#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2j57 s ASP 8 N 0.00 5.92 0.37 3.42 -1.08 -1.26 -4.88 116.67 119.15 2j57 s ASP 8 Ca 0.00 0.95 0.15 0.00 -0.52 0.00 0.00 52.55 53.12 2j57 s ASP 8 Cb 0.00 -2.53 0.73 0.00 -1.46 0.00 0.00 42.92 39.66 2j57 s ASP 8 CO 0.00 -1.75 1.80 1.55 0.52 0.00 0.00 175.17 177.29 2j57 h PRO 9 N 12.55 0.00 0.00 4.34 0.13 -2.05 -3.10 132.00 143.86 2j57 h PRO 9 Ca -0.30 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.83 2j57 h PRO 9 Cb 1.15 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.28 2j57 h PRO 9 CO 1.09 0.38 -0.76 0.00 -0.23 0.00 0.00 178.00 178.48 2j57 h ARG 10 N 0.00 0.00 -7.09 0.86 3.08 -2.06 -3.47 114.38 105.71 2j57 h ARG 10 Ca -0.00 0.00 -0.53 0.00 0.07 0.00 0.00 59.98 59.51 2j57 h ARG 10 Cb 0.73 0.00 0.12 0.00 0.08 0.00 0.00 29.97 30.90 2j57 h ARG 10 CO 0.05 0.00 0.49 0.00 -1.07 0.00 0.00 179.97 179.44 2j57 s ALA 11 N -3.29 2.59 0.21 0.04 0.00 -1.18 -4.94 121.76 115.20 2j57 s ALA 11 Ca 0.02 1.06 -0.31 0.00 0.00 0.00 0.00 51.96 52.73 2j57 s ALA 11 Cb 0.10 -3.47 -0.15 0.00 0.00 0.00 0.00 23.12 19.60 2j57 s ALA 11 CO 0.75 -1.18 1.05 1.17 0.00 0.00 0.00 175.76 177.56 2j57 n LYS 12 N -1.47 1.12 -2.24 0.00 4.81 -1.26 -4.93 118.16 114.19 2j57 n LYS 12 Ca 0.13 0.40 -0.42 0.00 -0.87 0.00 0.00 58.31 57.55 2j57 n LYS 12 Cb 0.49 -1.80 -0.03 0.00 0.02 0.00 0.00 35.03 33.70 2j57 n LYS 12 CO 0.00 0.00 0.00 -0.46 1.17 0.00 0.00 177.40 178.11 2j57 s TRP 13 N -0.57 3.30 -0.27 5.64 -0.00 -1.26 -5.02 118.94 120.76 2j57 s TRP 13 Ca 0.67 1.08 0.01 0.00 -0.00 0.00 0.00 56.10 57.86 2j57 s TRP 13 Cb -0.81 -3.61 0.05 0.00 -0.00 0.00 0.00 33.47 29.10 2j57 s TRP 13 CO 0.55 -2.04 -0.08 0.08 -0.00 0.00 0.00 176.95 175.46 2j57 s VAL 14 N 0.95 2.49 0.59 5.86 1.01 -1.26 -5.12 120.40 124.91 2j57 s VAL 14 Ca 0.62 -1.44 -0.15 0.00 0.00 0.00 0.00 61.98 61.01 2j57 s VAL 14 Cb -0.35 -2.41 -0.04 0.00 0.00 0.00 0.00 36.38 33.58 2j57 s VAL 14 CO 0.31 0.01 1.03 -2.16 0.00 0.00 0.00 175.10 174.30 2j57 s PRO 15 N 1.19 3.47 0.17 2.72 0.05 -1.26 -4.83 135.00 136.50 2j57 s PRO 15 Ca -0.06 1.06 0.01 0.00 0.05 0.00 0.00 61.00 62.06 2j57 s PRO 15 Cb -0.19 -2.06 -0.04 0.00 0.05 0.00 0.00 34.50 32.26 2j57 s PRO 15 CO -0.04 -0.68 0.03 1.14 0.05 0.00 0.00 177.00 177.50 2j57 s GLN 16 N -4.29 1.07 -0.19 4.56 1.03 -0.46 -4.88 119.66 116.49 2j57 s GLN 16 Ca 0.61 -1.52 0.16 0.00 0.04 0.00 0.00 55.36 54.65 2j57 s GLN 16 Cb -0.14 -0.08 0.45 0.00 0.03 0.00 0.00 33.01 33.27 2j57 s GLN 16 CO 0.39 -0.19 1.18 -3.47 -2.54 0.00 0.00 175.29 170.66 2j57 n ASP 17 N -0.21 2.39 -0.00 12.60 2.03 -1.26 -0.61 116.55 131.49 2j57 n ASP 17 Ca -0.06 -3.04 0.00 0.00 0.52 0.00 0.00 54.79 52.22 2j57 n ASP 17 Cb 0.64 -0.42 -0.00 0.00 -0.72 0.00 0.00 41.12 40.62 2j57 n ASP 17 CO 0.00 0.00 0.00 -0.46 -1.92 0.00 0.00 177.20 174.82 2j57 n ASN 18 N -0.53 1.45 -3.34 1.67 6.94 -1.26 -5.03 115.26 115.16 2j57 n ASN 18 Ca 0.20 -0.36 -0.09 0.00 -0.02 0.00 0.00 54.58 54.31 2j57 n ASN 18 Cb 0.89 1.01 -0.07 0.00 -2.36 0.00 0.00 39.78 39.25 2j57 n ASN 18 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 2j57 s ASP 19 N -1.35 0.32 0.17 0.53 -1.08 -1.26 -5.02 116.67 108.99 2j57 s ASP 19 Ca 0.00 0.03 0.24 0.00 -0.52 0.00 0.00 52.55 52.30 2j57 s ASP 19 Cb 0.00 1.10 0.91 0.00 -1.46 0.00 0.00 42.92 43.47 2j57 s ASP 19 CO 0.02 -0.32 1.73 2.30 0.52 0.00 0.00 175.17 179.43 2j57 n ILE 20 N 5.36 0.66 1.39 4.11 -5.35 -1.26 -2.94 119.36 121.33 2j57 n ILE 20 Ca -0.02 0.02 0.06 0.00 -0.27 0.00 0.00 62.75 62.54 2j57 n ILE 20 Cb 0.50 -0.85 0.24 0.00 -1.74 0.00 0.00 39.64 37.78 2j57 n ILE 20 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2j57 n GLN 21 N -2.05 