#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 3.52 0.73 -1.84 0.00 -1.26 -5.01 121.76 117.90 1za2 s ALA 11 Ca 0.00 0.59 -0.14 0.00 0.00 0.00 0.00 51.96 52.41 1za2 s ALA 11 Cb 0.00 -3.53 0.04 0.00 0.00 0.00 0.00 23.12 19.63 1za2 s ALA 11 CO 0.00 -0.82 1.15 -1.50 0.00 0.00 0.00 175.76 174.58 1za2 s ILE 12 N 2.40 2.79 0.00 0.00 2.07 -1.26 -5.04 121.20 122.16 1za2 s ILE 12 Ca 0.55 0.34 0.00 0.00 -1.41 0.00 0.00 60.65 60.14 1za2 s ILE 12 Cb -0.24 -2.82 0.00 0.00 0.13 0.00 0.00 42.46 39.53 1za2 s ILE 12 CO 0.21 -0.25 0.00 1.17 -1.91 0.00 0.00 174.94 174.16 1za2 n LYS 13 N -2.89 0.00 -4.92 3.50 3.00 -1.26 -4.41 118.16 111.18 1za2 n LYS 13 Ca 0.11 0.00 -0.33 0.00 -0.00 0.00 0.00 58.31 58.10 1za2 n LYS 13 Cb 0.51 -0.03 -0.15 0.00 0.00 0.00 0.00 35.03 35.37 1za2 n LYS 13 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.40 176.42 1za2 s ARG 14 N 0.00 3.18 0.00 1.64 1.04 -1.26 -2.53 118.95 121.01 1za2 s ARG 14 Ca 0.00 -0.74 0.00 0.00 -1.04 0.00 0.00 55.73 53.95 1za2 s ARG 14 Cb 0.00 -2.50 0.00 0.00 -2.04 0.00 0.00 34.95 30.41 1za2 s ARG 14 CO 0.00 0.26 0.00 0.41 -0.04 0.00 0.00 175.30 175.93 1za2 n GLY 15 N 3.37 -0.48 3.43 3.88 0.00 0.65 -1.28 105.19 114.77 1za2 n GLY 15 Ca -0.18 -1.06 -0.28 0.00 0.00 0.00 0.00 46.02 44.49 1za2 n GLY 15 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1za2 s THR 16 N -3.19 2.44 -0.15 2.61 -1.32 -0.71 -3.35 115.64 111.97 1za2 s THR 16 Ca 0.00 -1.82 -0.04 0.00 -1.21 0.00 0.00 61.69 58.61 1za2 s THR 16 Cb 0.00 -2.13 0.06 0.00 -1.51 0.00 0.00 72.50 68.92 1za2 s THR 16 CO 0.00 -0.00 0.11 0.54 -2.21 0.00 0.00 174.62 173.06 1za2 s VAL 17 N -1.35 -0.14 -0.39 5.08 0.11 -0.86 -0.88 120.40 121.97 1za2 s VAL 17 Ca 0.18 -0.04 -0.27 0.00 -2.93 0.00 0.00 61.98 58.91 1za2 s VAL 17 Cb -0.09 -0.51 0.02 0.00 -1.53 0.00 0.00 36.38 34.26 1za2 s VAL 17 CO 0.09 -0.18 1.01 -0.63 -3.33 0.00 0.00 175.10 172.06 1za2 s ILE 18 N 2.18 4.47 0.23 7.04 1.01 0.12 -2.33 121.20 133.93 1za2 s ILE 18 Ca 0.03 1.32 0.08 0.00 0.00 0.00 0.00 60.65 62.09 1za2 s ILE 18 Cb -0.15 -4.42 -0.04 0.00 0.01 0.00 0.00 42.46 37.85 1za2 s ILE 18 CO -0.08 -0.65 0.01 -0.62 0.00 0.00 0.00 174.94 173.60 1za2 s ASP 19 N 1.97 4.70 -0.92 3.58 3.68 0.14 -1.74 116.67 128.08 1za2 s ASP 19 Ca 0.42 -0.52 -0.05 0.00 2.13 0.00 0.00 52.55 54.54 1za2 s ASP 19 Cb -0.11 -0.95 0.01 0.00 -1.45 0.00 0.00 42.92 40.42 1za2 s ASP 19 CO 0.21 0.03 0.80 1.41 0.13 0.00 0.00 175.17 177.75 1za2 n HIS 20 N -0.60 -1.90 -2.98 -5.34 8.25 -1.25 -0.33 115.22 111.07 1za2 n HIS 20 Ca -0.08 0.69 -0.40 0.00 -0.26 0.00 0.00 57.72 57.67 1za2 n HIS 20 Cb 0.57 -3.88 -0.05 0.00 1.12 0.00 0.00 29.99 27.76 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 -3.23 4.84 0.75 1.59 1.01 -1.01 -4.06 121.20 121.10 1za2 s ILE 21 Ca 0.32 1.61 -0.15 0.00 0.00 0.00 0.00 60.65 62.44 1za2 s ILE 21 Cb -0.14 -4.11 0.05 0.00 0.01 0.00 0.00 42.46 38.26 1za2 s ILE 21 CO 0.51 0.31 1.23 -2.84 0.00 0.00 0.00 174.94 174.15 1za2 s PRO 22 N 0.31 1.98 0.40 2.79 0.02 -1.26 -0.05 135.00 139.19 1za2 s PRO 22 Ca 0.40 1.85 -0.27 0.00 0.02 0.00 0.00 61.00 63.00 1za2 s PRO 22 Cb -0.20 -1.80 -0.10 0.00 0.02 0.00 0.00 34.50 32.41 1za2 s PRO 22 CO 0.22 -1.98 1.48 0.00 -0.33 0.00 0.00 177.00 176.39 1za2 n ALA 23 N -2.79 2.32 -1.00 -1.55 0.00 -1.25 -2.39 120.51 113.84 1za2 n ALA 23 Ca 0.14 0.32 -0.00 0.00 0.00 0.00 0.00 53.44 53.90 1za2 n ALA 23 Cb 0.50 -2.42 -0.00 0.00 0.00 0.00 0.00 19.45 17.53 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 0.29 -0.21 -0.02 0.00 1.13 -1.26 -4.86 117.38 112.45 1za2 n GLN 24 Ca 0.02 0.08 0.01 0.00 -1.94 0.00 0.00 57.00 55.17 1za2 n GLN 24 Cb 0.39 -3.26 -0.07 0.00 0.11 0.00 0.00 30.24 27.41 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 -2.90 0.23 0.20 5.09 2.08 -1.01 -4.40 119.36 118.65 1za2 n ILE 25 Ca -0.00 -0.27 -0.15 0.00 0.56 0.00 0.00 62.75 62.89 1za2 n ILE 25 Cb 0.05 -0.11 -0.07 0.00 -0.75 0.00 0.00 39.64 38.76 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 1.72 -0.56 1.06 7.39 0.00 -1.90 0.25 103.07 111.04 1za2 h GLY 26 Ca -0.09 0.26 -0.02 0.00 0.00 0.00 0.00 47.33 47.47 1za2 h GLY 26 CO 0.00 -0.22 0.44 -2.75 0.00 0.00 0.00 176.54 174.02 1za2 h PHE 27 N -0.54 1.21 -0.72 5.60 3.57 -1.96 0.17 116.94 124.28 1za2 h PHE 27 Ca -0.02 -0.04 0.04 0.00 3.53 0.00 0.00 57.97 61.47 1za2 h PHE 27 Cb 0.47 -0.38 -0.05 0.00 2.79 0.00 0.00 35.95 38.78 1za2 h PHE 27 CO -0.12 0.86 0.44 -0.22 -2.23 0.00 0.00 178.31 177.04 1za2 h LYS 28 N 1.22 0.83 -0.52 1.11 3.64 -1.67 -0.40 116.57 120.78 1za2 h LYS 28 Ca 0.30 -0.05 -0.06 0.00 -1.27 0.00 0.00 60.65 59.57 1za2 h LYS 28 Cb 0.07 -0.19 -0.02 0.00 -0.41 0.00 0.00 32.23 31.69 1za2 h LYS 28 CO -0.04 0.55 0.10 -0.07 -2.27 0.00 0.00 179.45 177.72 1za2 h LEU 29 N 0.85 0.82 -1.54 5.20 3.38 0.54 0.27 115.31 124.83 1za2 h LEU 29 Ca 0.30 -0.25 0.02 0.00 0.09 0.00 0.00 57.88 58.04 1za2 h LEU 29 Cb 0.06 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.57 1za2 h LEU 29 CO -0.13 0.86 0.33 -0.07 0.09 0.00 0.00 178.44 179.52 1za2 h LEU 30 N 0.74 0.53 0.04 1.67 3.38 -0.22 -2.61 115.31 118.84 1za2 h LEU 30 Ca 0.16 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.12 1za2 h LEU 30 Cb 0.37 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 41.00 1za2 h LEU 30 CO 0.01 0.38 -0.02 0.28 0.09 0.00 0.00 178.44 179.17 1za2 h SER 31 N 0.62 -0.05 -1.03 -0.43 0.02 -0.60 -2.46 113.55 109.62 1za2 h SER 31 Ca 0.19 0.00 0.26 0.00 -0.84 0.00 0.00 61.79 61.40 1za2 h SER 31 Cb 0.00 0.01 -0.10 0.00 0.14 0.00 0.00 62.40 62.45 1za2 h SER 31 CO -0.04 0.33 0.65 -0.07 -1.14 0.00 0.00 176.83 176.56 1za2 h LEU 32 N -0.78 0.52 -3.06 5.07 3.38 -0.99 -0.58 115.31 118.86 1za2 h LEU 32 Ca -0.01 0.10 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1za2 h LEU 32 Cb 0.04 0.02 0.00 0.00 0.09 0.00 0.00 40.66 40.81 1za2 h LEU 32 CO 0.01 0.09 0.00 0.49 0.09 0.00 0.00 178.44 179.12 1za2 n PHE 33 N -4.71 0.79 -3.65 1.13 3.72 -0.99 -4.79 117.46 108.96 1za2 n PHE 33 Ca 0.26 -0.66 -0.21 0.00 -0.05 0.00 0.00 57.45 56.79 1za2 n PHE 33 Cb 0.84 -0.17 0.01 0.00 -0.94 0.00 0.00 39.48 39.23 1za2 n PHE 33 CO 0.00 0.00 0.00 0.36 -0.05 0.00 0.00 176.76 177.07 1za2 n LYS 34 N 0.22 -0.69 0.00 -1.08 2.85 -0.23 -4.81 118.16 114.44 1za2 n LYS 34 Ca 0.17 0.03 0.13 0.00 -1.05 0.00 0.00 58.31 57.59 1za2 n LYS 34 Cb 0.67 -1.02 0.48 0.00 -0.65 0.00 0.00 35.03 34.50 1za2 n LYS 34 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63 1za2 n LEU 35 N -2.62 0.34 -0.87 -5.58 4.77 -0.96 -3.64 117.00 108.44 1za2 n LEU 35 Ca -0.11 0.16 0.11 0.00 -0.03 0.00 0.00 56.01 56.15 1za2 n LEU 35 Cb 0.34 -0.31 0.28 0.00 -2.33 0.00 0.00 43.42 41.39 1za2 n LEU 35 CO 0.39 0.07 0.73 0.35 -1.33 0.00 0.00 177.39 177.60 1za2 n THR 36 N -1.33 0.34 -1.46 -5.08 -2.24 -1.26 -4.37 114.28 98.88 1za2 n THR 36 Ca 0.09 -0.55 -0.26 0.00 -2.27 0.00 0.00 64.05 61.06 1za2 n THR 36 Cb 0.32 0.74 -0.06 0.00 -2.10 0.00 0.00 70.33 69.23 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 0.96 2.37 -4.21 -0.78 1.02 -1.24 -4.87 120.64 113.90 1za2 n GLU 37 Ca 0.18 -2.26 -0.12 0.00 -0.02 0.00 0.00 57.16 54.93 1za2 n GLU 37 Cb 0.48 -2.13 -0.10 0.00 -0.02 0.00 0.00 31.44 29.67 1za2 n GLU 37 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1za2 s THR 38 N -2.07 0.74 -1.57 2.62 2.01 -1.26 -5.03 115.64 111.08 1za2 s THR 38 Ca 0.59 -1.97 0.16 0.00 0.31 0.00 0.00 61.69 60.79 1za2 s THR 38 Cb 0.38 -1.87 0.56 0.00 0.01 0.00 0.00 72.50 71.58 1za2 s THR 38 CO -0.21 -0.70 1.46 0.47 -0.69 0.00 0.00 174.62 174.94 1za2 n ASP 39 N -0.14 3.64 -4.85 3.53 8.00 -1.26 -4.94 116.55 120.54 1za2 n ASP 39 Ca -0.10 -2.20 -0.35 0.00 0.71 0.00 0.00 54.79 52.85 1za2 n ASP 39 Cb 0.62 -0.47 -0.06 0.00 -0.02 0.00 0.00 41.12 41.19 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 -1.53 3.95 0.05 -1.24 -1.52 -1.26 -5.02 119.66 113.09 1za2 s GLN 40 Ca 0.41 0.45 -0.30 0.00 -1.95 0.00 0.00 55.36 53.97 1za2 s GLN 40 Cb 0.24 -2.94 -0.09 0.00 -0.22 0.00 0.00 33.01 30.00 1za2 s GLN 40 CO 0.23 0.49 1.94 0.50 -0.25 0.00 0.00 175.29 178.20 1za2 s ARG 41 N -1.95 4.14 -0.07 2.91 3.52 -1.26 -4.84 118.95 121.40 1za2 s ARG 41 Ca 0.37 2.60 0.03 0.00 -0.13 0.00 0.00 55.73 58.60 1za2 s ARG 41 Cb -0.15 -4.08 0.01 0.00 -1.56 0.00 0.00 34.95 29.17 1za2 s ARG 41 CO 0.19 -0.94 -0.18 0.42 -0.81 0.00 0.00 175.30 173.99 1za2 s ILE 42 N 4.22 1.54 -0.07 4.11 1.01 -1.26 -2.26 121.20 128.49 1za2 s ILE 42 Ca 0.87 -0.73 0.04 0.00 0.00 0.00 0.00 60.65 60.83 1za2 s ILE 42 Cb -0.43 -1.36 -0.02 0.00 0.01 0.00 0.00 42.46 40.67 1za2 s ILE 42 CO 0.40 0.44 -0.19 0.42 0.00 0.00 0.00 174.94 176.02 1za2 s THR 43 N 0.43 2.62 -0.02 2.92 -4.23 -0.91 -5.00 115.64 111.46 1za2 s THR 43 Ca -0.14 -0.86 0.04 0.00 -1.18 0.00 0.00 61.69 59.55 1za2 s THR 43 Cb -0.16 -2.02 -0.01 0.00 1.34 0.00 0.00 72.50 71.66 1za2 s THR 43 CO 0.05 0.57 -0.14 -0.63 -0.54 0.00 0.00 174.62 173.93 1za2 s ILE 44 N -0.24 1.10 -0.13 2.99 1.01 -1.26 -1.50 121.20 123.16 1za2 s ILE 44 Ca -0.00 -0.58 0.01 0.00 0.00 0.00 0.00 60.65 60.08 1za2 s ILE 44 Cb -0.13 -0.92 0.02 0.00 0.01 0.00 0.00 42.46 41.43 1za2 s ILE 44 CO 0.03 0.31 -0.14 -0.83 0.00 0.00 0.00 174.94 174.32 1za2 s GLY 45 N -0.22 1.06 -0.08 6.18 0.00 0.05 -4.99 107.32 109.33 1za2 s GLY 45 Ca 0.03 -0.81 0.03 0.00 0.00 0.00 0.00 44.72 43.98 1za2 s GLY 45 CO -0.00 0.46 -0.18 1.08 0.00 0.00 0.00 173.10 174.46 1za2 s LEU 46 N 1.34 