52.55 52.58 1za2 s ASP 104 Cb -0.16 -0.82 0.00 0.00 1.01 0.00 0.00 42.92 42.95 1za2 s ASP 104 CO -0.07 -0.13 0.00 0.59 0.21 0.00 0.00 175.17 175.77 1za2 n ASN 105 N -1.01 0.00 0.07 0.27 3.02 -0.67 -4.60 115.26 112.33 1za2 n ASN 105 Ca -0.05 0.00 -0.02 0.00 -0.03 0.00 0.00 54.58 54.48 1za2 n ASN 105 Cb 0.60 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.71 1za2 n ASN 105 CO 0.00 0.00 0.00 -0.37 -2.62 0.00 0.00 177.26 174.27 1za2 h VAL 106 N 0.00 0.95 -3.49 2.41 -1.51 -1.88 -3.42 116.25 109.31 1za2 h VAL 106 Ca 0.00 -2.49 -0.50 0.00 -1.23 0.00 0.00 66.70 62.48 1za2 h VAL 106 Cb 0.00 2.41 0.02 0.00 -2.13 0.00 0.00 31.29 31.58 1za2 h VAL 106 CO 0.00 0.54 0.05 -0.76 -1.23 0.00 0.00 177.57 176.17 1za2 s LEU 107 N -6.27 3.79 -0.13 4.19 1.43 -1.26 -5.09 118.68 115.34 1za2 s LEU 107 Ca 0.00 0.92 0.01 0.00 -1.03 0.00 0.00 54.13 54.03 1za2 s LEU 107 Cb 0.08 -3.82 0.02 0.00 0.03 0.00 0.00 46.19 42.50 1za2 s LEU 107 CO 0.79 -0.43 -0.15 -0.69 0.23 0.00 0.00 176.35 176.10 1za2 s VAL 108 N -2.48 1.57 0.06 -1.59 1.01 -1.26 -4.69 120.40 113.02 1za2 s VAL 108 Ca 0.47 -0.66 -0.30 0.00 0.00 0.00 0.00 61.98 61.49 1za2 s VAL 108 Cb -0.10 -1.45 -0.09 0.00 0.00 0.00 0.00 36.38 34.73 1za2 s VAL 108 CO 0.37 0.46 1.90 0.00 0.00 0.00 0.00 175.10 177.83 1za2 h PRO 110 N 9.82 0.00 -6.37 0.00 0.11 -1.93 -3.41 132.00 130.21 1za2 h PRO 110 Ca -0.48 0.00 -0.57 0.00 0.11 0.00 0.00 66.00 65.06 1za2 h PRO 110 Cb 1.23 0.00 -0.07 0.00 0.11 0.00 0.00 31.00 32.26 1za2 h PRO 110 CO 0.94 0.00 0.81 1.21 -0.21 0.00 0.00 178.00 180.75 1za2 s ASN 111 N -4.47 6.77 0.52 -2.05 2.47 -1.26 -4.90 114.94 112.03 1za2 s ASN 111 Ca -0.01 0.74 0.30 0.00 0.42 0.00 0.00 52.86 54.32 1za2 s ASN 111 Cb 0.09 -2.52 1.24 0.00 -1.45 0.00 0.00 41.25 38.60 1za2 s ASN 111 CO 0.33 -0.99 1.94 0.77 -3.72 0.00 0.00 177.10 175.43 1za2 h SER 112 N 8.55 0.00 -0.14 -4.21 4.64 -2.03 -2.58 113.55 117.78 1za2 h SER 112 Ca -0.22 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.10 1za2 h SER 112 Cb 1.06 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.15 1za2 h SER 112 CO 1.05 0.07 0.00 -3.20 -0.87 0.00 0.00 176.83 173.88 1za2 n ASN 113 N -3.21 1.81 -4.75 4.97 5.15 -1.26 -4.91 115.26 113.05 1za2 n ASN 113 Ca 0.00 -1.69 -0.41 0.00 -0.60 0.00 0.00 54.58 51.89 1za2 n ASN 113 Cb 0.34 -0.08 -0.03 0.00 -0.53 0.00 0.00 39.78 39.48 1za2 n ASN 113 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1za2 h ILE 115 N 3.33 0.36 -0.19 0.00 6.09 -1.91 -3.07 117.51 122.12 1za2 h ILE 115 Ca -0.47 -0.16 0.04 0.00 -1.37 0.00 0.00 64.86 62.90 1za2 h ILE 115 Cb 1.22 1.11 -0.01 0.00 0.47 0.00 0.00 36.82 39.61 1za2 h ILE 115 CO 0.70 0.03 0.13 0.77 -3.07 0.00 0.00 178.15 176.72 1za2 h SER 116 N 0.00 0.08 0.11 2.19 4.64 -1.91 -3.02 113.55 115.64 1za2 h SER 116 Ca -0.00 -0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 1za2 h SER 116 Cb 0.11 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.18 1za2 h SER 116 CO 0.00 0.05 -0.05 0.45 -0.87 0.00 0.00 176.83 176.42 1za2 h HIS 117 N 0.09 -0.14 0.00 4.77 3.86 -1.90 -3.30 115.15 118.54 1za2 h HIS 117 Ca 0.08 -0.00 -0.05 0.00 -1.16 0.00 0.00 60.37 59.24 1za2 h HIS 117 Cb 0.22 0.05 -0.01 0.00 1.06 0.00 0.00 27.41 28.73 1za2 h HIS 117 CO -0.00 0.07 -0.62 0.00 0.86 0.00 0.00 177.93 178.24 1za2 h ALA 118 N 0.55 0.73 -2.40 2.45 0.00 -1.79 -3.47 119.26 115.32 1za2 h ALA 118 Ca -0.02 -0.25 -0.51 0.00 0.00 0.00 0.00 54.91 54.13 1za2 h ALA 118 Cb 0.27 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 1za2 h ALA 118 CO 0.02 0.31 -0.29 -1.21 0.00 0.00 0.00 179.25 178.08 1za2 s GLU 119 N -3.14 3.51 -1.33 0.00 0.41 -1.14 -5.01 118.70 112.00 1za2 s GLU 119 Ca 0.03 -0.35 -0.11 0.00 -0.41 0.00 0.00 54.97 54.12 1za2 s GLU 119 Cb 0.07 -2.78 -0.06 0.00 -1.78 0.00 0.00 34.13 29.58 1za2 s GLU 119 CO 0.74 0.32 2.49 -0.35 -0.49 0.00 0.00 175.26 177.98 1za2 n PRO 120 N -1.06 2.90 -4.28 0.39 -0.04 -1.26 -4.87 135.00 126.78 1za2 n PRO 120 Ca -0.05 -2.08 -0.16 0.00 -0.04 0.00 0.00 63.50 61.18 1za2 n PRO 120 Cb 0.55 -2.84 -0.10 0.00 -0.04 0.00 0.00 33.50 31.06 1za2 n PRO 120 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1za2 s VAL 121 N 2.99 1.24 0.15 0.52 -7.23 -1.26 -5.15 120.40 111.67 1za2 s VAL 121 Ca 0.56 -2.08 -0.13 0.00 -1.81 0.00 0.00 61.98 58.53 1za2 s VAL 121 Cb 0.15 -1.99 -0.07 0.00 0.56 0.00 0.00 36.38 35.03 1za2 s VAL 121 CO -0.04 -0.63 0.53 -0.44 -0.31 0.00 0.00 175.10 174.21 1za2 s SER 122 N -3.23 6.75 0.87 4.85 0.01 -1.26 -5.01 113.70 116.69 1za2 s SER 122 Ca 0.20 1.00 -0.11 0.00 1.31 0.00 0.00 55.95 58.36 1za2 s SER 122 Cb 0.03 -2.26 0.12 0.00 0.21 0.00 0.00 66.02 64.12 1za2 s SER 122 CO 0.03 0.07 1.11 -0.94 0.41 0.00 0.00 173.24 173.93 1za2 s SER 123 N -1.87 3.47 -0.29 2.44 1.04 -1.26 -4.78 113.70 112.45 1za2 s SER 123 Ca 0.39 1.93 -0.15 0.00 0.48 0.00 0.00 55.95 58.60 1za2 s SER 123 Cb -0.14 -2.49 0.14 0.00 0.10 0.00 0.00 66.02 63.63 1za2 s SER 123 CO 0.19 -2.71 0.88 -0.55 0.98 0.00 0.00 173.24 172.04 1za2 s SER 124 N -3.03 -0.69 0.01 7.02 0.15 -1.26 -1.68 