1.49 -4.58 6.28 6.02 -1.26 -4.89 117.38 118.39 2j57 n GLN 21 Ca 0.04 -0.75 -0.31 0.00 -0.01 0.00 0.00 57.00 55.97 2j57 n GLN 21 Cb 0.31 -1.25 -0.12 0.00 1.02 0.00 0.00 30.24 30.21 2j57 n GLN 21 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2j57 s ALA 22 N -1.77 2.79 0.47 -1.58 0.00 -1.15 -4.93 121.76 115.59 2j57 s ALA 22 Ca 0.21 -1.11 0.29 0.00 0.00 0.00 0.00 51.96 51.36 2j57 s ALA 22 Cb 0.11 -0.93 1.62 0.00 0.00 0.00 0.00 23.12 23.92 2j57 s ALA 22 CO 0.16 0.59 2.14 0.00 0.00 0.00 0.00 175.76 178.65 2j57 n ASP 24 N -3.65 1.50 -4.67 0.00 5.68 -1.26 -4.82 116.55 109.33 2j57 n ASP 24 Ca -0.02 -1.68 -0.42 0.00 -0.50 0.00 0.00 54.79 52.17 2j57 n ASP 24 Cb 0.18 -0.09 -0.00 0.00 -1.14 0.00 0.00 41.12 40.07 2j57 n ASP 24 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 2j57 n TYR 25 N 0.21 1.98 -0.24 2.11 9.36 -0.66 -1.36 117.16 128.57 2j57 n TYR 25 Ca 0.16 0.57 0.03 0.00 3.32 0.00 0.00 57.90 61.98 2j57 n TYR 25 Cb 0.30 -2.36 0.27 0.00 -0.63 0.00 0.00 39.34 36.92 2j57 n TYR 25 CO 0.00 0.00 0.00 0.11 0.22 0.00 0.00 176.86 177.19 2j57 h TRP 26 N 2.27 0.93 0.00 2.98 5.08 -1.19 -2.02 115.95 123.99 2j57 h TRP 26 Ca -0.45 0.02 0.00 0.00 1.08 0.00 0.00 58.89 59.54 2j57 h TRP 26 Cb 1.30 -0.31 0.00 0.00 -3.00 0.00 0.00 29.16 27.15 2j57 h TRP 26 CO 0.49 0.52 0.00 0.54 -1.28 0.00 0.00 178.44 178.71 2j57 n ARG 27 N -4.46 0.10 -0.60 0.12 1.74 -1.26 -3.37 116.66 108.93 2j57 n ARG 27 Ca 0.11 0.20 -0.05 0.00 -0.77 0.00 0.00 57.85 57.34 2j57 n ARG 27 Cb 0.15 -1.64 0.17 0.00 -1.02 0.00 0.00 32.46 30.12 2j57 n ARG 27 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 2j57 n HIS 28 N -1.81 1.45 0.37 -1.55 8.25 -0.76 -4.56 115.22 116.61 2j57 n HIS 28 Ca 0.05 -0.82 0.13 0.00 -0.26 0.00 0.00 57.72 56.81 2j57 n HIS 28 Cb 0.29 -0.49 0.53 0.00 1.12 0.00 0.00 29.99 31.44 2j57 n HIS 28 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2j57 n SER 30 N -2.35 0.84 -4.75 0.00 2.88 -1.26 -0.92 113.62 108.07 2j57 n SER 30 Ca 0.02 -2.01 -0.41 0.00 -1.33 0.00 0.00 58.87 55.14 2j57 n SER 30 Cb 0.22 -0.25 -0.04 0.00 -0.75 0.00 0.00 64.21 63.40 2j57 n SER 30 CO 0.00 0.00 0.00 -0.51 -1.23 0.00 0.00 175.04 173.30 2j57 s ILE 31 N -0.70 3.58 -0.14 2.46 2.07 -1.01 -4.82 121.20 122.63 2j57 s ILE 31 Ca 0.29 1.43 -0.00 0.00 -1.41 0.00 0.00 60.65 60.96 2j57 s ILE 31 Cb 0.34 -3.91 0.03 0.00 0.13 0.00 0.00 42.46 39.05 2j57 s ILE 31 CO -0.13 0.28 -0.08 -0.62 -1.91 0.00 0.00 174.94 172.49 2j57 s ASP 32 N -0.33 2.55 0.00 4.50 2.15 -1.26 -1.56 116.67 122.72 2j57 s ASP 32 Ca 0.49 -0.49 0.00 0.00 0.43 0.00 0.00 52.55 52.98 2j57 s ASP 32 Cb -0.32 -0.93 0.00 0.00 -0.30 0.00 0.00 42.92 41.38 2j57 s ASP 32 CO 0.38 -0.14 0.00 0.61 -0.17 0.00 0.00 175.17 175.86 2j57 n GLY 33 N 4.89 1.14 2.99 2.66 0.00 -0.48 -4.83 105.19 111.55 2j57 n GLY 33 Ca -0.13 -0.77 -0.13 0.00 0.00 0.00 0.00 46.02 45.00 2j57 n GLY 33 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2j57 s ASN 34 N -4.00 -0.14 -0.15 1.61 0.01 -1.26 -1.35 114.94 109.65 2j57 s ASN 34 Ca 0.00 0.30 -0.29 0.00 -0.71 0.00 0.00 52.86 52.16 2j57 s ASN 34 Cb 0.00 0.26 -0.02 0.00 0.41 0.00 0.00 41.25 41.90 2j57 s ASN 34 CO 0.00 -0.09 1.41 -0.63 -1.51 0.00 0.00 177.10 176.28 2j57 s ILE 35 N 0.51 4.02 0.54 0.60 1.01 -0.75 -0.64 121.20 126.49 2j57 s ILE 35 Ca -0.04 1.22 0.21 0.00 0.00 0.00 0.00 60.65 62.04 2j57 s ILE 35 Cb -0.05 -3.84 0.30 0.00 0.01 0.00 0.00 42.46 38.88 2j57 s ILE 35 CO -0.02 -0.17 2.18 0.00 0.00 0.00 0.00 174.94 176.93 2j57 h ASP 37 N 0.00 0.00 0.08 0.00 3.58 -1.75 -0.75 116.42 117.59 2j57 h ASP 37 Ca 0.01 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.46 2j57 h ASP 37 Cb 0.02 