2.49 -1.04 0.66 1.43 -1.26 0.05 118.68 122.35 1za2 s LEU 46 Ca 0.01 -0.35 -0.02 0.00 -1.03 0.00 0.00 54.13 52.74 1za2 s LEU 46 Cb -0.13 -1.51 0.00 0.00 0.03 0.00 0.00 46.19 44.58 1za2 s LEU 46 CO -0.07 0.25 0.88 0.59 0.23 0.00 0.00 176.35 178.22 1za2 n ASN 47 N 2.95 -3.07 -4.87 2.29 5.03 -1.04 -4.99 115.26 111.56 1za2 n ASN 47 Ca -0.18 -0.50 -0.31 0.00 0.87 0.00 0.00 54.58 54.47 1za2 n ASN 47 Cb 0.52 -4.33 -0.05 0.00 -1.02 0.00 0.00 39.78 34.90 1za2 n ASN 47 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 1za2 s LEU 48 N -5.81 4.03 0.44 3.41 1.43 0.68 -4.80 118.68 118.06 1za2 s LEU 48 Ca 0.14 1.05 -0.24 0.00 -1.03 0.00 0.00 54.13 54.06 1za2 s LEU 48 Cb -0.06 -3.87 -0.08 0.00 0.03 0.00 0.00 46.19 42.21 1za2 s LEU 48 CO 0.61 -0.22 1.16 -2.16 0.23 0.00 0.00 176.35 175.96 1za2 s PRO 49 N -3.26 3.87 0.32 1.29 0.04 -1.26 -0.68 135.00 135.32 1za2 s PRO 49 Ca 0.50 1.77 -0.04 0.00 0.04 0.00 0.00 61.00 63.26 1za2 s PRO 49 Cb -0.11 -2.49 0.02 0.00 0.04 0.00 0.00 34.50 31.97 1za2 s PRO 49 CO 0.24 -0.46 0.50 0.45 0.04 0.00 0.00 177.00 177.77 1za2 n SER 50 N -0.31 -1.41 -0.04 6.66 2.88 0.26 -4.76 113.62 116.90 1za2 n SER 50 Ca 0.06 -2.64 -0.07 0.00 -1.33 0.00 0.00 58.87 54.88 1za2 n SER 50 Cb 0.48 2.55 -0.03 0.00 -0.75 0.00 0.00 64.21 66.46 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 -0.51 -0.12 0.00 0.46 0.00 -1.26 -3.75 105.19 100.01 1za2 n GLY 51 Ca -0.01 -0.04 0.06 0.00 0.00 0.00 0.00 46.02 46.02 1za2 n GLY 51 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1za2 n GLU 52 N -3.19 0.68 -0.07 1.61 1.02 -1.26 -3.66 120.64 115.76 1za2 n GLU 52 Ca -0.15 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 56.99 1za2 n GLU 52 Cb 0.61 -1.26 0.00 0.00 -0.02 0.00 0.00 31.44 30.78 1za2 n GLU 52 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1za2 n MET 53 N -0.76 0.00 0.00 3.49 0.00 -1.26 -5.07 117.12 113.52 1za2 n MET 53 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 57.70 57.78 1za2 n MET 53 Cb 0.04 0.00 0.00 0.00 0.00 0.00 0.00 33.22 33.26 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 0.00 1.27 3.12 3.17 0.00 -1.24 -4.73 105.19 106.79 1za2 n GLY 54 Ca 0.00 0.01 -0.25 0.00 0.00 0.00 0.00 46.02 45.78 1za2 n GLY 54 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1za2 s ARG 55 N 0.00 1.60 0.21 1.61 6.06 -1.26 0.92 118.95 128.09 1za2 s ARG 55 Ca 0.00 -0.57 -0.01 0.00 -2.50 0.00 0.00 55.73 52.65 1za2 s ARG 55 Cb 0.00 -1.43 -0.04 0.00 0.06 0.00 0.00 34.95 33.54 1za2 s ARG 55 CO 0.00 0.26 0.15 -1.59 -2.50 0.00 0.00 175.30 171.62 1za2 s LYS 56 N -0.04 1.26 0.20 5.12 -2.85 0.14 -3.82 119.74 119.75 1za2 s LYS 56 Ca -0.01 -1.65 0.08 0.00 -1.00 0.00 0.00 55.97 53.38 1za2 s LYS 56 Cb -0.10 0.28 -0.04 0.00 -2.06 0.00 0.00 37.83 35.91 1za2 s LYS 56 CO 0.01 -0.42 -0.02 -0.51 0.10 0.00 0.00 175.35 174.52 1za2 s ASP 57 N -3.17 4.63 -0.06 0.03 -0.00 0.93 -0.23 116.67 118.79 1za2 s ASP 57 Ca 0.39 -0.49 -0.03 0.00 -0.00 0.00 0.00 52.55 52.42 1za2 s ASP 57 Cb 0.06 -0.92 0.04 0.00 -0.00 0.00 0.00 42.92 42.10 1za2 s ASP 57 CO 0.13 0.07 0.13 -0.22 -0.00 0.00 0.00 175.17 175.28 1za2 s LEU 58 N -3.12 0.54 -0.09 1.23 2.96 0.11 -2.40 118.68 117.92 1za2 s LEU 58 Ca 0.28 0.26 0.04 0.00 -0.22 0.00 0.00 54.13 54.49 1za2 s LEU 58 Cb -0.08 0.26 -0.01 0.00 0.50 0.00 0.00 46.19 46.86 1za2 s LEU 58 CO 0.18 -0.17 -0.21 -0.63 -1.32 0.00 0.00 176.35 174.20 1za2 s ILE 59 N 1.48 2.35 -0.13 6.68 1.01 -0.71 -0.77 121.20 131.11 1za2 s ILE 59 Ca -0.06 -0.94 0.01 0.00 0.00 0.00 0.00 60.65 59.67 1za2 s ILE 59 Cb -0.12 -1.91 0.02 0.00 0.01 0.00 0.00 42.46 40.46 1za2 s ILE 59 CO -0.05 0.56 -0.17 -0.54 0.00 0.00 0.00 174.94 174.74 1za2 s LYS 60 N 0.07 2.46 -0.26 2.79 1.02 -0.56 0.16 119.74 125.42 1za2 s LYS 60 Ca -0.09 -0.64 0.01 0.00 0.02 0.00 0.00 55.97 55.27 1za2 s LYS 60 Cb -0.15 -2.12 0.07 0.00 -0.52 0.00 0.00 37.83 35.11 1za2 s LYS 60 CO 0.06 -0.12 -0.02 0.42 -0.92 0.00 0.00 175.35 174.77 1za2 s ILE 61 N 1.15 1.52 0.33 2.17 1.01 -0.06 -2.15 121.20 125.17 1za2 s ILE 61 Ca -0.02 -1.38 -0.29 0.00 0.00 0.00 0.00 60.65 58.96 1za2 s ILE 61 Cb -0.14 -1.88 -0.10 0.00 0.01 0.00 0.00 42.46 40.35 1za2 s ILE 61 CO -0.06 -0.25 1.31 -0.70 0.00 0.00 0.00 174.94 175.24 1za2 s GLU 62 N 1.37 4.35 -1.36 2.79 2.12 -0.96 -1.74 118.70 125.27 1za2 s GLU 62 Ca -0.01 2.22 -0.08 0.00 0.36 0.00 0.00 54.97 57.45 1za2 s GLU 62 Cb -0.19 -3.07 0.05 0.00 0.26 0.00 0.00 34.13 31.19 1za2 s GLU 62 CO -0.09 -0.19 0.54 0.09 -0.54 0.00 0.00 175.26 175.07 1za2 n ASN 63 N 0.80 -4.39 -3.99 -1.70 3.02 -0.40 -4.68 115.26 103.92 1za2 n ASN 63 Ca -0.00 -0.38 -0.13 0.00 -0.03 0.00 0.00 54.58 54.05 1za2 n ASN 63 Cb 0.42 -3.60 -0.12 0.00 -0.61 0.00 