#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2i96 s ALA 22 N 0.00 -1.34 0.00 -5.12 0.00 -1.26 -5.13 121.76 108.91 2i96 s ALA 22 Ca 0.00 1.16 0.00 0.00 0.00 0.00 0.00 51.96 53.12 2i96 s ALA 22 Cb 0.00 -1.74 0.00 0.00 0.00 0.00 0.00 23.12 21.38 2i96 s ALA 22 CO 0.00 -1.23 0.31 0.39 0.00 0.00 0.00 175.76 175.23 2i96 n GLU 23 N 5.38 0.00 0.00 0.00 -0.58 -1.26 -5.03 120.64 119.15 2i96 n GLU 23 Ca -0.04 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.70 2i96 n GLU 23 Cb 0.50 -0.81 0.00 0.00 -0.57 0.00 0.00 31.44 30.57 2i96 n GLU 23 CO 0.00 0.00 0.00 0.94 -0.48 0.00 0.00 177.13 177.59 2i96 n GLN 24 N -0.31 0.00 -0.03 3.49 7.27 -1.26 -5.01 117.38 121.52 2i96 n GLN 24 Ca 0.00 0.00 -0.10 0.00 0.07 0.00 0.00 57.00 56.97 2i96 n GLN 24 Cb 0.00 0.00 -0.14 0.00 2.41 0.00 0.00 30.24 32.51 2i96 n GLN 24 CO 0.00 0.00 0.00 0.45 0.07 0.00 0.00 177.06 177.58 2i96 n SER 25 N -0.01 0.83 -0.31 1.69 2.88 -1.26 -3.84 113.62 113.59 2i96 n SER 25 Ca 0.00 0.33 0.10 0.00 -1.33 0.00 0.00 58.87 57.97 2i96 n SER 25 Cb 0.00 0.05 0.27 0.00 -0.75 0.00 0.00 64.21 63.78 2i96 n SER 25 CO 0.00 0.00 0.00 -0.78 -1.23 0.00 0.00 175.04 173.03 2i96 h ASP 26 N 0.00 0.55 0.00 -3.46 1.82 -2.01 -3.25 116.42 110.07 2i96 h ASP 26 Ca -0.34 0.11 -0.41 0.00 -0.39 0.00 0.00 57.03 56.00 2i96 h ASP 26 Cb 2.05 0.02 -0.06 0.00 0.68 0.00 0.00 39.33 42.02 2i96 h ASP 26 CO 0.07 0.18 -2.37 -1.84 -1.61 0.00 0.00 179.24 173.67 2i96 n GLU 27 N -4.88 0.52 -3.36 0.28 0.28 -1.26 -5.02 120.64 107.20 2i96 n GLU 27 Ca 0.20 0.22 0.02 0.00 -0.16 0.00 0.00 57.16 57.44 2i96 n GLU 27 Cb 0.52 -1.38 -0.04 0.00 1.43 0.00 0.00 31.44 31.97 2i96 n GLU 27 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 2i96 s ALA 28 N -2.45 -2.88 -0.13 -1.84 0.00 -1.23 -5.12 121.76 108.11 2i96 s ALA 28 Ca -0.34 1.96 -0.29 0.00 0.00 0.00 0.00 51.96 53.29 2i96 s ALA 28 Cb 0.13 -2.11 -0.05 0.00 0.00 0.00 0.00 23.12 21.09 2i96 s ALA 28 CO 0.44 -0.87 1.87 0.08 0.00 0.00 0.00 175.76 177.28 2i96 s VAL 29 N 2.12 3.32 0.18 0.00 1.01 -1.25 -4.62 120.40 121.15 2i96 s VAL 29 Ca -0.02 0.36 -0.30 0.00 0.00 0.00 0.00 61.98 62.02 2i96 s VAL 29 Cb -0.04 -3.31 -0.08 0.00 0.00 0.00 0.00 36.38 32.95 2i96 s VAL 29 CO -0.16 -0.12 1.27 -0.54 0.00 0.00 0.00 175.10 175.55 2i96 s LYS 30 N 4.98 4.42 0.14 2.72 3.01 -1.26 -4.95 119.74 128.80 2i96 s LYS 30 Ca 0.84 1.98 0.10 0.00 -1.01 0.00 0.00 55.97 57.88 2i96 s LYS 30 Cb -0.33 -3.23 -0.04 0.00 -1.01 0.00 0.00 37.83 33.23 2i96 s LYS 30 CO 0.34 -0.22 -0.25 0.71 0.51 0.00 0.00 175.35 176.45 2i96 s TYR 31 N 0.22 2.17 0.00 3.18 2.02 -1.26 -0.66 117.35 123.02 2i96 s TYR 31 Ca 0.56 -0.39 0.00 0.00 -0.37 0.00 0.00 57.07 56.87 2i96 s TYR 31 Cb -0.35 -1.16 0.00 0.00 -0.40 0.00 0.00 41.96 40.06 2i96 s TYR 31 CO 0.36 0.34 0.00 0.66 -1.57 0.00 0.00 175.55 175.34 2i96 n TYR 32 N 0.82 0.00 -3.97 2.71 4.02 0.11 -4.85 117.16 115.99 2i96 n TYR 32 Ca -0.17 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.72 2i96 n TYR 32 Cb 0.54 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.86 2i96 n TYR 32 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 176.86 176.10 2i96 n THR 33 N 0.00 0.00 -0.08 -0.72 -2.24 -1.26 -0.13 114.28 109.85 2i96 n THR 33 Ca 0.00 0.00 -0.22 0.00 -2.27 0.00 0.00 64.05 61.56 2i96 n THR 33 Cb 0.00 0.00 -0.12 0.00 -2.10 0.00 0.00 70.33 68.11 2i96 n THR 33 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 2i96 n LEU 34 N 0.00 2.05 0.00 3.22 7.94 -1.26 -4.37 117.00 124.58 2i96 n LEU 34 Ca 0.00 0.36 0.08 0.00 -1.11 0.00 0.00 56.01 55.35 2i96 n LEU 34 Cb 0.00 -0.99 0.49 0.00 0.53 0.00 0.00 43.42 43.45 2i96 n LEU 34 CO 0.00 0.43 1.16 1.05 -1.11 0.00 