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.07 2j57 h ASP 37 CO -0.00 0.00 -0.32 0.00 -2.88 0.00 0.00 179.24 176.04 2j57 n SER 39 N -0.16 1.49 0.00 0.00 3.41 -0.78 -4.87 113.62 112.71 2j57 n SER 39 Ca 0.11 -3.03 0.00 0.00 -0.26 0.00 0.00 58.87 55.69 2j57 n SER 39 Cb 0.42 -0.41 0.00 0.00 -0.26 0.00 0.00 64.21 63.96 2j57 n SER 39 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2j57 n GLY 40 N -0.71 0.69 0.00 5.00 0.00 -1.21 -4.79 105.19 104.17 2j57 n GLY 40 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 2j57 n GLY 40 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2j57 n GLY 41 N -2.06 -0.31 1.31 -0.02 0.00 -0.36 -4.32 105.19 99.43 2j57 n GLY 41 Ca 0.00 -1.74 -0.09 0.00 0.00 0.00 0.00 46.02 44.19 2j57 n GLY 41 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2j57 n SER 42 N -1.38 0.51 -0.33 1.61 3.41 -0.59 -4.31 113.62 112.53 2j57 n SER 42 Ca 0.00 -1.86 0.24 0.00 -0.26 0.00 0.00 58.87 56.98 2j57 n SER 42 Cb 0.00 0.51 0.47 0.00 -0.26 0.00 0.00 64.21 64.93 2j57 n SER 42 CO 0.00 0.00 0.00 0.25 -0.16 0.00 0.00 175.04 175.13 2j57 h LEU 43 N 0.00 0.52 -1.01 1.04 5.85 -1.95 -3.24 115.31 116.52 2j57 h LEU 43 Ca -0.11 0.19 0.00 0.00 0.84 0.00 0.00 57.88 58.80 2j57 h LEU 43 Cb 0.48 0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.64 2j57 h LEU 43 CO 0.17 -0.13 0.00 0.35 -0.34 0.00 0.00 178.44 178.50 2j57 n THR 44 N -5.05 0.17 -4.33 1.05 -2.24 -1.26 0.54 114.28 103.16 2j57 n THR 44 Ca 0.32 -0.25 -0.24 0.00 -2.27 0.00 0.00 64.05 61.61 2j57 n THR 44 Cb 0.97 1.24 -0.12 0.00 -2.10 0.00 0.00 70.33 70.33 2j57 n THR 44 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 2j57 s ASN 45 N -0.17 2.78 0.33 3.42 0.01 -1.22 -4.85 114.94 115.24 2j57 s ASN 45 Ca 0.00 -0.79 -0.14 0.00 -0.71 0.00 0.00 52.86 51.22 2j57 s ASN 45 Cb 0.00 -0.17 -0.09 0.00 0.41 0.00 0.00 41.25 41.41 2j57 s ASN 45 CO 0.00 0.03 0.73 0.00 -1.51 0.00 0.00 177.10 176.36 2j57 s PRO 47 N -3.10 2.64 0.42 0.00 0.02 -1.26 -4.54 135.00 129.18 2j57 s PRO 47 Ca 0.54 1.73 -0.25 0.00 0.02 0.00 0.00 61.00 63.04 2j57 s PRO 47 Cb -0.10 -1.90 -0.10 0.00 0.02 0.00 0.00 34.50 32.42 2j57 s PRO 47 CO 0.19 -1.44 1.21 -2.30 -0.33 0.00 0.00 177.00 174.33 2j57 n PRO 48 N -2.14 1.77 0.00 5.54 -0.02 -1.26 -2.03 135.00 136.87 2j57 n PRO 48 Ca 0.13 0.63 0.00 0.00 -2.02 0.00 0.00 63.50 62.24 2j57 n PRO 48 Cb 0.50 -2.30 0.00 0.00 -0.02 0.00 0.00 33.50 31.68 2j57 n PRO 48 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2j57 n GLY 49 N 0.90 3.26 3.97 -1.23 0.00 -1.26 -5.02 105.19 105.81 2j57 n GLY 49 Ca 0.07 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.85 2j57 n GLY 49 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2j57 s THR 50 N -2.13 2.28 -0.07 2.61 -4.23 -0.86 -4.92 115.64 108.32 2j57 s THR 50 Ca 0.00 -0.48 0.03 0.00 -1.18 0.00 0.00 61.69 60.06 2j57 s THR 50 Cb 0.00 -2.80 0.01 0.00 1.34 0.00 0.00 72.50 71.05 2j57 s THR 50 CO 0.00 0.00 -0.16 -0.54 -0.54 0.00 0.00 174.62 173.38 2j57 s LYS 51 N -5.15 2.01 -0.31 3.99 -0.14 -0.08 -4.88 119.74 115.18 2j57 s LYS 51 Ca 0.63 -0.57 -0.20 0.00 -1.36 0.00 0.00 55.97 54.47 2j57 s LYS 51 Cb -0.08 -1.63 -0.01 0.00 -1.68 0.00 0.00 37.83 34.43 2j57 s LYS 51 CO 0.44 0.12 0.64 -1.17 -0.76 0.00 0.00 175.35 174.62 2j57 s LEU 52 N 0.42 4.15 0.45 3.17 2.96 -1.26 0.17 118.68 128.73 2j57 s LEU 52 Ca -0.13 0.43 -0.25 0.00 -0.22 0.00 0.00 54.13 53.96 2j57 s LEU 52 Cb -0.15 -2.83 -0.08 0.00 0.50 0.00 0.00 46.19 43.63 2j57 s LEU 52 CO 0.04 -0.50 1.40 0.00 -1.32 0.00 0.00 176.35 175.98 2j57 s ALA 53 N 2.64 3.23 -0.74 5.97 0.00 -0.86 -3.87 121.76 128.12 2j57 s ALA 53 Ca 0.26 1.41 0.22 0.00 0.00 0.00 0.00 51.96 53.85 2j57 s ALA 53 Cb -0.15 -3.57 -0.11 0.00 0.00 0.00 0.00 23.12 19.30 2j57 s ALA 53 CO 0.12 -1.12 0.91 0.25 0.00 0.00 0.00 175.76 175.92 2j57 n THR 54 N -0.16 0.04 -4.57 0.00 -2.24 -0.86 -4.81 114.28 101.68 2j57 n THR 54 Ca 0.05 -0.14 -0.22 0.00 -2.27 0.00 0.00 64.05 61.47 2j57 n THR 54 Cb 0.42 0.56 -0.15 0.00 -2.10 0.00 0.00 70.33 69.06 2j57 n THR 54 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2j57 s ALA 55 N -3.14 1.07 0.00 6.98 0.00 -0.78 -5.01 121.76 120.88 2j57 s ALA 55 Ca 0.05 -0.52 0.00 0.00 0.00 0.00 0.00 51.96 51.48 2j57 s ALA 55 Cb 0.15 -0.30 0.00 0.00 0.00 0.00 0.00 23.12 22.97 2j57 s ALA 55 CO 0.84 0.24 0.00 -1.13 0.00 0.00 0.00 175.76 175.71 2j57 n SER 56 N 2.91 0.00 -3.67 0.00 3.41 -1.26 -4.34 113.62 110.67 2j57 n SER 56 Ca -0.15 0.00 -0.06 0.00 -0.26 0.00 0.00 58.87 58.40 2j57 n SER 56 Cb 0.55 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.49 2j57 n SER 56 CO 0.00 0.00 0.00 0.68 -0.16 0.00 0.00 175.04 175.56 2j57 s VAL 58 N 2.40 0.00 -0.14 -3.33 -7.23 -0.83 -4.87 120.40 106.40 2j57 s VAL 58 Ca 0.00 -0.84 -0.29 0.00 -1.81 0.00 0.00 61.98 59.04 2j57 s VAL 58 Cb 0.00 -2.18 0.09 0.00 0.56 0.00 0.00 36.38 34.86 2j57 s VAL 58 CO 0.00 0.00 0.82 0.00 -0.31 0.00 0.00 175.10 175.61 2j57 s ALA 59 N -3.35 -1.84 -0.16 1.32 0.00 -0.87 -4.58 121.76 112.28 2j57 s ALA 59 Ca 0.13 1.57 -0.23 0.00 0.00 0.00 0.00 51.96 53.42 2j57 s ALA 59 Cb -0.04 -0.55 -0.02 0.00 0.00 0.00 0.00 23.12 22.51 2j57 s ALA 59 CO 0.06 -0.33 0.74 0.45 0.00 0.00 0.00 175.76 176.67 2j57 s SER 60 N -0.78 6.87 -0.09 0.00 0.15 -1.26 -1.22 113.70 117.38 2j57 s SER 60 Ca -0.05 1.07 0.03 0.00 0.70 0.00 0.00 55.95 57.70 2j57 s SER 60 Cb -0.01 -2.41 0.00 0.00 -1.71 0.00 0.00 66.02 61.89 2j57 s SER 60 CO 0.04 -0.30 -0.21 0.00 1.20 0.00 0.00 173.24 173.98 2j57 s TYR 62 N 0.43 2.64 -0.45 0.00 5.04 -1.26 -0.67 117.35 123.08 2j57 s TYR 62 Ca -0.18 0.67 -0.18 0.00 -2.44 0.00 0.00 57.07 54.94 2j57 s TYR 62 Cb -0.17 -3.72 0.04 0.00 0.35 0.00 0.00 41.96 38.45 2j57 s TYR 62 CO 0.07 -2.78 0.51 1.21 -1.34 0.00 0.00 175.55 173.23 2j57 s ASN 63 N 2.22 6.22 0.00 4.32 2.47 0.14 -4.85 114.94 125.46 2j57 s ASN 63 Ca 0.66 -0.76 0.14 0.00 0.42 0.00 0.00 52.86 53.31 2j57 s ASN 63 Cb -0.32 -2.25 0.59 0.00 -1.45 0.00 0.00 41.25 37.82 2j57 s ASN 63 CO 0.26 -0.70 1.43 -0.81 -3.72 0.00 0.00 177.10 173.57 2j57 n PRO 64 N 5.81 0.01 0.09 0.43 -0.04 -1.26 -0.95 135.00 139.09 2j57 n PRO 64 Ca -0.07 0.26 -0.23 0.00 -0.04 0.00 0.00 63.50 63.43 2j57 n PRO 64 Cb 0.46 -1.50 -0.15 0.00 -0.04 0.00 0.00 33.50 32.27 2j57 n PRO 64 CO 0.00 0.00 0.00 1.15 -0.04 0.00 0.00 175.50 176.61 2j57 h THR 65 N 0.00 1.04 -0.00 0.52 2.02 -1.94 -3.38 112.91 111.17 2j57 h THR 65 Ca 0.00 -2.59 0.00 0.00 0.77 0.00 0.00 66.41 64.59 2j57 h THR 65 Cb 0.23 2.83 0.00 0.00 -1.74 0.00 0.00 68.15 69.47 2j57 h THR 65 CO 0.00 0.84 -0.03 -0.90 0.37 0.00 0.00 175.52 175.80 2j57 n ASP 66 N -3.61 1.19 0.00 4.18 5.68 -1.12 -5.01 116.55 117.87 2j57 n ASP 66 Ca -0.22 -1.10 0.00 0.00 -0.50 0.00 0.00 54.79 52.97 2j57 n ASP 66 Cb 1.08 0.16 0.00 0.00 -1.14 0.00 0.00 41.12 41.22 2j57 n ASP 66 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2j57 n GLY 67 N 0.39 0.77 3.69 6.12 0.00 -0.12 -5.04 105.19 111.00 2j57 n GLY 67 Ca 0.02 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.69 2j57 n GLY 67 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2j57 s GLN 68 N -0.13 3.22 0.25 1.61 -1.52 -1.14 -4.84 119.66 117.11 2j57 s GLN 68 Ca 0.00 -0.37 -0.29 0.00 -1.95 0.00 0.00 55.36 52.76 2j57 s GLN 68 Cb 0.00 -2.91 -0.09 0.00 -0.22 0.00 0.00 33.01 29.79 2j57 s GLN 68 CO 0.00 0.63 0.92 -1.12 -0.25 0.00 0.00 175.29 175.47 2j57 s SER 69 N -0.66 7.55 0.00 5.90 0.01 -1.26 0.24 113.70 125.47 2j57 s SER 69 Ca 0.11 1.89 0.04 0.00 1.31 0.00 0.00 55.95 59.30 2j57 s SER 69 Cb -0.12 -2.59 -0.01 0.00 0.21 0.00 0.00 66.02 63.51 2j57 s SER 69 CO 0.02 0.11 -0.13 -0.31 0.41 0.00 0.00 173.24 173.35 2j57 s TYR 70 N -1.28 1.13 -0.22 2.43 1.51 0.16 -3.18 117.35 117.91 2j57 s TYR 70 Ca 0.43 -0.24 -0.29 0.00 -1.01 0.00 0.00 57.07 55.95 2j57 s TYR 70 Cb -0.24 -0.72 -0.01 0.00 -0.11 0.00 0.00 41.96 40.88 2j57 s TYR 70 CO 0.30 -0.01 1.37 -1.17 -1.11 0.00 0.00 175.55 174.93 2j57 s LEU 71 N -0.47 4.03 -0.23 -1.29 2.96 -0.39 -0.45 118.68 122.83 2j57 s LEU 71 Ca 0.04 1.54 -0.09 0.00 -0.22 0.00 0.00 54.13 55.40 2j57 s LEU 71 Cb -0.05 -3.54 -0.04 0.00 0.50 0.00 0.00 46.19 43.05 2j57 s LEU 71 CO -0.00 -0.98 0.13 -0.63 -1.32 0.00 0.00 176.35 173.54 2j57 s ILE 72 N 4.18 5.04 -0.38 6.68 -1.09 -0.36 0.01 121.20 135.28 2j57 s ILE 72 Ca 0.60 0.07 -0.16 0.00 -2.23 0.00 0.00 60.65 58.93 2j57 s ILE 72 Cb -0.21 -3.34 0.01 0.00 -1.58 0.00 0.00 42.46 37.33 2j57 s ILE 72 CO 0.22 0.36 0.38 0.00 -1.23 0.00 0.00 174.94 174.66 2j57 s ALA 73 N 1.10 3.46 -1.48 9.38 0.00 -0.83 -2.04 121.76 131.36 2j57 s ALA 73 Ca 0.06 -1.41 -0.11 0.00 0.00 0.00 0.00 51.96 50.51 2j57 s ALA 73 Cb -0.14 -2.92 -0.06 0.00 0.00 0.00 0.00 23.12 20.00 2j57 s ALA 73 CO 0.04 -1.34 2.68 0.66 0.00 0.00 0.00 175.76 177.81 2j57 n TYR 74 N 5.44 2.48 -1.99 0.00 4.01 -1.26 -4.01 117.16 121.83 2j57 n TYR 74 Ca -0.09 -2.89 -0.42 0.00 -0.16 0.00 0.00 57.90 54.35 2j57 n TYR 74 Cb 0.48 -2.38 -0.03 0.00 -0.31 0.00 0.00 39.34 37.10 2j57 n TYR 74 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 2j57 s ARG 75 N 2.63 4.23 0.45 -0.72 0.52 -1.26 -4.73 118.95 120.06 2j57 s ARG 75 Ca 0.61 2.27 -0.09 0.00 -0.52 0.00 0.00 55.73 58.00 2j57 s ARG 75 Cb 0.16 -3.44 -0.05 0.00 0.52 0.00 0.00 34.95 32.14 2j57 s ARG 75 CO -0.06 -0.65 0.80 -0.51 0.02 0.00 0.00 175.30 174.91 2j57 s ASP 76 N 1.86 6.42 -0.14 0.23 1.01 -1.00 -1.40 116.67 123.64 2j57 s ASP 76 Ca 0.71 1.11 -0.04 0.00 0.71 0.00 0.00 52.55 55.03 2j57 s ASP 76 Cb -0.39 -2.32 -0.03 0.00 1.01 0.00 0.00 42.92 41.19 2j57 s ASP 76 CO 0.31 -0.50 -0.01 0.00 0.21 0.00 0.00 175.17 175.18 2j57 n GLY 79 N -0.28 0.80 3.27 0.00 0.00 -0.83 -0.90 105.19 107.26 2j57 n GLY 79 Ca -0.08 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.77 2j57 n GLY 79 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2j57 s TYR 80 N -2.10 1.46 0.71 1.61 1.51 -1.26 -4.97 117.35 114.32 2j57 s TYR 80 Ca 0.00 -0.59 -0.13 0.00 -1.01 0.00 0.00 57.07 55.33 2j57 s TYR 80 Cb 0.00 -0.74 0.03 0.00 -0.11 0.00 0.00 41.96 41.14 2j57 s TYR 80 CO 0.00 0.19 1.11 1.21 -1.11 0.00 0.00 175.55 176.95 2j57 s ASN 81 N -2.79 4.76 0.35 2.29 2.47 -1.26 -3.79 114.94 116.96 2j57 s ASN 81 Ca 0.14 1.96 -0.28 0.00 0.42 0.00 0.00 52.86 55.10 2j57 s ASN 81 Cb -0.03 -2.54 -0.12 0.00 -1.45 0.00 0.00 41.25 37.11 2j57 s ASN 81 CO 0.04 -1.86 1.42 0.55 -3.72 0.00 0.00 177.10 173.52 2j57 n VAL 82 N -2.89 1.85 0.22 -5.21 3.14 -0.89 -4.55 118.33 110.01 2j57 n VAL 82 Ca 0.10 -0.46 0.07 0.00 -2.96 0.00 0.00 64.34 61.09 2j57 n VAL 82 Cb 0.52 -1.80 0.51 0.00 -1.06 0.00 0.00 33.84 32.01 2j57 n VAL 82 CO 0.00 0.00 0.00 0.77 -6.46 0.00 0.00 176.83 171.14 2j57 h SER 83 N 3.05 0.00 0.00 6.55 4.64 -1.75 -3.46 113.55 122.58 2j57 h SER 83 Ca -0.48 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.84 2j57 h SER 83 Cb 1.26 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.35 2j57 h SER 83 CO 0.66 0.25 0.00 0.61 -0.87 0.00 0.00 176.83 177.47 2j57 n GLY 84 N -0.55 0.36 3.59 -0.77 0.00 -1.26 -5.03 105.19 101.52 2j57 n GLY 84 Ca -0.02 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.67 