0.00 39.78 35.87 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 -3.01 0.32 0.07 3.41 2.01 -1.22 -5.00 115.64 112.23 1za2 s THR 64 Ca 0.38 -0.67 0.01 0.00 0.31 0.00 0.00 61.69 61.72 1za2 s THR 64 Cb -0.19 -0.37 -0.04 0.00 0.01 0.00 0.00 72.50 71.91 1za2 s THR 64 CO 0.47 -0.23 -0.06 -0.36 -0.69 0.00 0.00 174.62 173.75 1za2 s PHE 65 N -0.89 0.72 -0.12 4.92 0.40 -1.26 -2.19 117.98 119.56 1za2 s PHE 65 Ca -0.07 -0.85 0.03 0.00 -0.60 0.00 0.00 56.93 55.44 1za2 s PHE 65 Cb -0.07 -0.44 0.00 0.00 0.51 0.00 0.00 43.02 43.02 1za2 s PHE 65 CO -0.00 -0.20 -0.21 -0.51 0.70 0.00 0.00 175.22 175.00 1za2 s LEU 66 N -2.64 2.19 0.73 -0.37 1.43 -1.26 -5.10 118.68 113.68 1za2 s LEU 66 Ca 0.05 -0.55 -0.15 0.00 -1.03 0.00 0.00 54.13 52.45 1za2 s LEU 66 Cb 0.02 -1.46 0.04 0.00 0.03 0.00 0.00 46.19 44.83 1za2 s LEU 66 CO -0.05 0.13 1.22 -0.94 0.23 0.00 0.00 176.35 176.94 1za2 s SER 67 N 0.55 4.12 0.22 2.29 1.04 -1.26 -4.75 113.70 115.91 1za2 s SER 67 Ca -0.13 2.41 0.11 0.00 0.48 0.00 0.00 55.95 58.82 1za2 s SER 67 Cb -0.17 -2.59 0.62 0.00 0.10 0.00 0.00 66.02 63.98 1za2 s SER 67 CO 0.04 -2.32 1.27 1.21 0.98 0.00 0.00 173.24 174.42 1za2 n GLU 68 N -2.72 0.08 -0.01 4.02 2.13 -1.26 0.23 120.64 123.10 1za2 n GLU 68 Ca 0.14 0.53 -0.11 0.00 0.66 0.00 0.00 57.16 58.38 1za2 n GLU 68 Cb 0.50 -1.91 -0.14 0.00 0.27 0.00 0.00 31.44 30.16 1za2 n GLU 68 CO 0.00 0.00 0.00 -0.44 -0.41 0.00 0.00 177.13 176.28 1za2 h ASP 69 N 0.00 0.09 0.80 4.31 3.32 -2.00 -3.01 116.42 119.92 1za2 h ASP 69 Ca 0.00 -0.19 -0.04 0.00 0.02 0.00 0.00 57.03 56.82 1za2 h ASP 69 Cb 0.33 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.84 1za2 h ASP 69 CO 0.00 1.17 -0.17 1.56 -1.72 0.00 0.00 179.24 180.08 1za2 h GLN 70 N 0.02 0.00 0.15 3.56 4.20 -0.53 -2.76 115.11 119.75 1za2 h GLN 70 Ca -0.30 0.00 -0.20 0.00 0.06 0.00 0.00 58.65 58.21 1za2 h GLN 70 Cb 2.01 0.00 0.02 0.00 0.30 0.00 0.00 27.48 29.81 1za2 h GLN 70 CO 0.09 0.17 -0.87 0.28 -0.67 0.00 0.00 178.83 177.82 1za2 h VAL 71 N 0.00 1.49 -0.34 -0.54 2.07 -1.51 -3.28 116.25 114.13 1za2 h VAL 71 Ca -0.00 -2.55 0.09 0.00 0.82 0.00 0.00 66.70 65.06 1za2 h VAL 71 Cb 0.61 3.19 -0.02 0.00 -1.52 0.00 0.00 31.29 33.55 1za2 h VAL 71 CO 0.02 0.72 0.24 0.44 0.02 0.00 0.00 177.57 179.02 1za2 h ASP 72 N -0.33 0.06 0.20 0.57 3.45 -1.37 0.15 116.42 119.14 1za2 h ASP 72 Ca -0.15 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.31 1za2 h ASP 72 Cb 1.68 -0.01 0.00 0.00 -0.56 0.00 0.00 39.33 40.44 1za2 h ASP 72 CO 0.16 0.04 0.00 0.00 -1.57 0.00 0.00 179.24 177.87 1za2 n GLN 73 N -4.45 0.03 0.08 3.56 1.13 -1.06 -1.16 117.38 115.51 1za2 n GLN 73 Ca 0.05 0.34 0.12 0.00 -1.94 0.00 0.00 57.00 55.57 1za2 n GLN 73 Cb 0.38 -1.50 0.10 0.00 0.11 0.00 0.00 30.24 29.33 1za2 n GLN 73 CO 0.00 0.00 0.00 -0.07 -1.44 0.00 0.00 177.06 175.55 1za2 h LEU 74 N 0.00 0.00 -0.93 1.08 3.38 -0.86 -3.41 115.31 114.58 1za2 h LEU 74 Ca 0.00 -0.15 0.11 0.00 0.09 0.00 0.00 57.88 57.93 1za2 h LEU 74 Cb 0.10 0.00 -0.13 0.00 0.09 0.00 0.00 40.66 40.72 1za2 h LEU 74 CO 0.00 0.07 -0.50 0.00 0.09 0.00 0.00 178.44 178.11 1za2 h ALA 75 N 2.33 -0.28 0.00 1.53 0.00 -1.26 0.33 119.26 121.91 1za2 h ALA 75 Ca 0.00 0.17 0.00 0.00 0.00 0.00 0.00 54.91 55.08 1za2 h ALA 75 Cb 0.84 1.19 0.00 0.00 0.00 0.00 0.00 17.79 19.81 1za2 h ALA 75 CO 0.00 -0.83 0.00 1.28 0.00 0.00 0.00 179.25 179.70 1za2 n LEU 76 N -5.35 0.56 -0.06 0.00 4.77 -1.26 -2.44 117.00 113.21 1za2 n LEU 76 Ca 0.05 0.71 -0.10 0.00 -0.03 0.00 0.00 56.01 56.64 1za2 n LEU 76 Cb 0.32 -0.72 -0.06 0.00 -2.33 0.00 0.00 43.42 40.64 1za2 n LEU 76 CO -0.13 -0.78 -0.92 -1.22 -1.33 0.00 0.00 177.39 173.01 1za2 n TYR 77 N -2.20 0.00 -3.38 -1.77 4.01 -0.36 -4.87 117.16 108.60 1za2 n TYR 77 Ca -0.00 0.00 -0.26 0.00 -0.16 0.00 0.00 57.90 57.48 1za2 n TYR 77 Cb 0.10 -0.49 -0.09 0.00 -0.31 0.00 0.00 39.34 38.56 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 -2.99 2.91 0.09 -0.72 0.00 0.10 -4.75 120.51 115.16 1za2 n ALA 78 Ca -0.23 -3.58 0.01 0.00 0.00 0.00 0.00 53.44 49.63 1za2 n ALA 78 Cb 0.73 -0.82 0.33 0.00 0.00 0.00 0.00 19.45 19.68 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 4.82 0.29 -0.84 0.00 0.13 -1.65 -2.97 132.00 131.78 1za2 h PRO 79 Ca 0.17 -0.08 -0.48 0.00 -0.87 0.00 0.00 66.00 64.74 1za2 h PRO 79 Cb 0.85 -0.03 -0.27 0.00 0.13 0.00 0.00 31.00 31.68 1za2 h PRO 79 CO 0.50 0.47 0.46 1.04 -0.23 0.00 0.00 178.00 180.24 1za2 n GLN 80 N -4.21 2.33 -2.67 0.86 3.00 -1.26 -4.50 117.38 110.94 1za2 n GLN 80 Ca -0.01 -3.19 -0.23 0.00 -0.01 0.00 0.00 57.00 53.56 1za2 n GLN 80 Cb 0.32 -2.13 0.03 0.00 0.00 0.00 0.00 30.24 28.46 1za2 n GLN 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1za2 