0.00 177.39 178.92 2i96 h GLU 35 N -0.75 0.39 0.00 1.96 4.11 -1.97 -0.35 114.58 117.96 2i96 h GLU 35 Ca -0.39 -0.02 -0.07 0.00 0.07 0.00 0.00 59.36 58.94 2i96 h GLU 35 Cb 1.49 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 30.64 2i96 h GLU 35 CO -0.16 0.26 -0.64 1.05 0.07 0.00 0.00 179.01 179.59 2i96 h GLU 36 N 0.40 0.00 0.00 1.06 4.11 -1.97 -3.09 114.58 115.10 2i96 h GLU 36 Ca 0.19 0.00 -0.14 0.00 0.07 0.00 0.00 59.36 59.48 2i96 h GLU 36 Cb 0.24 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.47 2i96 h GLU 36 CO -0.04 0.25 -0.66 0.82 0.07 0.00 0.00 179.01 179.44 2i96 h ILE 37 N 0.00 1.45 0.00 -1.06 1.08 -1.27 -1.86 117.51 115.85 2i96 h ILE 37 Ca -0.03 -2.30 -0.02 0.00 -0.39 0.00 0.00 64.86 62.11 2i96 h ILE 37 Cb 1.26 2.25 -0.00 0.00 -3.07 0.00 0.00 36.82 37.26 2i96 h ILE 37 CO 0.03 0.65 -0.10 1.56 -0.69 0.00 0.00 178.15 179.60 2i96 h GLN 38 N 0.00 0.00 -0.02 2.37 1.08 -1.38 -2.09 115.11 115.08 2i96 h GLN 38 Ca -0.01 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.19 2i96 h GLN 38 Cb 1.20 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.63 2i96 h GLN 38 CO 0.09 0.10 -0.02 1.17 -0.95 0.00 0.00 178.83 179.22 2i96 n LYS 39 N -3.32 1.68 -2.13 1.46 4.81 -0.73 -3.94 118.16 115.98 2i96 n LYS 39 Ca -0.00 -1.05 -0.09 0.00 -0.87 0.00 0.00 58.31 56.29 2i96 n LYS 39 Cb 0.31 -1.48 0.05 0.00 0.02 0.00 0.00 35.03 33.93 2i96 n LYS 39 CO 0.00 0.00 0.00 0.72 1.17 0.00 0.00 177.40 179.29 2i96 n HIS 40 N 0.26 1.61 -0.79 5.64 8.25 -0.79 -4.78 115.22 124.63 2i96 n HIS 40 Ca 0.18 -1.94 0.08 0.00 -0.26 0.00 0.00 57.72 55.77 2i96 n HIS 40 Cb 0.39 -0.27 0.28 0.00 1.12 0.00 0.00 29.99 31.50 2i96 n HIS 40 CO 0.00 0.00 0.00 0.27 0.64 0.00 0.00 176.34 177.25 2i96 n ASN 41 N -0.59 4.12 -3.59 0.41 6.94 -1.19 -1.16 115.26 120.20 2i96 n ASN 41 Ca 0.23 -2.75 -0.23 0.00 -0.02 0.00 0.00 54.58 51.81 2i96 n ASN 41 Cb 0.89 -0.52 -0.07 0.00 -2.36 0.00 0.00 39.78 37.73 2i96 n ASN 41 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 2i96 n HIS 42 N 0.05 -0.02 -0.06 -2.53 1.44 -1.08 -4.77 115.22 108.26 2i96 n HIS 42 Ca 0.21 -2.46 -0.01 0.00 -2.01 0.00 0.00 57.72 53.45 2i96 n HIS 42 Cb 0.86 0.04 -0.01 0.00 0.12 0.00 0.00 29.99 31.00 2i96 n HIS 42 CO 0.00 0.00 0.00 0.45 -2.81 0.00 0.00 176.34 173.98 2i96 n SER 43 N -1.60 -0.14 0.34 4.39 2.88 -1.26 -1.44 113.62 116.79 2i96 n SER 43 Ca -0.03 0.84 0.22 0.00 -1.33 0.00 0.00 58.87 58.56 2i96 n SER 43 Cb 0.57 -0.33 1.16 0.00 -0.75 0.00 0.00 64.21 64.85 2i96 n SER 43 CO 0.00 0.00 0.00 0.50 -1.23 0.00 0.00 175.04 174.31 2i96 h LYS 44 N 0.00 0.00 -1.19 -1.46 3.64 -1.98 -3.37 116.57 112.22 2i96 h LYS 44 Ca 0.02 0.00 0.06 0.00 -1.27 0.00 0.00 60.65 59.46 2i96 h LYS 44 Cb 0.05 0.00 -0.22 0.00 -0.41 0.00 0.00 32.23 31.65 2i96 h LYS 44 CO -0.13 0.00 -0.29 -1.12 -2.27 0.00 0.00 179.45 175.65 2i96 s SER 45 N -5.02 -1.17 -0.52 4.20 0.01 -0.52 -5.04 113.70 105.64 2i96 s SER 45 Ca -0.05 0.85 -0.16 0.00 1.31 0.00 0.00 55.95 57.90 2i96 s SER 45 Cb 0.12 2.04 0.12 0.00 0.21 0.00 0.00 66.02 68.51 2i96 s SER 45 CO 0.39 -0.26 0.48 -0.89 0.41 0.00 0.00 173.24 173.36 2i96 s THR 46 N 2.82 5.21 0.43 1.44 2.01 -1.22 -2.63 115.64 123.70 2i96 s THR 46 Ca 0.18 -1.40 0.07 0.00 0.31 0.00 0.00 61.69 60.85 2i96 s THR 46 Cb -0.15 -4.29 -0.01 0.00 0.01 0.00 0.00 72.50 68.06 2i96 s THR 46 CO -0.20 -0.80 0.38 0.26 -0.69 0.00 0.00 174.62 173.56 2i96 s TRP 47 N 1.61 2.57 0.29 4.92 0.52 -0.31 -1.92 118.94 126.62 2i96 s TRP 47 Ca 0.03 -0.54 -0.20 0.00 0.02 0.00 0.00 56.10 55.42 2i96 s TRP 47 Cb -0.29 -2.14 0.04 0.00 -1.15 0.00 0.00 33.47 29.94 2i96 s TRP 47 CO 0.04 -0.16 0.80 -0.48 0.02 0.00 0.00 176.95 177.16 2i96 s