2j57 n GLY 84 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2j57 s ARG 85 N -0.77 2.69 -1.18 1.61 0.52 -1.26 -4.67 118.95 115.90 2j57 s ARG 85 Ca 0.00 -0.60 -0.07 0.00 -0.52 0.00 0.00 55.73 54.55 2j57 s ARG 85 Cb 0.00 -2.56 -0.02 0.00 0.52 0.00 0.00 34.95 32.88 2j57 s ARG 85 CO 0.00 0.65 0.82 0.00 0.02 0.00 0.00 175.30 176.79 2j57 s PRO 87 N -5.44 4.38 0.05 0.00 0.04 -1.26 -1.82 135.00 130.96 2j57 s PRO 87 Ca 0.25 1.92 0.02 0.00 0.04 0.00 0.00 61.00 63.23 2j57 s PRO 87 Cb -0.06 -3.29 -0.03 0.00 0.04 0.00 0.00 34.50 31.16 2j57 s PRO 87 CO 0.79 -0.34 -0.07 0.00 0.04 0.00 0.00 177.00 177.42 2j57 s LEU 89 N -1.96 0.29 0.23 0.00 2.96 -1.26 -1.38 118.68 117.56 2j57 s LEU 89 Ca -0.05 -0.86 0.11 0.00 -0.22 0.00 0.00 54.13 53.11 2j57 s LEU 89 Cb -0.06 -0.11 -0.05 0.00 0.50 0.00 0.00 46.19 46.48 2j57 s LEU 89 CO -0.01 -0.39 -0.15 0.20 -1.32 0.00 0.00 176.35 174.68 2j57 s ASN 90 N 2.18 3.87 -0.21 3.68 0.01 -0.60 -5.03 114.94 118.84 2j57 s ASN 90 Ca 0.06 -0.82 0.23 0.00 -0.71 0.00 0.00 52.86 51.62 2j57 s ASN 90 Cb -0.16 -0.48 0.49 0.00 0.41 0.00 0.00 41.25 41.51 2j57 s ASN 90 CO -0.24 0.07 1.13 0.35 -1.51 0.00 0.00 177.10 176.89 2j57 n THR 91 N -0.31 1.11 -2.21 1.60 -2.24 -1.19 -4.06 114.28 106.97 2j57 n THR 91 Ca -0.08 -2.64 -0.42 0.00 -2.27 0.00 0.00 64.05 58.64 2j57 n THR 91 Cb 0.58 1.09 -0.03 0.00 -2.10 0.00 0.00 70.33 69.88 2j57 n THR 91 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2j57 s GLU 92 N -3.07 4.27 -0.18 -0.78 0.41 -0.09 -1.96 118.70 117.28 2j57 s GLU 92 Ca 0.30 1.97 0.00 0.00 -0.41 0.00 0.00 54.97 56.83 2j57 s GLU 92 Cb 0.34 -3.61 0.00 0.00 -1.78 0.00 0.00 34.13 29.08 2j57 s GLU 92 CO -0.06 -0.60 0.00 0.41 -0.49 0.00 0.00 175.26 174.52 2j57 n GLY 93 N 3.68 0.30 3.70 -1.39 0.00 -1.26 -4.63 105.19 105.59 2j57 n GLY 93 Ca 0.13 -0.04 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 2j57 n GLY 93 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2j57 s GLU 94 N -1.64 4.44 0.22 1.61 -6.30 -0.83 -4.98 118.70 111.23 2j57 s GLU 94 Ca 0.00 1.51 0.06 0.00 -2.50 0.00 0.00 54.97 54.04 2j57 s GLU 94 Cb 0.00 -3.50 -0.04 0.00 0.00 0.00 0.00 34.13 30.59 2j57 s GLU 94 CO 0.00 -0.27 0.18 -0.51 0.02 0.00 0.00 175.26 174.67 2j57 s LEU 95 N 1.70 3.82 1.16 2.70 1.43 -0.87 -5.00 118.68 123.61 2j57 s LEU 95 Ca 0.52 -0.21 -0.13 0.00 -1.03 0.00 0.00 54.13 53.29 2j57 s LEU 95 Cb -0.22 -2.37 0.28 0.00 0.03 0.00 0.00 46.19 43.91 2j57 s LEU 95 CO 0.23 -0.00 1.03 -2.84 0.23 0.00 0.00 176.35 175.00 2j57 s PRO 96 N -3.60 -0.89 0.48 1.29 0.02 -1.26 -3.74 135.00 127.31 2j57 s PRO 96 Ca 0.32 0.86 0.16 0.00 0.02 0.00 0.00 61.00 62.35 2j57 s PRO 96 Cb -0.09 -1.56 1.17 0.00 0.02 0.00 0.00 34.50 34.04 2j57 s PRO 96 CO 0.24 -3.71 2.07 -0.24 -0.33 0.00 0.00 177.00 175.03 2j57 h VAL 97 N -2.61 0.95 0.00 3.83 3.04 -1.98 0.21 116.25 119.69 2j57 h VAL 97 Ca -0.61 -0.07 0.00 0.00 -1.01 0.00 0.00 66.70 65.01 2j57 h VAL 97 Cb 1.33 0.74 0.00 0.00 -2.01 0.00 0.00 31.29 31.35 2j57 h VAL 97 CO 0.50 0.04 0.00 0.10 -1.01 0.00 0.00 177.57 177.20 2j57 h TYR 98 N 0.19 0.00 -2.63 3.17 -0.00 -2.03 -2.53 116.97 113.14 2j57 h TYR 98 Ca 0.14 0.00 -0.75 0.00 -0.00 0.00 0.00 58.73 58.11 2j57 h TYR 98 Cb 0.30 0.00 -0.32 0.00 -0.00 0.00 0.00 36.73 36.71 2j57 h TYR 98 CO -0.00 0.00 0.46 0.54 -0.00 0.00 0.00 178.16 179.16 2j57 n ARG 99 N -2.47 4.15 -0.02 0.10 5.12 0.73 -4.95 116.66 119.33 2j57 n ARG 99 Ca 0.00 -4.62 -0.00 0.00 -1.93 0.00 0.00 57.85 51.31 2j57 n ARG 99 Cb 0.17 -2.44 0.30 0.00 -1.16 0.00 0.00 32.46 29.33 2j57 n ARG 99 CO 0.00 0.00 0.00 -1.00 -1.93 0.00 0.00 177.63 174.70 2j57 h PRO 100 N 4.87 0.56 -0.41 5.56 0.13 -1.62 -1.69 132.00 139.40 2j57 h PRO 100 Ca 0.24 -0.11 0.12 0.00 -0.87 0.00 0.00 66.00 65.38 2j57 h PRO 100 Cb 0.58 -0.09 -0.02 0.00 0.13 0.00 0.00 31.00 31.60 2j57 h PRO 100 CO 1.19 0.56 1.07 1.05 -0.23 0.00 0.00 178.00 181.63 2j57 h GLU 101 N 0.55 0.00 0.00 0.86 9.09 -1.90 0.02 114.58 123.19 2j57 h GLU 101 Ca 0.12 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.53 2j57 h GLU 101 Cb 0.28 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.38 2j57 h GLU 101 CO 0.00 0.00 0.00 1.19 0.05 0.00 0.00 179.01 180.25 2j57 n PHE 102 N -2.80 0.00 -3.50 2.06 3.72 -0.66 -1.96 117.46 114.31 2j57 n PHE 102 Ca 0.09 -0.05 -0.37 0.00 -0.05 0.00 0.00 57.45 57.07 2j57 n PHE 102 Cb 1.20 -0.01 -0.07 0.00 -0.94 0.00 0.00 39.48 39.66 2j57 n PHE 102 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2j57 s ALA 103 N -0.11 3.58 -1.33 4.37 0.00 -0.01 -2.05 121.76 126.21 2j57 s ALA 103 Ca 0.00 -0.52 0.16 0.00 0.00 0.00 0.00 51.96 51.60 2j57 s ALA 103 Cb 0.00 -2.46 0.48 0.00 0.00 0.00 0.00 23.12 21.14 2j57 s ALA 103 CO 0.00 -0.06 1.40 0.27 0.00 0.00 0.00 175.76 177.37 2j57 n ASN 104 N 3.92 3.50 0.10 0.00 0.23 -1.26 -4.36 115.26 117.39 2j57 n ASN 104 Ca -0.11 -2.07 0.12 0.00 -0.53 0.00 0.00 54.58 51.99 2j57 n ASN 104 Cb 0.52 -0.37 0.04 0.00 -2.08 0.00 0.00 39.78 37.89 2j57 n ASN 104 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 2j57 h ASP 105 N 3.07 0.00 -3.92 0.53 3.32 -1.95 -3.43 116.42 114.04 2j57 h ASP 105 Ca 0.00 -0.05 -0.53 0.00 0.02 0.00 0.00 57.03 56.47 2j57 h ASP 105 Cb 0.91 0.00 0.09 0.00 0.22 0.00 0.00 39.33 40.55 2j57 h ASP 105 CO 0.02 0.03 0.69 -0.63 -1.72 0.00 0.00 179.24 177.63 2j57 s ILE 106 N -3.31 2.40 -0.62 0.35 1.01 -1.26 -4.96 121.20 114.81 2j57 s ILE 106 Ca 0.01 0.40 -0.27 0.00 0.00 0.00 0.00 60.65 60.79 2j57 s ILE 106 Cb 0.10 -3.25 -0.01 0.00 0.01 0.00 0.00 42.46 39.31 2j57 s ILE 106 CO 0.77 0.09 1.78 -0.63 0.00 0.00 0.00 174.94 176.95 2j57 s ILE 107 N -1.16 3.41 -1.37 2.92 -1.09 -1.26 -4.94 121.20 117.70 2j57 s ILE 107 Ca 0.52 0.24 -0.15 0.00 -2.23 0.00 0.00 60.65 59.04 2j57 s ILE 107 Cb -0.42 -4.06 0.07 0.00 -1.58 0.00 0.00 42.46 36.47 2j57 s ILE 107 CO 0.56 -1.02 1.99 0.79 -1.23 0.00 0.00 174.94 176.04 2j57 n TRP 108 N 12.26 3.92 0.34 3.97 7.02 -1.26 -4.41 117.44 139.28 2j57 n TRP 108 Ca 0.18 -2.94 0.04 0.00 -1.02 0.00 0.00 57.50 53.76 2j57 n TRP 108 Cb 0.52 -2.50 -0.03 0.00 -2.42 0.00 0.00 31.31 26.88 2j57 n TRP 108 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 2j57 n PHE 110 N -0.94 1.87 -0.22 0.00 3.72 -1.26 -2.01 117.46 118.62 2j57 n PHE 110 Ca 0.02 0.51 0.00 0.00 -0.05 0.00 0.00 57.45 57.93 2j57 n PHE 110 Cb 0.13 -2.40 0.00 0.00 -0.94 0.00 0.00 39.48 36.27 2j57 n PHE 110 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2j57 n GLY 111 N 2.13 1.16 3.77 1.37 0.00 -1.26 -1.87 105.19 110.48 2j57 n GLY 111 Ca 0.13 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.79 2j57 n GLY 111 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2j57 s ALA 112 N -2.72 2.70 0.75 4.61 0.00 -0.85 -4.26 121.76 121.99 2j57 s ALA 112 Ca 0.00 0.91 -0.15 0.00 0.00 0.00 0.00 51.96 52.71 2j57 s ALA 112 Cb 0.00 -3.39 0.01 0.00 0.00 0.00 0.00 23.12 19.73 2j57 s ALA 112 CO 0.00 -0.87 0.84 0.39 0.00 0.00 0.00 175.76 176.11 2j57 n GLU 113 N -1.24 0.35 -1.43 0.00 4.71 -1.26 -2.88 120.64 118.89 2j57 n GLU 113 Ca 0.11 0.17 -0.12 0.00 -0.01 0.00 0.00 57.16 57.31 2j57 n GLU 113 Cb 0.50 -2.11 -0.05 0.00 -1.01 0.00 0.00 31.44 28.77 2j57 n GLU 113 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 2j57 n ASP 114 N -1.48 -3.29 -2.85 1.62 8.00 -1.26 -2.18 116.55 115.10 2j57 n ASP 114 Ca 0.12 0.30 -0.21 0.00 0.71 0.00 0.00 