s ALA 81 N -3.43 3.64 -0.11 -1.58 0.00 -1.12 -4.86 121.76 114.29 1za2 s ALA 81 Ca 0.56 -1.05 -0.02 0.00 0.00 0.00 0.00 51.96 51.45 1za2 s ALA 81 Cb 0.47 -2.27 0.04 0.00 0.00 0.00 0.00 23.12 21.35 1za2 s ALA 81 CO 0.05 -0.68 0.00 0.99 0.00 0.00 0.00 175.76 176.12 1za2 s THR 82 N -2.79 0.51 0.03 0.00 2.01 0.55 -4.25 115.64 111.70 1za2 s THR 82 Ca 0.54 -0.13 -0.18 0.00 0.31 0.00 0.00 61.69 62.22 1za2 s THR 82 Cb -0.10 -0.75 -0.06 0.00 0.01 0.00 0.00 72.50 71.60 1za2 s THR 82 CO 0.40 0.14 0.52 -0.69 -0.69 0.00 0.00 174.62 174.30 1za2 s VAL 83 N 1.90 4.88 0.01 3.82 1.01 0.02 -0.68 120.40 131.35 1za2 s VAL 83 Ca 0.03 1.09 0.07 0.00 0.00 0.00 0.00 61.98 63.17 1za2 s VAL 83 Cb -0.14 -3.84 -0.02 0.00 0.00 0.00 0.00 36.38 32.38 1za2 s VAL 83 CO -0.06 0.53 -0.22 0.20 0.00 0.00 0.00 175.10 175.54 1za2 s ASN 84 N -0.87 2.63 0.00 3.32 0.01 -0.98 -0.24 114.94 118.81 1za2 s ASN 84 Ca 0.27 -0.45 0.25 0.00 -0.71 0.00 0.00 52.86 52.22 1za2 s ASN 84 Cb -0.18 -0.27 0.45 0.00 0.41 0.00 0.00 41.25 41.66 1za2 s ASN 84 CO 0.16 0.24 1.37 0.54 -1.51 0.00 0.00 177.10 177.91 1za2 n ARG 85 N 2.28 0.24 0.00 -0.60 5.12 -1.12 -2.03 116.66 120.55 1za2 n ARG 85 Ca -0.16 -0.15 0.00 0.00 -1.93 0.00 0.00 57.85 55.61 1za2 n ARG 85 Cb 0.53 -1.50 0.00 0.00 -1.16 0.00 0.00 32.46 30.33 1za2 n ARG 85 CO 0.00 0.00 0.00 0.44 -1.93 0.00 0.00 177.63 176.14 1za2 n ILE 86 N -1.25 0.00 -3.92 0.55 -6.64 -1.21 -4.15 119.36 102.74 1za2 n ILE 86 Ca 0.07 0.00 -0.13 0.00 -1.77 0.00 0.00 62.75 60.92 1za2 n ILE 86 Cb 0.34 0.00 -0.14 0.00 -1.44 0.00 0.00 39.64 38.40 1za2 n ILE 86 CO 0.00 0.00 0.00 -0.62 -1.77 0.00 0.00 176.55 174.16 1za2 s ASP 87 N 0.00 0.16 -1.44 7.28 -1.08 0.41 -0.25 116.67 121.74 1za2 s ASP 87 Ca 0.00 -0.02 -0.09 0.00 -0.52 0.00 0.00 52.55 51.92 1za2 s ASP 87 Cb 0.00 -0.04 0.05 0.00 -1.46 0.00 0.00 42.92 41.47 1za2 s ASP 87 CO 0.00 -0.01 0.95 0.59 0.52 0.00 0.00 175.17 177.22 1za2 n ASN 88 N 3.25 -4.12 -0.29 -0.34 4.13 -1.23 -1.04 115.26 115.62 1za2 n ASN 88 Ca -0.15 -0.75 -0.04 0.00 1.68 0.00 0.00 54.58 55.33 1za2 n ASN 88 Cb 0.58 -4.15 -0.02 0.00 -1.54 0.00 0.00 39.78 34.65 1za2 n ASN 88 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 1za2 n TYR 89 N -4.63 0.00 -5.14 3.10 4.01 -1.05 -4.98 117.16 108.47 1za2 n TYR 89 Ca -0.05 0.00 -0.31 0.00 -0.16 0.00 0.00 57.90 57.38 1za2 n TYR 89 Cb 0.57 -1.72 -0.17 0.00 -0.31 0.00 0.00 39.34 37.71 1za2 n TYR 89 CO 0.00 0.00 0.00 -1.21 -0.46 0.00 0.00 176.86 175.19 1za2 s GLU 90 N -1.88 2.83 -1.05 -0.72 2.02 -0.21 -5.04 118.70 114.65 1za2 s GLU 90 Ca 0.00 -0.82 -0.25 0.00 0.02 0.00 0.00 54.97 53.92 1za2 s GLU 90 Cb 0.00 -2.17 -0.14 0.00 0.10 0.00 0.00 34.13 31.92 1za2 s GLU 90 CO 0.00 0.18 2.07 0.08 0.02 0.00 0.00 175.26 177.61 1za2 s VAL 91 N 0.33 3.26 0.00 2.63 1.01 -1.26 -0.45 120.40 125.93 1za2 s VAL 91 Ca -0.17 -0.39 0.00 0.00 0.00 0.00 0.00 61.98 61.42 1za2 s VAL 91 Cb -0.17 -4.05 0.00 0.00 0.00 0.00 0.00 36.38 32.16 1za2 s VAL 91 CO 0.08 -0.50 0.23 0.52 0.00 0.00 0.00 175.10 175.43 1za2 n VAL 92 N 8.42 0.00 -3.83 2.92 0.31 -1.26 -4.73 118.33 120.16 1za2 n VAL 92 Ca 0.43 0.73 -0.27 0.00 -0.01 0.00 0.00 64.34 65.22 1za2 n VAL 92 Cb 0.46 -1.47 -0.17 0.00 -0.91 0.00 0.00 33.84 31.76 1za2 n VAL 92 CO 0.00 0.00 0.00 -0.83 -1.32 0.00 0.00 176.83 174.68 1za2 s GLY 93 N 0.00 0.81 0.62 2.92 0.00 -1.26 -4.94 107.32 105.47 1za2 s GLY 93 Ca 0.00 -0.68 -0.11 0.00 0.00 0.00 0.00 44.72 43.93 1za2 s GLY 93 CO 0.00 1.10 1.03 0.54 0.00 0.00 0.00 173.10 175.77 1za2 s LYS 94 N 1.75 3.53 -0.17 2.90 1.02 -1.26 -2.78 119.74 124.73 1za2 s LYS 94 Ca 0.01 0.80 -0.22 0.00 0.02 0.00 0.00 55.97 56.58 1za2 s LYS 94 Cb -0.15 -2.07 0.06 0.00 -0.52 0.00 0.00 37.83 35.14 1za2 s LYS 94 CO -0.07 -0.63 0.57 -1.54 -0.92 0.00 0.00 175.35 172.76 1za2 s SER 95 N -4.02 -0.58 -0.11 2.83 1.04 0.67 -4.97 113.70 108.57 1za2 s SER 95 Ca 0.56 0.98 -0.05 0.00 0.48 0.00 0.00 55.95 57.92 1za2 s SER 95 Cb -0.11 0.98 -0.04 0.00 0.10 0.00 0.00 66.02 66.95 1za2 s SER 95 CO 0.52 -0.30 0.08 -0.13 0.98 0.00 0.00 173.24 174.39 1za2 s ARG 96 N -0.14 3.28 -0.08 4.02 1.81 -1.26 -0.80 118.95 125.78 1za2 s ARG 96 Ca -0.03 -0.25 -0.30 0.00 -1.72 0.00 0.00 55.73 53.43 1za2 s ARG 96 Cb -0.03 -3.03 -0.05 0.00 -0.45 0.00 0.00 34.95 31.38 1za2 s ARG 96 CO 0.03 0.72 1.67 -2.14 -0.68 0.00 0.00 175.30 174.90 1za2 s PRO 97 N -0.89 4.10 0.04 3.54 0.02 -1.26 -4.90 135.00 135.64 1za2 s PRO 97 Ca 0.14 2.12 0.03 0.00 0.02 0.00 0.00 61.00 63.31 1za2 s PRO 97 Cb -0.12 -4.01 -0.04 0.00 0.02 0.00 0.00 34.50 30.36 1za2 s PRO 97 CO 0.03 -0.95 -0.00 -1.54 -0.33 0.00 0.00 177.00 174.21 1za2 s SER 98 N 3.64 5.07 -0.10 2.53 1.04 -1.26 -4.78 113.70 119.84 1za2 s