LEU 48 N -4.14 -0.14 0.05 2.99 2.34 -0.83 -0.61 118.68 118.34 2i96 s LEU 48 Ca 0.47 -0.76 0.06 0.00 0.06 0.00 0.00 54.13 53.95 2i96 s LEU 48 Cb -0.03 2.64 -0.03 0.00 -0.56 0.00 0.00 46.19 48.22 2i96 s LEU 48 CO 0.27 -1.37 -0.16 -0.63 -1.06 0.00 0.00 176.35 173.39 2i96 s ILE 49 N -3.17 1.32 0.00 1.48 1.01 0.60 0.19 121.20 122.63 2i96 s ILE 49 Ca 0.13 -1.16 0.00 0.00 0.00 0.00 0.00 60.65 59.62 2i96 s ILE 49 Cb -0.05 -1.19 0.00 0.00 0.01 0.00 0.00 42.46 41.23 2i96 s ILE 49 CO 0.08 0.01 0.00 0.18 0.00 0.00 0.00 174.94 175.20 2i96 n LEU 50 N 1.69 0.00 -3.94 2.97 4.77 -0.14 0.67 117.00 123.02 2i96 n LEU 50 Ca -0.18 0.00 -0.42 0.00 -0.03 0.00 0.00 56.01 55.37 2i96 n LEU 50 Cb 0.54 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.64 2i96 n LEU 50 CO 0.23 0.00 1.13 1.41 -1.33 0.00 0.00 177.39 178.83 2i96 n HIS 51 N 0.00 2.32 -1.01 -1.77 8.25 -1.26 -4.20 115.22 117.55 2i96 n HIS 51 Ca 0.00 -2.61 -0.00 0.00 -0.26 0.00 0.00 57.72 54.84 2i96 n HIS 51 Cb 0.00 -1.22 -0.00 0.00 1.12 0.00 0.00 29.99 29.89 2i96 n HIS 51 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2i96 n HIS 52 N 1.14 0.00 -4.41 4.41 8.25 -1.26 -4.99 115.22 118.36 2i96 n HIS 52 Ca 0.28 0.00 -0.20 0.00 -0.26 0.00 0.00 57.72 57.55 2i96 n HIS 52 Cb 0.33 -0.73 -0.15 0.00 1.12 0.00 0.00 29.99 30.56 2i96 n HIS 52 CO 0.00 0.00 0.00 0.15 0.64 0.00 0.00 176.34 177.13 2i96 s LYS 53 N -0.80 0.86 0.18 -0.41 1.02 -1.26 -2.92 119.74 116.41 2i96 s LYS 53 Ca 0.00 -0.34 -0.14 0.00 0.02 0.00 0.00 55.97 55.51 2i96 s LYS 53 Cb 0.00 -0.82 -0.07 0.00 -0.52 0.00 0.00 37.83 36.42 2i96 s LYS 53 CO 0.00 0.18 0.59 0.54 -0.92 0.00 0.00 175.35 175.73 2i96 s VAL 54 N -0.08 4.81 0.19 3.17 0.11 0.17 -0.96 120.40 127.81 2i96 s VAL 54 Ca 0.01 0.85 0.09 0.00 -2.93 0.00 0.00 61.98 60.01 2i96 s VAL 54 Cb -0.05 -3.73 -0.04 0.00 -1.53 0.00 0.00 36.38 31.02 2i96 s VAL 54 CO -0.00 0.16 -0.19 -0.31 -3.33 0.00 0.00 175.10 171.43 2i96 s TYR 55 N -1.56 1.97 0.05 1.54 1.51 0.13 -1.10 117.35 119.89 2i96 s TYR 55 Ca 0.41 -0.44 0.09 0.00 -1.01 0.00 0.00 57.07 56.12 2i96 s TYR 55 Cb -0.14 -0.95 -0.03 0.00 -0.11 0.00 0.00 41.96 40.73 2i96 s TYR 55 CO 0.20 0.42 -0.26 0.34 -1.11 0.00 0.00 175.55 175.13 2i96 s ASP 56 N -2.87 3.19 -0.01 2.29 -1.08 -0.87 -1.96 116.67 115.35 2i96 s ASP 56 Ca 0.20 -0.61 0.01 0.00 -0.52 0.00 0.00 52.55 51.63 2i96 s ASP 56 Cb -0.05 -0.28 -0.01 0.00 -1.46 0.00 0.00 42.92 41.11 2i96 s ASP 56 CO 0.08 0.25 -0.00 0.18 0.52 0.00 0.00 175.17 176.20 2i96 n LEU 57 N 1.68 1.03 0.00 -1.34 4.77 -0.81 -4.86 117.00 117.47 2i96 n LEU 57 Ca -0.17 -0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.81 2i96 n LEU 57 Cb 0.52 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.61 2i96 n LEU 57 CO 0.23 0.20 0.02 0.41 -1.33 0.00 0.00 177.39 176.92 2i96 n THR 58 N -2.22 0.00 -0.05 -5.08 -1.04 -1.26 0.16 114.28 104.79 2i96 n THR 58 Ca -0.02 0.02 -0.05 0.00 -2.04 0.00 0.00 64.05 61.95 2i96 n THR 58 Cb 0.54 -0.28 -0.07 0.00 -1.82 0.00 0.00 70.33 68.69 2i96 n THR 58 CO 0.00 0.00 0.00 0.29 -0.64 0.00 0.00 175.07 174.72 2i96 n LYS 59 N -0.15 2.09 0.21 -2.82 5.02 -1.26 -4.73 118.16 116.52 2i96 n LYS 59 Ca 0.00 0.01 0.15 0.00 -2.02 0.00 0.00 58.31 56.45 2i96 n LYS 59 Cb 0.02 -1.24 0.69 0.00 -0.02 0.00 0.00 35.03 34.48 2i96 n LYS 59 CO 0.00 0.00 0.00 0.35 -0.52 0.00 0.00 177.40 177.23 2i96 h PHE 60 N 0.00 0.00 -0.69 2.13 3.57 0.11 -3.26 116.94 118.79 2i96 h PHE 60 Ca -0.25 0.00 0.20 0.00 3.53 0.00 0.00 57.97 61.45 2i96 h PHE 60 Cb 1.54 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 40.25 2i96 h PHE 60 CO 0.00 0.00 0.65 -0.07 -2.23 0.00 0.00 178.31 176.66 2i96 h LEU 61 N 0.00 0.00 0.00 0.59 3.38 -1.85 0.13 115.31 117.56 2i96 h LEU 61 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2i96 h LEU 61 Cb 0.