113.70 114.22 1za2 s SER 124 Ca 0.64 1.04 0.04 0.00 0.70 0.00 0.00 55.95 58.37 1za2 s SER 124 Cb -0.20 1.50 -0.01 0.00 -1.71 0.00 0.00 66.02 65.59 1za2 s SER 124 CO 0.57 -0.16 -0.11 -0.36 1.20 0.00 0.00 173.24 174.38 1za2 s PHE 125 N 1.88 1.01 0.01 3.44 0.40 -0.67 -0.55 117.98 123.49 1za2 s PHE 125 Ca -0.07 -0.25 -0.22 0.00 -0.60 0.00 0.00 56.93 55.79 1za2 s PHE 125 Cb -0.06 -0.63 -0.05 0.00 0.51 0.00 0.00 43.02 42.79 1za2 s PHE 125 CO -0.17 -0.00 0.64 0.00 0.70 0.00 0.00 175.22 176.39 1za2 s ALA 126 N -0.51 3.45 -0.24 5.36 0.00 0.15 -1.70 121.76 128.27 1za2 s ALA 126 Ca 0.02 0.10 -0.10 0.00 0.00 0.00 0.00 51.96 51.98 1za2 s ALA 126 Cb -0.06 -2.82 -0.05 0.00 0.00 0.00 0.00 23.12 20.20 1za2 s ALA 126 CO 0.00 0.14 0.16 0.08 0.00 0.00 0.00 175.76 176.14 1za2 s VAL 127 N -0.15 5.35 -0.10 0.00 1.01 0.05 -1.59 120.40 124.96 1za2 s VAL 127 Ca 0.33 0.18 -0.03 0.00 0.00 0.00 0.00 61.98 62.45 1za2 s VAL 127 Cb -0.19 -3.49 0.04 0.00 0.00 0.00 0.00 36.38 32.74 1za2 s VAL 127 CO 0.19 0.35 0.07 0.00 0.00 0.00 0.00 175.10 175.71 1za2 s ARG 128 N 1.04 0.04 0.25 2.72 1.70 -0.79 -4.84 118.95 119.08 1za2 s ARG 128 Ca 0.07 0.14 -0.30 0.00 -0.47 0.00 0.00 55.73 55.17 1za2 s ARG 128 Cb -0.13 -1.17 -0.09 0.00 -0.57 0.00 0.00 34.95 32.98 1za2 s ARG 128 CO 0.04 -0.49 1.01 -1.59 -1.08 0.00 0.00 175.30 173.19 1za2 s LYS 129 N 2.14 4.76 0.00 3.89 -2.85 -1.26 -1.60 119.74 124.82 1za2 s LYS 129 Ca 0.03 1.63 0.00 0.00 -1.00 0.00 0.00 55.97 56.63 1za2 s LYS 129 Cb -0.14 -3.24 0.00 0.00 -2.06 0.00 0.00 37.83 32.39 1za2 s LYS 129 CO -0.06 0.38 0.00 2.89 0.10 0.00 0.00 175.35 178.66 1za2 n ARG 130 N 1.41 0.00 -1.46 1.78 1.85 -0.89 -4.97 116.66 114.39 1za2 n ARG 130 Ca -0.01 0.00 -0.18 0.00 -1.00 0.00 0.00 57.85 56.65 1za2 n ARG 130 Cb 0.46 0.00 -0.18 0.00 -1.05 0.00 0.00 32.46 31.69 1za2 n ARG 130 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 1za2 n ALA 131 N -3.00 0.94 -0.76 2.89 0.00 -1.26 -2.75 120.51 116.57 1za2 n ALA 131 Ca 0.00 -0.95 0.00 0.00 0.00 0.00 0.00 53.44 52.49 1za2 n ALA 131 Cb 0.00 -2.35 0.00 0.00 0.00 0.00 0.00 19.45 17.10 1za2 n ALA 131 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1za2 n ASN 132 N 7.54 -3.00 -3.77 0.00 5.03 -1.26 -4.89 115.26 114.91 1za2 n ASN 132 Ca 0.58 0.00 -0.04 0.00 0.87 0.00 0.00 54.58 55.98 1za2 n ASN 132 Cb 0.22 -2.95 -0.01 0.00 -1.02 0.00 0.00 39.78 36.02 1za2 n ASN 132 CO 0.00 0.00 0.00 1.51 -1.83 0.00 0.00 177.26 176.94 1za2 s ASP 133 N -2.01 -0.20 -0.08 6.41 -4.77 -1.11 -5.15 116.67 109.76 