SER 98 Ca 0.74 -0.08 -0.33 0.00 0.48 0.00 0.00 55.95 56.76 1za2 s SER 98 Cb -0.32 -1.28 -0.11 0.00 0.10 0.00 0.00 66.02 64.41 1za2 s SER 98 CO 0.30 0.24 1.94 -0.11 0.98 0.00 0.00 173.24 176.59 1za2 n LEU 99 N 1.06 3.47 -4.87 2.42 7.94 -1.26 -4.33 117.00 121.43 1za2 n LEU 99 Ca -0.13 0.87 -0.29 0.00 -1.11 0.00 0.00 56.01 55.35 1za2 n LEU 99 Cb 0.52 -1.40 0.14 0.00 0.53 0.00 0.00 43.42 43.21 1za2 n LEU 99 CO 0.36 -0.10 0.79 -2.16 -1.11 0.00 0.00 177.39 175.17 1za2 s PRO 100 N 4.46 1.18 0.00 1.96 0.04 -1.26 -4.98 135.00 136.40 1za2 s PRO 100 Ca 0.94 -0.03 0.21 0.00 0.04 0.00 0.00 61.00 62.16 1za2 s PRO 100 Cb -0.64 -1.87 0.28 0.00 0.04 0.00 0.00 34.50 32.30 1za2 s PRO 100 CO 0.49 -2.11 1.26 -0.85 0.04 0.00 0.00 177.00 175.83 1za2 n GLU 101 N -3.64 2.16 -3.67 4.56 0.28 -1.26 -4.56 120.64 114.52 1za2 n GLU 101 Ca 0.10 -1.97 -0.11 0.00 -0.16 0.00 0.00 57.16 55.02 1za2 n GLU 101 Cb 0.60 -1.44 -0.08 0.00 1.43 0.00 0.00 31.44 31.95 1za2 n GLU 101 CO 0.00 0.00 0.00 1.03 -0.16 0.00 0.00 177.13 178.00 1za2 s ARG 102 N -1.58 0.65 -0.13 3.44 0.52 -1.26 -1.59 118.95 119.00 1za2 s ARG 102 Ca 0.30 0.92 0.00 0.00 -0.52 0.00 0.00 55.73 56.43 1za2 s ARG 102 Cb 0.19 0.23 0.02 0.00 0.52 0.00 0.00 34.95 35.91 1za2 s ARG 102 CO 0.28 -0.11 -0.12 0.42 0.02 0.00 0.00 175.30 175.78 1za2 s ILE 103 N 0.82 1.39 0.42 1.52 1.01 -0.72 -4.95 121.20 120.68 1za2 s ILE 103 Ca -0.04 -0.53 0.07 0.00 0.00 0.00 0.00 60.65 60.15 1za2 s ILE 103 Cb -0.05 -1.32 -0.07 0.00 0.01 0.00 0.00 42.46 41.03 1za2 s ILE 103 CO -0.06 0.43 0.05 -1.81 0.00 0.00 0.00 174.94 173.55 1za2 s ASP 104 N 1.45 4.03 0.00 3.58 -0.00 -1.26 -1.08 116.67 123.38 1za2 s ASP 104 Ca 0.03 -1.31 0.00 0.00 -0.00 0.00 0.00 52.55 51.27 1za2 s ASP 104 Cb -0.13 -0.38 0.00 0.00 -0.00 0.00 0.00 42.92 42.41 1za2 s ASP 104 CO -0.08 -0.49 0.00 0.59 -0.00 0.00 0.00 175.17 175.19 1za2 n ASN 105 N -1.05 0.00 -0.09 0.27 3.02 -0.73 -4.37 115.26 112.31 1za2 n ASN 105 Ca -0.05 0.00 -0.14 0.00 -0.03 0.00 0.00 54.58 54.36 1za2 n ASN 105 Cb 0.66 0.00 -0.04 0.00 -0.61 0.00 0.00 39.78 39.79 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 1.28 -4.40 2.41 -1.51 -1.87 -3.42 116.25 108.74 1za2 h VAL 106 Ca 0.00 -1.64 -0.50 0.00 -1.23 0.00 0.00 66.70 63.33 1za2 h VAL 106 Cb 0.00 1.59 0.07 0.00 -2.13 0.00 0.00 31.29 30.83 1za2 h VAL 106 CO 0.00 0.53 0.41 -0.76 -1.23 0.00 0.00 177.57 176.52 1za2 s LEU 107 N -8.79 3.03 -0.06 4.19 1.43 -1.26 -5.08 118.68 112.14 1za2 s LEU 107 Ca -0.11 1.31 0.03 0.00 -1.03 0.00 0.00 54.13 54.33 1za2 s LEU 107 Cb 0.10 -4.20 0.00 0.00 0.03 0.00 0.00 46.19 42.12 1za2 s LEU 107 CO 0.87 -1.20 -0.15 -0.69 0.23 0.00 0.00 176.35 175.41 1za2 s VAL 108 N -3.24 1.34 0.02 -1.59 1.01 -1.26 -4.71 120.40 111.97 1za2 s VAL 108 Ca 0.57 -0.63 -0.30 0.00 0.00 0.00 0.00 61.98 61.61 1za2 s VAL 108 Cb -0.12 -1.18 -0.05 0.00 0.00 0.00 0.00 36.38 35.04 1za2 s VAL 108 CO 0.53 0.39 1.24 0.00 0.00 0.00 0.00 175.10 177.27 1za2 h PRO 110 N 7.18 0.00 -6.12 0.00 0.11 -1.93 -3.41 132.00 127.83 1za2 h PRO 110 Ca -0.39 0.00 -0.54 0.00 0.11 0.00 0.00 66.00 65.18 1za2 h PRO 110 Cb 1.19 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.27 1za2 h PRO 110 CO 0.85 0.28 1.33 1.21 -0.21 0.00 0.00 178.00 181.45 1za2 s ASN 111 N -6.79 5.56 0.55 -2.05 2.47 -1.26 -4.83 114.94 108.60 1za2 s ASN 111 Ca -0.03 0.90 0.28 0.00 0.42 0.00 0.00 52.86 54.43 1za2 s ASN 111 Cb 0.14 -2.53 1.60 0.00 -1.45 0.00 0.00 41.25 39.02 1za2 s ASN 111 CO 0.69 -2.04 2.15 0.77 -3.72 0.00 0.00 177.10 174.95 1za2 h SER 112 N 14.08 0.00 -0.28 -4.21 4.64 -2.03 -1.20 113.55 124.55 1za2 h SER 112 Ca -0.30 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.02 1za2 h SER 112 Cb 1.17 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.26 1za2 h SER 112 CO 1.11 0.07 0.00 -3.20 -0.87 0.00 0.00 176.83 173.94 1za2 n ASN 113 N -3.76 1.54 -4.74 4.97 5.15 -1.26 -4.88 115.26 112.28 1za2 n ASN 113 Ca -0.02 -1.97 -0.41 0.00 -0.60 0.00 0.00 54.58 51.57 1za2 n ASN 113 Cb 0.17 -0.19 -0.04 0.00 -0.53 0.00 0.00 39.78 39.20 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 3.75 0.34 -0.37 0.00 6.09 -1.90 -2.98 117.51 122.44 1za2 h ILE 115 Ca -0.44 -0.00 0.09 0.00 -1.37 0.00 0.00 64.86 63.14 1za2 h ILE 115 Cb 1.21 1.00 -0.02 0.00 0.47 0.00 0.00 36.82 39.49 1za2 h ILE 115 CO 0.73 0.00 0.26 0.77 -3.07 0.00 0.00 178.15 176.85 1za2 h SER 116 N 0.00 0.07 -0.03 2.19 4.64 -1.91 -2.97 113.55 115.54 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 0.00 -0.01 -0.00 0.00 -0.31 0.00 0.00 62.40 62.08 1za2 h SER 116 CO 0.00 0.05 -0.01 0.45 -0.87 0.00 0.00 176.83 176.45 1za2 h HIS 117 N 0.08 0.07 -0.00 4.77 3.86 -1.89 -3.30 115.15 118.74 1za2 h HIS 