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.99 2i96 h LEU 61 CO 0.00 0.00 -1.21 -0.62 0.09 0.00 0.00 178.44 176.70 2i96 n GLU 62 N -3.80 0.41 -0.02 1.13 1.02 -1.23 -3.12 120.64 115.02 2i96 n GLU 62 Ca 0.14 -0.02 0.05 0.00 -0.02 0.00 0.00 57.16 57.32 2i96 n GLU 62 Cb 0.90 -1.62 -0.14 0.00 -0.02 0.00 0.00 31.44 30.56 2i96 n GLU 62 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 2i96 n GLU 63 N -2.14 0.70 -2.52 3.49 1.02 0.40 -4.95 120.64 116.65 2i96 n GLU 63 Ca 0.00 -0.13 -0.41 0.00 -0.02 0.00 0.00 57.16 56.61 2i96 n GLU 63 Cb 0.48 -1.43 -0.04 0.00 -0.02 0.00 0.00 31.44 30.43 2i96 n GLU 63 CO 0.00 0.00 0.00 -1.58 1.18 0.00 0.00 177.13 176.73 2i96 s HIS 64 N -3.07 3.61 0.28 -0.32 2.46 -0.90 -4.94 115.29 112.42 2i96 s HIS 64 Ca -0.07 1.64 0.07 0.00 0.47 0.00 0.00 55.06 57.17 2i96 s HIS 64 Cb 0.10 -3.26 0.81 0.00 -0.13 0.00 0.00 32.58 30.10 2i96 s HIS 64 CO 0.73 -0.53 1.35 -2.30 -2.47 0.00 0.00 174.74 171.52 2i96 n PRO 65 N 2.07 -0.06 -3.33 2.88 -0.02 -1.26 -4.05 135.00 131.23 2i96 n PRO 65 Ca 0.02 1.25 -0.38 0.00 -2.02 0.00 0.00 63.50 62.37 2i96 n PRO 65 Cb 0.46 -2.07 -0.06 0.00 -0.02 0.00 0.00 33.50 31.81 2i96 n PRO 65 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 2i96 s GLY 66 N -4.27 2.38 0.87 -1.23 0.00 -1.26 -5.06 107.32 98.75 2i96 s GLY 66 Ca -0.10 -0.21 -0.11 0.00 0.00 0.00 0.00 44.72 44.30 2i96 s GLY 66 CO 0.67 0.75 1.10 -0.32 0.00 0.00 0.00 173.10 175.29 2i96 s GLY 67 N 0.61 1.65 0.21 0.20 0.00 -1.26 -4.81 107.32 103.92 2i96 s GLY 67 Ca 0.25 0.17 -0.05 0.00 0.00 0.00 0.00 44.72 45.09 2i96 s GLY 67 CO 0.10 0.60 1.16 -1.84 0.00 0.00 0.00 173.10 173.12 2i96 n GLU 68 N -3.87 -0.07 -0.34 2.90 0.28 -1.18 -0.84 120.64 117.52 2i96 n GLU 68 Ca 0.08 1.15 0.10 0.00 -0.16 0.00 0.00 57.16 58.34 2i96 n GLU 68 Cb 0.54 -1.74 0.30 0.00 1.43 0.00 0.00 31.44 31.96 2i96 n GLU 68 CO 0.00 0.00 0.00 0.93 -0.16 0.00 0.00 177.13 177.90 2i96 h GLU 69 N 0.00 0.83 -0.15 3.44 5.08 -1.92 -2.23 114.58 119.62 2i96 h GLU 69 Ca 0.37 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.68 2i96 h GLU 69 Cb 0.61 -0.19 0.00 0.00 0.50 0.00 0.00 28.75 29.67 2i96 h GLU 69 CO -0.76 0.55 0.00 1.33 -1.00 0.00 0.00 179.01 179.13 2i96 n VAL 70 N -4.65 0.18 0.13 3.13 0.24 -0.02 -3.05 118.33 114.29 2i96 n VAL 70 Ca 0.20 -0.48 -0.22 0.00 -2.04 0.00 0.00 64.34 61.80 2i96 n VAL 70 Cb 0.45 0.90 -0.15 0.00 -1.47 0.00 0.00 33.84 33.57 2i96 n VAL 70 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 2i96 h LEU 71 N 3.59 0.70 -2.07 1.34 -0.00 -1.42 -3.38 115.31 114.07 2i96 h LEU 71 Ca 0.00 -0.78 0.10 0.00 -0.00 0.00 0.00 57.88 57.20 2i96 h LEU 71 Cb 0.78 -0.23 -0.01 0.00 -0.00 0.00 0.00 40.66 41.19 2i96 h LEU 71 CO 0.00 1.62 0.33 0.03 -0.00 0.00 0.00 178.44 180.41 2i96 h ARG 72 N 0.12 0.00 0.00 1.13 3.08 -1.51 -1.10 114.38 116.10 2i96 h ARG 72 Ca -0.23 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 59.80 2i96 h ARG 72 Cb 2.11 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 32.16 2i96 h ARG 72 CO 0.24 0.00 -0.08 0.93 -1.07 0.00 0.00 179.97 180.00 2i96 h GLU 73 N 0.00 0.00 0.00 0.04 4.39 -1.74 -2.67 114.58 114.60 2i96 h GLU 73 Ca 0.17 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.87 2i96 h GLU 73 Cb 0.82 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.47 2i96 h GLU 73 CO -0.00 0.08 0.00 1.04 -1.16 0.00 0.00 179.01 178.97 2i96 n GLN 74 N -4.10 1.47 -2.74 2.33 1.13 -0.64 -5.07 117.38 109.76 2i96 n GLN 74 Ca -0.03 -0.21 -0.37 0.00 -1.94 0.00 0.00 57.00 54.46 2i96 n GLN 74 Cb 0.16 -0.65 -0.06 0.00 0.11 0.00 0.00 30.24 29.80 2i96 n GLN 74 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2i96 s ALA 75 N -0.27 3.19 0.00 -1.58 0.00 -0.51 -3.51 121.76 119.07 2i96 s ALA 75 Ca 0.00 0.55 0.00 0.00 0.00 0.00 0.00 51.96 52.51 2i96 s ALA 75 Cb 0.00 -3.20 0.00 0.00 0.00 0.00 0.00 23.12 19.92 2i96 s ALA 75 CO 0.00 0.11 0.00 0.41 0.00 0.00 0.00 175.76 176.28 2i96 n GLY 76 N 0.47 0.43 0.00 0.00 0.00 0.22 -4.79 105.19 101.52 2i96 n GLY 76 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 2i96 n GLY 76 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2i96 n GLY 77 N -2.00 4.74 3.76 -0.02 0.00 -1.23 -3.09 105.19 107.36 2i96 n GLY 77 Ca 0.00 -1.28 -0.39 0.00 0.00 0.00 0.00 46.02 44.34 2i96 n GLY 77 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2i96 s ASP 78 N 1.20 7.19 0.00 1.61 -1.08 -1.26 -0.29 116.67 124.04 2i96 s ASP 78 Ca 0.00 2.15 0.00 0.00 -0.52 0.00 0.00 52.55 54.18 2i96 s ASP 78 Cb 0.00 -2.61 0.00 0.00 -1.46 0.00 0.00 42.92 38.85 2i96 s ASP 78 CO 0.00 -0.19 0.56 0.00 0.52 0.00 0.00 175.17 176.06 2i96 n ALA 79 N 0.88 1.72 0.06 3.66 0.00 0.21 -4.84 120.51 122.20 2i96 n ALA 79 Ca 0.00 -0.56 0.21 0.00 0.00 0.00 0.00 53.44 53.09 2i96 n ALA 79 Cb 0.46 0.00 0.68 0.00 0.00 0.00 0.00 19.45 20.59 2i96 n ALA 79 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2i96 h THR 80 N 0.57 0.25 -0.97 0.00 1.03 -1.73 -2.53 112.91 109.53 2i96 h THR 80 Ca 0.00 0.00 0.16 0.00 -0.01 0.00 0.00 66.41 66.56 2i96 h THR 80 Cb 0.37 0.51 -0.10 0.00 -1.07 0.00 0.00 68.15 67.86 2i96 h THR 80 CO 0.00 0.00 0.58 -0.33 -0.01 0.00 0.00 175.52 175.76 2i96 h GLU 81 N 0.00 0.79 0.00 0.00 5.08 -1.92 0.26 114.58 118.78 2i96 h GLU 81 Ca 0.23 -0.05 -0.08 0.00 -1.00 0.00 0.00 59.36 58.46 2i96 h GLU 81 Cb 1.42 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 30.48 2i96 h GLU 81 CO -0.00 0.52 -0.40 -2.95 -1.00 0.00 0.00 179.01 175.18 2i96 h ASN 82 N 0.81 0.00 0.35 1.42 7.08 -1.87 -2.80 115.58 120.58 2i96 h ASN 82 Ca 0.53 0.00 0.00 0.00 -3.08 0.00 0.00 56.30 53.75 2i96 h ASN 82 Cb 0.71 0.00 0.00 0.00 -2.08 0.00 0.00 38.32 36.95 2i96 h ASN 82 CO -0.34 0.40 -0.31 0.33 -2.08 0.00 0.00 177.43 175.43 2i96 n PHE 83 N -4.06 0.00 -0.88 4.14 7.35 0.83 -0.42 117.46 124.41 2i96 n PHE 83 Ca -0.02 0.00 0.08 0.00 -0.76 0.00 0.00 57.45 56.75 2i96 n PHE 83 Cb 0.43 -0.18 0.13 0.00 0.35 0.00 0.00 39.48 40.21 2i96 n PHE 83 CO 0.00 0.00 0.00 -0.85 -0.76 0.00 0.00 176.76 175.15 2i96 n GLU 84 N -0.97 1.70 0.00 -4.13 0.28 -0.77 -4.78 120.64 111.97 2i96 n GLU 84 Ca 0.10 -2.42 0.00 0.00 -0.16 0.00 0.00 57.16 54.68 2i96 n GLU 84 Cb 0.34 -1.44 0.00 0.00 1.43 0.00 0.00 31.44 31.76 2i96 n GLU 84 CO 0.00 0.00 0.00 -3.47 -0.16 0.00 0.00 177.13 173.50 2i96 n ASP 85 N -1.19 0.00 -0.72 -1.84 2.03 -1.08 -5.02 116.55 108.72 2i96 n ASP 85 Ca 0.14 0.00 -0.00 0.00 0.52 0.00 0.00 54.79 55.45 2i96 n ASP 85 Cb 0.60 0.00 -0.00 0.00 -0.72 0.00 0.00 41.12 40.99 2i96 n ASP 85 CO 0.00 0.00 0.00 1.33 -1.92 0.00 0.00 177.20 176.61 2i96 n VAL 86 N -0.40 0.00 -3.34 5.18 0.24 -1.20 -5.11 118.33 113.71 2i96 n VAL 86 Ca 0.00 -0.17 -0.38 0.00 -2.04 0.00 0.00 64.34 61.75 2i96 n VAL 86 Cb 0.00 0.46 -0.06 0.00 -1.47 0.00 0.00 33.84 32.77 2i96 n VAL 86 CO 0.00 0.00 0.00 -0.83 -2.14 0.00 0.00 176.83 173.86 2i96 s GLY 87 N -0.91 2.43 0.15 7.63 0.00 0.44 -4.93 107.32 112.13 2i96 s GLY 87 Ca 0.06 -0.17 0.00 0.00 0.00 0.00 0.00 44.72 44.61 2i96 s GLY 87 CO -0.03 0.65 0.00 1.42 0.00 0.00 0.00 173.10 175.14 2i96 n HIS 88 N 3.22 -1.20 -3.34 1.90 8.25 -1.26 -4.61 115.22 118.18 2i96 n HIS 88 Ca -0.08 0.64 -0.15 0.00 -0.26 0.00 0.00 57.72 57.86 2i96 n HIS 88 Cb 0.52 -1.60 0.03 0.00 