1za2 s ASP 133 Ca 0.00 -0.43 -0.15 0.00 -3.30 0.00 0.00 52.55 48.67 1za2 s ASP 133 Cb 0.00 0.53 -0.05 0.00 -1.09 0.00 0.00 42.92 42.31 1za2 s ASP 133 CO 0.00 -0.98 0.37 -0.63 0.70 0.00 0.00 175.17 174.63 1za2 s ILE 134 N -3.41 5.17 -0.14 2.11 1.09 -1.26 -2.09 121.20 122.68 1za2 s ILE 134 Ca 0.12 0.74 -0.05 0.00 -1.10 0.00 0.00 60.65 60.35 1za2 s ILE 134 Cb -0.02 -3.69 -0.04 0.00 -1.06 0.00 0.00 42.46 37.65 1za2 s ILE 134 CO 0.03 0.47 0.05 0.00 -0.10 0.00 0.00 174.94 175.39 1za2 s ALA 135 N -0.26 3.43 -0.14 9.38 0.00 -0.62 0.06 121.76 133.61 1za2 s ALA 135 Ca 0.22 -0.75 0.01 0.00 0.00 0.00 0.00 51.96 51.44 1za2 s ALA 135 Cb -0.15 -1.77 -0.00 0.00 0.00 0.00 0.00 23.12 21.20 1za2 s ALA 135 CO 0.09 0.39 -0.17 -0.51 0.00 0.00 0.00 175.76 175.56 1za2 s LEU 136 N -0.28 2.42 -0.20 0.00 1.43 0.17 -1.88 118.68 120.33 1za2 s LEU 136 Ca 0.08 -0.47 -0.03 0.00 -1.03 0.00 0.00 54.13 52.67 1za2 s LEU 136 Cb -0.12 -1.53 -0.01 0.00 0.03 0.00 0.00 46.19 44.56 1za2 s LEU 136 CO 0.02 0.11 -0.06 -0.75 0.23 0.00 0.00 176.35 175.90 1za2 s LYS 137 N 0.65 3.38 0.14 1.70 2.20 -0.62 -0.94 119.74 126.24 1za2 s LYS 137 Ca -0.09 -0.63 -0.31 0.00 -0.36 0.00 0.00 55.97 54.58 1za2 s LYS 137 Cb -0.16 -2.94 -0.09 0.00 -1.51 0.00 0.00 37.83 33.13 1za2 s LYS 137 CO 0.02 -0.12 1.53 0.00 -0.36 0.00 0.00 175.35 176.42 1za2 h LYS 139 N 6.99 0.23 0.00 0.00 3.64 -1.20 -2.09 116.57 124.13 1za2 h LYS 139 Ca -0.42 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 58.94 1za2 h LYS 139 Cb 1.20 -0.05 0.00 0.00 -0.41 0.00 0.00 32.23 32.97 1za2 h LYS 139 CO 0.90 0.15 0.00 0.66 -2.27 0.00 0.00 179.45 178.89 1za2 n TYR 140 N -4.45 0.00 0.60 1.91 4.01 -1.26 -4.50 117.16 113.47 1za2 n TYR 140 Ca 0.09 0.00 0.10 0.00 -0.16 0.00 0.00 57.90 57.93 1za2 n TYR 140 Cb 0.44 -0.17 0.42 0.00 -0.31 0.00 0.00 39.34 39.73 1za2 n TYR 140 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1za2 n GLU 142 N -1.72 -1.47 -2.94 0.00 1.02 -0.79 -4.97 120.64 109.77 1za2 n GLU 142 Ca 0.04 1.09 -0.40 0.00 -0.02 0.00 0.00 57.16 57.87 1za2 n GLU 142 Cb 0.24 -5.44 -0.06 0.00 -0.02 0.00 0.00 31.44 26.16 1za2 n GLU 142 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1za2 s LYS 143 N -3.40 4.62 -0.11 3.49 -0.14 -1.26 -4.78 119.74 118.16 1za2 s LYS 143 Ca 0.00 1.21 -0.03 0.00 -1.36 0.00 0.00 55.97 55.80 1za2 s LYS 143 Cb 0.00 -3.27 -0.03 0.00 -1.68 0.00 0.00 37.83 32.85 1za2 s LYS 143 CO 0.00 0.55 0.00 -2.00 -0.76 0.00 0.00 175.35 173.14 1za2 s GLU 144 N -1.11 3.19 0.20 1.68 2.12 -1.26 -2.47 118.70 121.05 1za2 s GLU 144 Ca 0.37 -0.42 0.02 0.00 0.36 0.00 0.00 54.97 55.30 1za2 s GLU 144 Cb -0.24 -2.85 -0.05 0.00 0.26 0.00 0.00 34.13 31.26 1za2 s GLU 144 CO 0.27 0.59 0.02 -0.06 -0.54 0.00 0.00 175.26 175.54 1za2 s PHE 145 N -0.56 1.36 0.04 5.30 0.40 -0.12 -4.96 117.98 119.43 1za2 s PHE 145 Ca 0.09 -1.03 -0.30 0.00 -0.60 0.00 0.00 56.93 55.10 1za2 s PHE 145 Cb -0.12 -0.78 -0.04 0.00 0.51 0.00 0.00 43.02 42.59 1za2 s PHE 145 CO 0.02 -0.20 0.96 0.45 0.70 0.00 0.00 175.22 177.16 1za2 s SER 146 N -3.23 7.41 0.60 1.36 0.15 -1.26 -0.66 113.70 118.07 1za2 s SER 146 Ca 0.28 1.69 0.27 0.00 0.70 0.00 0.00 55.95 58.90 1za2 s SER 146 Cb 0.06 -2.57 1.21 0.00 -1.71 0.00 0.00 66.02 63.01 1za2 s SER 146 CO 0.07 -0.18 1.62 1.12 1.20 0.00 0.00 173.24 177.06 1za2 h HIS 147 N 6.34 0.00 -0.45 3.44 2.07 -0.72 0.39 115.15 126.22 1za2 h HIS 147 Ca -0.42 0.00 -0.08 0.00 -2.85 0.00 0.00 60.37 57.02 1za2 h HIS 147 Cb 1.22 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 31.18 1za2 h HIS 147 CO 0.67 0.00 -0.05 -0.91 -3.07 0.00 0.00 177.93 174.57 1za2 h ASN 148 N 0.00 0.82 0.66 3.10 2.35 -1.91 -1.78 115.58 118.83 1za2 h ASN 148 Ca 0.32 -0.33 -0.16 0.00 -0.55 0.00 0.00 56.30 55.57 1za2 h ASN 148 Cb 1.94 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 40.07 1za2 h ASN 148 CO -0.00 0.96 -0.76 -0.37 -1.65 0.00 0.00 177.43 175.61 1za2 h VAL 149 N 0.67 1.51 -0.03 2.81 -1.51 -0.61 -0.92 116.25 118.17 1za2 h VAL 149 Ca 0.12 -2.49 -0.18 0.00 -1.23 0.00 0.00 66.70 62.92 1za2 h VAL 149 Cb 0.57 2.35 0.01 0.00 -2.13 0.00 0.00 31.29 32.09 1za2 h VAL 149 CO 0.03 0.72 -0.69 0.58 -1.23 0.00 0.00 177.57 176.98 1za2 h VAL 150 N 0.04 1.38 0.00 7.19 2.07 -1.50 -3.20 116.25 122.24 1za2 h VAL 150 Ca -0.02 -2.06 -0.07 0.00 0.82 0.00 0.00 66.70 65.37 1za2 h VAL 150 Cb 1.33 2.45 -0.01 0.00 -1.52 0.00 0.00 31.29 33.54 1za2 h VAL 150 CO 0.10 0.61 -0.34 -0.07 0.02 0.00 0.00 177.57 177.90 1za2 h LEU 151 N 0.08 0.00 -2.68 2.57 -0.00 -1.37 -3.01 115.31 110.90 1za2 h LEU 151 Ca -0.08 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 57.80 1za2 h LEU 151 Cb 1.37 0.00 0.00 0.00 -0.00 0.00 0.00 40.66 42.03 1za2 h LEU 151 CO 0.14 0.34 0.09 0.00 -0.00 0.00 0.00 178.44 179.00 1za2 h ALA 152 N 1.66 1.09 0.00 1.53 0.00 -1.15 -3.51 119.26 118.89 1za2 h ALA 152 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1za2 h ALA 152 Cb 0.84 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.63 1za2 h ALA 152 CO 0.04 -0.09 0.00 -1.71 0.00 0.00 0.00 179.25 177.49