117 Ca 0.18 -0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.37 1za2 h HIS 117 Cb 0.59 -0.02 0.00 0.00 1.06 0.00 0.00 27.41 29.05 1za2 h HIS 117 CO -0.00 0.42 -0.22 0.00 0.86 0.00 0.00 177.93 178.99 1za2 n ALA 118 N -2.30 2.96 -2.63 2.45 0.00 -1.16 -4.92 120.51 114.91 1za2 n ALA 118 Ca -0.08 -0.30 -0.27 0.00 0.00 0.00 0.00 53.44 52.80 1za2 n ALA 118 Cb 0.21 -1.26 -0.08 0.00 0.00 0.00 0.00 19.45 18.32 1za2 n ALA 118 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1za2 s GLU 119 N -2.67 2.29 -1.24 0.00 0.41 -1.13 -5.03 118.70 111.34 1za2 s GLU 119 Ca 0.22 -1.15 -0.12 0.00 -0.41 0.00 0.00 54.97 53.51 1za2 s GLU 119 Cb 0.19 -2.30 -0.06 0.00 -1.78 0.00 0.00 34.13 30.18 1za2 s GLU 119 CO 0.54 0.45 2.37 -0.35 -0.49 0.00 0.00 175.26 177.78 1za2 n PRO 120 N -0.03 2.66 -4.26 0.39 -0.04 -1.26 -4.85 135.00 127.60 1za2 n PRO 120 Ca -0.10 -2.03 -0.19 0.00 -0.04 0.00 0.00 63.50 61.14 1za2 n PRO 120 Cb 0.55 -2.84 -0.13 0.00 -0.04 0.00 0.00 33.50 31.04 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 3.27 1.07 0.20 0.52 -7.23 -1.26 -5.14 120.40 111.84 1za2 s VAL 121 Ca 0.54 -1.11 -0.30 0.00 -1.81 0.00 0.00 61.98 59.30 1za2 s VAL 121 Cb 0.14 -1.00 -0.08 0.00 0.56 0.00 0.00 36.38 36.00 1za2 s VAL 121 CO -0.03 -0.10 1.00 -0.55 -0.31 0.00 0.00 175.10 175.11 1za2 s SER 122 N -1.38 7.48 0.88 4.85 0.15 -1.26 -4.97 113.70 119.45 1za2 s SER 122 Ca -0.00 2.00 -0.11 0.00 0.70 0.00 0.00 55.95 58.53 1za2 s SER 122 Cb -0.09 -2.61 0.12 0.00 -1.71 0.00 0.00 66.02 61.74 1za2 s SER 122 CO 0.02 -0.02 1.10 -0.94 1.20 0.00 0.00 173.24 174.60 1za2 s SER 123 N -0.65 3.45 -0.29 5.45 1.04 -1.26 -4.80 113.70 116.64 1za2 s SER 123 Ca 0.45 1.82 -0.16 0.00 0.48 0.00 0.00 55.95 58.54 1za2 s SER 123 Cb -0.27 -2.42 0.14 0.00 0.10 0.00 0.00 66.02 63.57 1za2 s SER 123 CO 0.34 -2.71 0.94 -0.55 0.98 0.00 0.00 173.24 172.24 1za2 s SER 124 N -3.11 -0.58 0.11 7.02 0.15 -1.26 -1.78 113.70 114.25 1za2 s SER 124 Ca 0.64 0.89 0.06 0.00 0.70 0.00 0.00 55.95 58.24 1za2 s SER 124 Cb -0.20 1.36 -0.04 0.00 -1.71 0.00 0.00 66.02 65.44 1za2 s SER 124 CO 0.58 -0.14 -0.15 -0.36 1.20 0.00 0.00 173.24 174.37 1za2 s PHE 125 N 1.66 1.45 -0.09 3.44 0.40 -0.24 -0.90 117.98 123.69 1za2 s PHE 125 Ca -0.08 -0.50 -0.14 0.00 -0.60 0.00 0.00 56.93 55.61 1za2 s PHE 125 Cb -0.05 -0.77 -0.05 0.00 0.51 0.00 0.00 43.02 42.66 1za2 s PHE 125 CO -0.16 0.15 0.36 0.00 0.70 0.00 0.00 175.22 176.26 1za2 s ALA 126 N -1.78 3.63 -0.06 5.36 0.00 0.87 -1.76 121.76 128.02 1za2 s ALA 126 Ca 0.06 -0.34 -0.09 0.00 0.00 0.00 0.00 51.96 51.60 1za2 s ALA 126 Cb -0.07 -2.41 -0.05 0.00 0.00 0.00 0.00 23.12 20.60 1za2 s ALA 126 CO 0.03 0.25 0.24 0.08 0.00 0.00 0.00 175.76 176.36 1za2 s VAL 127 N -0.16 5.34 -0.21 0.00 1.01 -0.62 -1.61 120.40 124.15 1za2 s VAL 127 Ca 0.21 0.37 -0.08 0.00 0.00 0.00 0.00 61.98 62.47 1za2 s VAL 127 Cb -0.15 -3.52 0.09 0.00 0.00 0.00 0.00 36.38 32.81 1za2 s VAL 127 CO 0.08 0.55 0.47 -0.60 0.00 0.00 0.00 175.10 175.60 1za2 s ARG 128 N -1.20 0.39 0.11 2.72 3.52 -0.63 -4.79 118.95 119.05 1za2 s ARG 128 Ca 0.20 1.09 -0.28 0.00 -0.13 0.00 0.00 55.73 56.61 1za2 s ARG 128 Cb -0.14 0.38 -0.06 0.00 -1.56 0.00 0.00 34.95 33.57 1za2 s ARG 128 CO 0.09 -0.23 0.88 0.21 -0.81 0.00 0.00 175.30 175.44 1za2 s LYS 129 N 2.50 4.63 -0.01 5.12 2.20 -1.26 0.44 119.74 133.36 1za2 s LYS 129 Ca -0.04 1.30 0.02 0.00 -0.36 0.00 0.00 55.97 56.89 1za2 s LYS 129 Cb -0.11 -3.35 0.03 0.00 -1.51 0.00 0.00 37.83 32.88 1za2 s LYS 129 CO -0.14 0.30 0.87 0.54 -0.36 0.00 0.00 175.35 176.56 1za2 n ARG 130 N 2.56 1.87 -1.51 4.03 1.74 -0.72 -4.90 116.66 119.72 1za2 n ARG 130 Ca -0.00 -1.30 0.00 0.00 -0.77 0.00 0.00 57.85 55.78 1za2 n ARG 130 Cb 0.49 -0.88 0.00 0.00 -1.02 0.00 0.00 32.46 31.05 1za2 n ARG 130 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1za2 n ALA 131 N -0.43 -2.40 0.00 7.54 0.00 -1.26 -4.62 120.51 119.34 1za2 n ALA 131 Ca 0.01 0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.76 1za2 n ALA 131 Cb 0.38 -1.09 0.00 0.00 0.00 0.00 0.00 19.45 18.74 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 1.20 0.00 -2.63 0.00 4.13 -1.26 -4.93 115.26 111.77 1za2 n ASN 132 Ca 0.00 0.00 -0.11 0.00 1.68 0.00 0.00 54.58 56.15 1za2 n ASN 132 Cb 0.00 0.00 -0.01 0.00 -1.54 0.00 0.00 39.78 38.23 1za2 n ASN 132 CO 0.00 0.00 0.00 -0.90 0.28 0.00 0.00 177.26 176.64 1za2 n ASP 133 N 1.30 -1.33 -4.13 6.41 3.85 -1.26 -5.09 116.55 116.30 1za2 n ASP 133 Ca 0.00 -2.53 -0.29 0.00 -0.71 0.00 0.00 54.79 51.27 1za2 n ASP 133 Cb 0.00 2.39 -0.17 0.00 -1.35 0.00 0.00 41.12 41.99 1za2 n ASP 133 CO 0.00 0.00 0.00 -0.63 -1.01 0.00 0.00 177.20 175.56 1za2 s ILE 134 N -2.63 1.63 -0.05 2.12 1.01 -1.26 -1.76 121.20 120.26 1za2 s ILE 134 Ca 0.22 -0.77 -0.20 0.00 0.00 0.00 0.00 60.65 59.90 1za2 s ILE 134 Cb -0.02 -1.44 -0.05 0.00 0.01 0.00 0.00 42.46 40.97 1za2 s ILE 134 CO 0.16 0.46 0.58 0.00 0.00 0.00 0.00 174.94 176.14 1za2 s ALA 135 N 0.50 3.46 -0.17 9.38 0.00 0.17 -0.11 121.76 134.99 1za2 s ALA 135 Ca -0.17 -0.01 0.01 0.00 0.00 0.00 0.00 51.96 51.79 1za2 s ALA 135 Cb -0.17 -2.75 0.02 0.00 0.00 0.00 0.00 23.12 20.22 1za2 s ALA 135 CO 0.06 0.08 -0.19 -0.51 0.00 0.00 0.00 175.76 175.20 1za2 s LEU 136 N 0.20 2.06 -0.23 0.00 1.43 0.46 -1.61 118.68 120.98 1za2 s LEU 136 Ca 0.31 -0.62 -0.06 0.00 -1.03 0.00 0.00 54.13 52.73 1za2 s LEU 136 Cb -0.17 -1.43 -0.02 0.00 0.03 0.00 0.00 46.19 44.60 1za2 s LEU 136 CO 0.15 -0.00 0.01 -0.75 0.23 0.00 0.00 176.35 175.99 1za2 s LYS 137 N 1.28 3.51 0.06 1.70 2.20 -0.63 -0.73 119.74 127.13 1za2 s LYS 137 Ca 0.04 -0.55 -0.31 0.00 -0.36 0.00 0.00 55.97 54.79 1za2 s LYS 137 Cb -0.13 -3.16 -0.07 0.00 -1.51 0.00 0.00 37.83 32.96 1za2 s LYS 137 CO -0.12 -0.19 1.38 0.00 -0.36 0.00 0.00 175.35 176.06 1za2 h LYS 139 N 7.27 0.77 0.03 0.00 3.64 -1.38 0.62 116.57 127.52 1za2 h LYS 139 Ca -0.40 -0.05 -0.00 0.00 -1.27 0.00 0.00 60.65 58.93 1za2 h LYS 139 Cb 1.20 -0.17 0.00 0.00 -0.41 0.00 0.00 32.23 32.84 1za2 h LYS 139 CO 0.88 0.51 -0.01 1.88 -2.27 0.00 0.00 179.45 180.43 1za2 h TYR 140 N 0.79 -0.04 0.38 1.91 0.05 -1.92 -3.39 116.97 114.76 1za2 h TYR 140 Ca 0.43 -0.00 -0.01 0.00 0.05 0.00 0.00 58.73 59.20 1za2 h TYR 140 Cb 0.45 0.01 -0.02 0.00 1.01 0.00 0.00 36.73 38.19 1za2 h TYR 140 CO -0.06 0.58 -0.41 0.00 -1.05 0.00 0.00 178.16 177.23 1za2 n GLU 142 N -4.86 0.00 -2.84 0.00 1.02 0.22 -5.00 120.64 109.18 1za2 n GLU 142 Ca -0.09 0.00 -0.38 0.00 -0.02 0.00 0.00 57.16 56.67 1za2 n GLU 142 Cb 0.37 -1.87 -0.06 0.00 -0.02 0.00 0.00 31.44 29.85 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 -0.27 4.60 -0.10 3.49 -0.14 -1.26 -4.77 119.74 121.29 1za2 s LYS 143 Ca 0.00 1.28 0.01 0.00 -1.36 0.00 0.00 55.97 55.90 1za2 s LYS 143 Cb 0.00 -2.98 -0.02 0.00 -1.68 0.00 0.00 37.83 33.15 1za2 s LYS 143 CO 0.00 0.39 -0.12 -2.00 -0.76 0.00 0.00 175.35 172.86 1za2 s GLU 144 N -1.73 3.10 0.12 1.68 2.12 -1.26 -1.74 118.70 120.98 1za2 s GLU 144 Ca 0.45 -0.66 0.05 0.00 0.36 0.00 0.00 54.97 55.16 1za2 s GLU 144 Cb -0.21 -2.58 -0.04 0.00 0.26 0.00 0.00 34.13 31.57 1za2 s GLU 144 CO 0.26 0.37 -0.11 -0.06 -0.54 0.00 0.00 175.26 175.18 1za2 s PHE 145 N -0.06 1.22 0.32 5.30 0.40 0.09 -4.93 117.98 120.32 1za2 s PHE 145 Ca -0.02 -0.65 -0.28 0.00 -0.60 0.00 0.00 56.93 55.38 1za2 s PHE 145 Cb -0.14 -0.64 -0.09 0.00 0.51 0.00 0.00 43.02 42.65 1za2 s PHE 145 CO 0.04 0.07 1.14 0.45 0.70 0.00 0.00 175.22 177.62 1za2 s SER 146 N -2.64 6.99 0.61 1.36 0.15 -1.26 -0.40 113.70 118.51 1za2 s SER 146 Ca 0.09 2.33 0.32 0.00 0.70 0.00 0.00 55.95 59.40 1za2 s SER 146 Cb -0.02 -2.62 1.82 0.00 -1.71 0.00 0.00 66.02 63.48 1za2 s SER 146 CO 0.01 -0.34 2.15 1.12 1.20 0.00 0.00 173.24 177.38 1za2 h HIS 147 N 3.39 0.00 0.00 3.44 2.07 -0.87 0.49 115.15 123.66 1za2 h HIS 147 Ca -0.48 0.00 -0.03 0.00 -2.85 0.00 0.00 60.37 57.02 1za2 h HIS 147 Cb 1.22 0.00 -0.00 0.00 2.57 0.00 0.00 27.41 31.19 1za2 h HIS 147 CO 0.57 0.00 -0.13 -0.91 -3.07 0.00 0.00 177.93 174.40 1za2 h ASN 148 N 0.00 0.00 0.11 3.10 2.35 -1.89 -0.24 115.58 119.01 1za2 h ASN 148 Ca 0.05 0.00 -0.37 0.00 -0.55 0.00 0.00 56.30 55.43 1za2 h ASN 148 Cb 0.36 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 38.71 1za2 h ASN 148 CO -0.00 0.13 -2.03 0.52 -1.65 0.00 0.00 177.43 174.39 1za2 n VAL 149 N -3.48 1.76 -0.05 2.81 0.31 0.17 -2.86 118.33 116.98 1za2 n VAL 149 Ca -0.01 -0.64 -0.12 0.00 -0.01 0.00 0.00 64.34 63.55 1za2 n VAL 149 Cb 0.28 -1.71 -0.07 0.00 -0.91 0.00 0.00 33.84 31.43 1za2 n VAL 149 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 1za2 h VAL 150 N 0.05 1.31 0.01 2.52 2.07 -1.26 -3.31 116.25 117.64 1za2 h VAL 150 Ca -0.44 -1.09 -0.14 0.00 0.82 0.00 0.00 66.70 65.86 1za2 h VAL 150 Cb 2.01 1.74 0.01 0.00 -1.52 0.00 0.00 31.29 33.53 1za2 h VAL 150 CO 0.07 0.32 -0.55 -0.07 0.02 0.00 0.00 177.57 177.36 1za2 h LEU 151 N -0.05 0.46 -5.79 2.57 -0.00 -1.25 -3.39 115.31 107.86 1za2 h LEU 151 Ca 0.03 -0.78 -0.57 0.00 -0.00 0.00 0.00 57.88 56.56 1za2 h LEU 151 Cb 0.52 -0.14 0.02 0.00 -0.00 0.00 0.00 40.66 41.06 1za2 h LEU 151 CO 0.02 1.19 2.81 0.00 -0.00 0.00 0.00 178.44 182.46 1za2 n ALA 152 N -2.59 4.89 0.68 1.53 0.00 -1.14 -5.09 120.51 118.80 1za2 n ALA 152 Ca -0.11 -2.98 0.08 0.00 0.00 0.00 0.00 53.44 50.43 1za2 n ALA 152 Cb 0.65 -3.35 0.07 0.00 0.00 0.00 0.00 19.45 16.82 1za2 n ALA 152 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59