1.12 0.00 0.00 29.99 30.06 2i96 n HIS 88 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 2i96 n SER 89 N -1.19 1.78 -0.31 0.41 3.41 -1.26 -5.00 113.62 111.46 2i96 n SER 89 Ca 0.00 -2.16 0.19 0.00 -0.26 0.00 0.00 58.87 56.63 2i96 n SER 89 Cb 0.03 -0.18 0.45 0.00 -0.26 0.00 0.00 64.21 64.26 2i96 n SER 89 CO 0.00 0.00 0.00 0.74 -0.16 0.00 0.00 175.04 175.62 2i96 h THR 90 N 0.30 0.62 -0.41 6.66 2.02 -2.02 -2.56 112.91 117.52 2i96 h THR 90 Ca -0.21 -0.17 0.09 0.00 0.77 0.00 0.00 66.41 66.88 2i96 h THR 90 Cb 0.87 0.07 -0.09 0.00 -1.74 0.00 0.00 68.15 67.26 2i96 h THR 90 CO 0.31 0.09 -0.18 0.44 0.37 0.00 0.00 175.52 176.55 2i96 h ASP 91 N 0.51 -0.63 0.21 4.18 5.19 -2.02 -1.22 116.42 122.64 2i96 h ASP 91 Ca 0.56 0.15 0.00 0.00 -0.62 0.00 0.00 57.03 57.12 2i96 h ASP 91 Cb 1.24 0.35 0.00 0.00 0.18 0.00 0.00 39.33 41.10 2i96 h ASP 91 CO -0.29 -0.22 0.00 0.00 -3.12 0.00 0.00 179.24 175.61 2i96 n ALA 92 N -2.86 2.17 0.81 3.45 0.00 -0.96 -1.95 120.51 121.17 2i96 n ALA 92 Ca 0.02 -0.11 0.12 0.00 0.00 0.00 0.00 53.44 53.47 2i96 n ALA 92 Cb 0.28 -1.34 0.25 0.00 0.00 0.00 0.00 19.45 18.64 2i96 n ALA 92 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 2i96 n ARG 93 N -1.16 0.13 -0.02 0.00 1.74 -0.46 -3.02 116.66 113.87 2i96 n ARG 93 Ca 0.12 0.04 0.02 0.00 -0.77 0.00 0.00 57.85 57.27 2i96 n ARG 93 Cb 0.12 -1.58 -0.10 0.00 -1.02 0.00 0.00 32.46 29.88 2i96 n ARG 93 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 2i96 n GLU 94 N -1.78 0.95 0.05 5.56 -0.58 -0.82 -4.34 120.64 119.68 2i96 n GLU 94 Ca 0.05 -0.08 -0.13 0.00 -0.42 0.00 0.00 57.16 56.57 2i96 n GLU 94 Cb 0.38 -1.30 -0.14 0.00 -0.57 0.00 0.00 31.44 29.81 2i96 n GLU 94 CO 0.00 0.00 0.00 1.98 -0.48 0.00 0.00 177.13 178.63 2i96 h MET 95 N 0.00 0.16 0.00 3.49 4.05 -1.65 -3.38 114.93 117.59 2i96 h MET 95 Ca -0.11 -0.27 -0.02 0.00 -0.28 0.00 0.00 59.70 59.02 2i96 h MET 95 Cb 0.96 0.10 -0.00 0.00 -0.80 0.00 0.00 31.60 31.86 2i96 h MET 95 CO 0.01 1.01 -0.56 0.66 0.23 0.00 0.00 176.91 178.25 2i96 h SER 96 N 0.04 0.00 0.12 1.39 4.64 -1.75 -3.37 113.55 114.63 2i96 h SER 96 Ca -0.19 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.12 2i96 h SER 96 Cb 1.96 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 64.05 2i96 h SER 96 CO 0.15 0.08 -0.03 0.07 -0.87 0.00 0.00 176.83 176.22 2i96 h LYS 97 N 0.00 0.00 -0.13 4.77 2.10 -1.76 0.15 116.57 121.70 2i96 h LYS 97 Ca -0.01 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.64 2i96 h LYS 97 Cb 1.07 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.40 2i96 h LYS 97 CO 0.01 0.03 0.00 0.25 -2.00 0.00 0.00 179.45 177.74 2i96 n THR 98 N -3.68 0.15 1.03 0.07 -2.24 -1.26 -3.46 114.28 104.90 2i96 n THR 98 Ca -0.03 -0.48 0.11 0.00 -2.27 0.00 0.00 64.05 61.39 2i96 n THR 98 Cb 0.13 0.96 0.09 0.00 -2.10 0.00 0.00 70.33 69.41 2i96 n THR 98 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 2i96 n PHE 99 N 0.95 0.00 -2.24 4.78 3.72 0.50 -4.82 117.46 120.35 2i96 n PHE 99 Ca 0.17 0.00 -0.40 0.00 -0.05 0.00 0.00 57.45 57.17 2i96 n PHE 99 Cb 0.50 -0.10 -0.03 0.00 -0.94 0.00 0.00 39.48 38.91 2i96 n PHE 99 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 2i96 s ILE 100 N -2.86 3.52 -0.97 4.37 1.01 -1.18 -2.06 121.20 123.04 2i96 s ILE 100 Ca 0.13 0.34 0.25 0.00 0.00 0.00 0.00 60.65 61.36 2i96 s ILE 100 Cb 0.17 -4.29 -0.01 0.00 0.01 0.00 0.00 42.46 38.34 2i96 s ILE 100 CO 0.72 -1.21 1.36 2.30 0.00 0.00 0.00 174.94 178.11 2i96 n ILE 101 N 6.92 0.03 -1.00 2.92 -5.35 -0.25 -4.99 119.36 117.63 2i96 n ILE 101 Ca 0.14 -0.02 0.00 0.00 -0.27 0.00 0.00 62.75 62.60 2i96 n ILE 101 Cb 0.51 0.28 0.00 0.00 -1.74 0.00 0.00 39.64 38.68 2i96 n ILE 101 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2i96 n GLY 102 N 1.49 -2.17 0.55 3.28 0.00 -1.20 -4.99 105.19 102.14 2i96 n GLY 102 Ca 0.05 -1.21 -0.03 0.00 0.00 0.00 0.00 46.02 44.83 2i96 n GLY 102 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2i96 n GLU 103 N -0.54 1.23 -3.96 1.61 4.71 0.17 0.44 120.64 124.30 2i96 n GLU 103 Ca 0.00 -0.47 -0.21 0.00 -0.01 0.00 0.00 57.16 56.47 2i96 n GLU 103 Cb 0.00 0.02 -0.02 0.00 -1.01 0.00 0.00 31.44 30.43 2i96 n GLU 103 CO 0.00 0.00 0.00 -0.51 0.09 0.00 0.00 177.13 176.71 2i96 s LEU 104 N 0.00 4.21 0.73 -4.62 1.43 -1.15 0.05 118.68 119.33 2i96 s LEU 104 Ca 0.06 -0.01 -0.15 0.00 -1.03 0.00 0.00 54.13 53.00 2i96 s LEU 104 Cb -0.00 -2.76 0.04 0.00 0.03 0.00 0.00 46.19 43.49 2i96 s LEU 104 CO 0.04 -0.09 1.19 -2.28 0.23 0.00 0.00 176.35 175.44 2i96 s HIS 105 N -2.02 2.10 0.04 0.29 2.46 0.82 -4.25 115.29 114.73 2i96 s HIS 105 Ca 0.35 1.60 0.01 0.00 0.47 0.00 0.00 55.06 57.49 2i96 s HIS 105 Cb -0.09 -3.43 0.13 0.00 -0.13 0.00 0.00 32.58 29.06 2i96 s HIS 105 CO 0.28 -2.51 0.21 -2.30 -2.47 0.00 0.00 174.74 167.96 2i96 n PRO 106 N -2.75 -0.01 0.01 2.88 -0.02 -1.26 0.66 135.00 134.51 2i96 n PRO 106 Ca 0.13 0.20 -0.17 0.00 -2.02 0.00 0.00 63.50 61.64 2i96 n PRO 106 Cb 0.50 -0.33 -0.14 0.00 -0.02 0.00 0.00 33.50 33.52 2i96 n PRO 106 CO 0.00 0.00 0.00 0.22 1.98 0.00 0.00 175.50 177.70 2i96 h ASP 107 N 0.00 0.30 1.49 2.55 1.82 -1.98 -3.29 116.42 117.31 2i96 h ASP 107 Ca 0.09 -0.60 -0.08 0.00 -0.39 0.00 0.00 57.03 56.06 2i96 h ASP 107 Cb 0.22 -0.10 -0.01 0.00 0.68 0.00 0.00 39.33 40.12 2i96 h ASP 107 CO -0.12 1.53 -0.36 0.44 -1.61 0.00 0.00 179.24 179.12 2i96 h ASP 108 N 0.05 0.00 -0.24 2.28 5.19 -0.90 -3.28 116.42 119.53 2i96 h ASP 108 Ca -0.35 0.00 -0.02 0.00 -0.62 0.00 0.00 57.03 56.05 2i96 h ASP 108 Cb 2.03 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 41.53 2i96 h ASP 108 CO 0.10 0.36 0.09 -0.09 -3.12 0.00 0.00 179.24 176.58 2i96 h ARG 109 N 0.00 0.36 0.00 3.56 2.43 0.16 -2.20 114.38 118.69 2i96 h ARG 109 Ca -0.00 -0.07 0.00 0.00 -0.81 0.00 0.00 59.98 59.10 2i96 h ARG 109 Cb 1.20 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.69 2i96 h ARG 109 CO 0.05 0.42 -0.53 -1.00 -1.51 0.00 0.00 179.97 177.39 2i96 h PRO 110 N 0.23 0.00 0.00 0.20 0.14 -1.74 -3.47 132.00 127.36 2i96 h PRO 110 Ca 0.08 0.00 0.00 0.00 0.14 0.00 0.00 66.00 66.22 2i96 h PRO 110 Cb 0.20 0.00 0.00 0.00 0.14 0.00 0.00 31.00 31.34 2i96 h PRO 110 CO -0.01 0.00 0.00 1.63 0.14 0.00 0.00 178.00 179.76 2i96 n LYS 111 N -2.85 0.00 -0.37 0.86 5.02 -0.83 -4.74 118.16 115.25 2i96 n LYS 111 Ca 0.02 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.31 2i96 n LYS 111 Cb 0.54 -0.28 0.00 0.00 -0.02 0.00 0.00 35.03 35.27 2i96 n LYS 111 CO 0.00 0.00 0.00 -0.11 -0.52 0.00 0.00 177.40 176.77 2i96 n LEU 112 N 0.00 4.18 0.00 -0.35 7.94 -1.26 -4.64 117.00 122.87 2i96 n LEU 112 Ca 0.00 -1.89 0.00 0.00 -1.11 0.00 0.00 56.01 53.01 2i96 n LEU 112 Cb 0.00 -0.87 0.00 0.00 0.53 0.00 0.00 43.42 43.08 2i96 n LEU 112 CO 0.00 0.78 0.00 -3.20 -1.11 0.00 0.00 177.39 173.86 2i96 n ASN 113 N 1.50 0.00 -1.53 1.96 4.05 -1.26 -4.20 115.26 115.79 2i96 n ASN 113 Ca 0.00 0.00 0.00 0.00 0.45 0.00 0.00 54.58 55.03 2i96 n ASN 113 Cb 0.41 -0.58 0.00 0.00 1.23 0.00 0.00 39.78 40.84 2i96 n ASN 113 CO 0.00 0.00 0.00 2.29 -3.05 0.00 0.00 177.26 176.50 2i96 n LYS 114 N -1.84 -2.75 -1.53 1.20 2.85 -1.26 -4.85 118.16 109.99 2i96 n LYS 114 Ca 0.00 2.22 -0.48 0.00 -1.05 0.00 0.00 58.31 58.99 2i96 n LYS 114 Cb 0.00 -2.46 -0.06 0.00 -0.65 0.00 0.00 35.03 31.86 2i96 n LYS 114 CO 0.00 0.00 0.00 -2.30 -0.05 0.00 0.00 177.40 175.05 2i96 n PRO 115 N 0.95 1.48 0.00 -1.58 -0.02 -1.26 -4.95 135.00 129.62 2i96 n PRO 115 Ca 0.00 0.43 0.00 0.00 -2.02 0.00 0.00 63.50 61.91 2i96 n PRO 115 Cb 0.00 -2.70 0.00 0.00 -0.02 0.00 0.00 33.50 30.78 2i96 n PRO 115 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 2i96 n PRO 116 N 8.08 2.55 -2.94 0.52 -0.02 -1.26 -5.09 135.00 136.84 2i96 n PRO 116 Ca 0.35 0.00 -0.20 0.00 -2.02 0.00 0.00 63.50 61.63 2i96 n PRO 116 Cb 0.30 0.00 0.06 0.00 -0.02 0.00 0.00 33.50 33.84 2i96 n PRO 116 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 2i96 s GLU 117 N 0.00 2.29 0.01 -0.52 2.12 -1.26 -5.12 118.70 116.23 2i96 s GLU 117 Ca 0.00 -1.46 0.08 0.00 0.36 0.00 0.00 54.97 53.95 2i96 s GLU 117 Cb 0.00 -2.61 -0.02 0.00 0.26 0.00 0.00 34.13 31.76 2i96 s GLU 117 CO 0.00 -0.86 -0.25 0.99 -0.54 0.00 0.00 175.26 174.60 2i96 s THR 118 N -2.70 2.01 0.46 -1.70 2.01 -1.26 -5.15 115.64 109.31 2i96 s THR 118 Ca 0.61 -1.21 0.05 0.00 0.31 0.00 0.00 61.69 61.45 2i96 s THR 118 Cb -0.06 -1.70 -0.04 0.00 0.01 0.00 0.00 72.50 70.70 2i96 s THR 118 CO 0.39 0.45 0.05 -0.76 -0.69 0.00 0.00 174.62 174.06 2i96 s LEU 119 N -0.91 2.69 -0.08 4.42 1.43 -1.26 -5.12 118.68 119.84 2i96 s LEU 119 Ca 0.10 -1.43 -0.17 0.00 -1.03 0.00 0.00 54.13 51.60 2i96 s LEU 119 Cb -0.10 -0.93 -0.05 0.00 0.03 0.00 0.00 46.19 45.15 2i96 s LEU 119 CO 0.01 -0.65 0.46 -0.63 0.23 0.00 0.00 176.35 175.77 2i96 s ILE 120 N -2.76 5.13 -1.14 -0.59 1.01 -1.26 -5.00 121.20 116.59 2i96 s ILE 120 Ca 0.25 0.93 -0.05 0.00 0.00 0.00 0.00 60.65 61.78 2i96 s ILE 120 Cb 0.05 -3.79 0.26 0.00 0.01 0.00 0.00 42.46 38.99 2i96 s ILE 120 CO 0.13 0.39 1.68 1.07 0.00 0.00 0.00 174.94 178.21 2i96 n THR 121 N 3.18 5.19 0.00 2.92 5.66 -1.26 -4.91 114.28 125.05 2i96 n THR 121 Ca -0.09 -5.47 0.00 0.00 -3.05 0.00 0.00 64.05 55.44 2i96 n THR 121 Cb 0.52 -2.08 0.00 0.00 -1.55 0.00 0.00 70.33 67.21 2i96 n THR 121 CO 0.00 0.00 0.00 0.41 -3.05 0.00 0.00 175.07 172.43 2i96 n THR 122 N 1.68 0.00 0.00 1.09 -1.04 -1.26 -4.06 114.28 110.69 2i96 n THR 122 Ca 0.34 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.35 2i96 n THR 122 Cb 0.33 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.84 2i96 n THR 122 CO 0.00 0.00 0.00 -0.38 -0.64 0.00 0.00 175.07 174.05 2i96 n ILE 123 N 0.00 0.00 -2.00 12.58 5.41 -1.26 -5.14 119.36 128.95 2i96 n ILE 123 Ca 0.00 0.00 0.00 0.00 1.00 0.00 0.00 62.75 63.75 2i96 n ILE 123 Cb 0.00 -0.23 0.00 0.00 -0.71 0.00 0.00 39.64 38.70 2i96 n ILE 123 CO 0.00 0.00 0.00 0.47 0.00 0.00 0.00 176.55 177.02 2i96 n ASP 124 N -1.38 0.28 -2.05 4.38 8.00 -1.26 -5.11 116.55 119.42 2i96 n ASP 124 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 2i96 n ASP 124 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 2i96 n ASP 124 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 2i96 n SER 125 N 0.00 0.00 0.00 -2.24 3.41 -1.26 -4.68 113.62 108.85 2i96 n SER 125 Ca 0.00 -0.78 0.00 0.00 -0.26 0.00 0.00 58.87 57.83 2i96 n SER 125 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 2i96 n SER 125 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2i96 n SER 126 N -2.35 0.00 0.26 4.04 7.64 -1.26 -4.92 113.62 117.03 2i96 n SER 126 Ca 0.00 0.00 0.12 0.00 1.01 0.00 0.00 58.87 60.00 2i96 n SER 126 Cb 0.00 0.00 0.74 0.00 -1.01 0.00 0.00 64.21 63.94 2i96 n SER 126 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 2i96 h SER 127 N 0.00 0.00 -0.01 6.43 0.02 -2.06 -3.56 113.55 114.38 2i96 h SER 127 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 2i96 h SER 127 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 2i96 h SER 127 CO 0.00 0.10 0.00 -0.24 -1.14 0.00 0.00 176.83 175.55