54.79 55.70 2j57 n ASP 114 Cb 0.50 -3.09 0.02 0.00 -0.02 0.00 0.00 41.12 38.52 2j57 n ASP 114 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 2j57 n ASP 115 N -0.49 -5.73 -4.75 -2.24 8.00 -1.14 -4.94 116.55 105.26 2j57 n ASP 115 Ca -0.13 -0.20 -0.41 0.00 0.71 0.00 0.00 54.79 54.77 2j57 n ASP 115 Cb 0.42 -4.69 -0.02 0.00 -0.02 0.00 0.00 41.12 36.81 2j57 n ASP 115 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2j57 s ALA 116 N -3.09 3.57 0.00 2.24 0.00 -0.93 -4.88 121.76 118.67 2j57 s ALA 116 Ca 0.21 1.26 0.00 0.00 0.00 0.00 0.00 51.96 53.44 2j57 s ALA 116 Cb -0.10 -3.52 0.00 0.00 0.00 0.00 0.00 23.12 19.50 2j57 s ALA 116 CO 0.26 -0.67 0.07 -1.33 0.00 0.00 0.00 175.76 174.09 2j57 n MET 117 N 1.96 0.96 -2.26 0.00 2.81 -1.26 -4.63 117.12 114.70 2j57 n MET 117 Ca 0.05 -0.07 -0.32 0.00 -1.81 0.00 0.00 57.70 55.55 2j57 n MET 117 Cb 0.41 -0.38 -0.02 0.00 -0.71 0.00 0.00 33.22 32.53 2j57 n MET 117 CO 0.00 0.00 0.00 0.95 1.51 0.00 0.00 175.97 178.43 2j57 s THR 118 N -0.16 4.19 -0.19 2.03 -4.23 -1.26 -4.85 115.64 111.17 2j57 s THR 118 Ca 0.00 1.06 -0.15 0.00 -1.18 0.00 0.00 61.69 61.42 2j57 s THR 118 Cb 0.00 -3.56 -0.04 0.00 1.34 0.00 0.00 72.50 70.24 2j57 s THR 118 CO 0.00 -0.59 0.38 -0.47 -0.54 0.00 0.00 174.62 173.40 2j57 s TYR 119 N -2.52 3.39 -0.06 3.99 5.04 -1.25 -1.96 117.35 123.99 2j57 s TYR 119 Ca 0.61 0.62 -0.08 0.00 -2.44 0.00 0.00 57.07 55.78 2j57 s TYR 119 Cb -0.13 -2.49 -0.04 0.00 0.35 0.00 0.00 41.96 39.66 2j57 s TYR 119 CO 0.33 0.04 -0.17 1.58 -1.34 0.00 0.00 175.55 175.99 2j57 n HIS 120 N 4.27 0.00 -3.78 4.97 -0.00 -0.38 -2.09 115.22 118.22 2j57 n HIS 120 Ca -0.09 0.00 -0.03 0.00 -0.00 0.00 0.00 57.72 57.60 2j57 n HIS 120 Cb 0.51 -0.30 -0.00 0.00 -0.00 0.00 0.00 29.99 30.20 2j57 n HIS 120 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.34 176.34 2j57 s THR 122 N -2.84 0.87 0.28 0.00 2.01 0.19 -0.62 115.64 115.52 2j57 s THR 122 Ca 0.15 -0.42 0.05 0.00 0.31 0.00 0.00 61.69 61.79 2j57 s THR 122 Cb -0.01 -0.76 -0.02 0.00 0.01 0.00 0.00 72.50 71.71 2j57 s THR 122 CO 0.02 0.26 0.41 0.27 -0.69 0.00 0.00 174.62 174.90 2j57 s ILE 123 N 0.11 4.94 -0.56 1.82 -4.36 -0.49 -2.86 121.20 119.79 2j57 s ILE 123 Ca -0.02 -0.94 0.06 0.00 -0.26 0.00 0.00 60.65 59.50 2j57 s ILE 123 Cb -0.08 -3.74 0.32 0.00 1.25 0.00 0.00 42.46 40.20 2j57 s ILE 123 CO 0.01 -0.31 0.86 -1.20 0.24 0.00 0.00 174.94 174.54 2j57 n SER 124 N -1.51 3.72 -4.80 4.36 7.64 0.19 -4.19 113.62 119.03 2j57 n SER 124 Ca -0.06 -3.51 -0.35 0.00 1.01 0.00 0.00 58.87 55.95 2j57 n SER 124 Cb 0.57 -0.59 -0.06 0.00 -1.01 0.00 0.00 64.21 63.11 2j57 n SER 124 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 2j57 s PRO 125 N -3.04 4.37 -0.03 1.43 0.04 -1.26 -4.82 135.00 131.69 2j57 s PRO 125 Ca 0.45 1.10 -0.29 0.00 0.04 0.00 0.00 61.00 62.31 2j57 s PRO 125 Cb 0.26 -2.66 -0.03 0.00 0.04 0.00 0.00 34.50 32.11 2j57 s PRO 125 CO -0.10 0.23 0.95 0.42 0.04 0.00 0.00 177.00 178.54 2j57 s ILE 126 N -1.74 4.88 -0.06 0.56 1.01 -1.26 -1.96 121.20 122.62 2j57 s ILE 126 Ca 0.51 1.98 -0.00 0.00 0.00 0.00 0.00 60.65 63.13 2j57 s ILE 126 Cb -0.15 -4.28 -0.00 0.00 0.01 0.00 0.00 42.46 38.03 2j57 s ILE 126 CO 0.20 0.14 0.03 0.58 0.00 0.00 0.00 174.94 175.89 2j57 h VAL 127 N 4.85 0.00 -2.95 2.92 2.07 -0.78 -3.48 116.25 118.89 2j57 h VAL 127 Ca -0.39 -0.60 -0.05 0.00 0.82 0.00 0.00 66.70 66.48 2j57 h VAL 127 Cb 1.20 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.97 2j57 h VAL 127 CO 0.77 0.00 0.19 0.61 0.02 0.00 0.00 177.57 179.16 2j57 n GLY 128 N 1.81 1.26 0.00 2.17 0.00 -1.24 -5.02 105.19 104.17 2j57 n GLY 128 Ca -0.00 -1.26 0.00 0.00 0.00 0.00 0.00 46.02 44.76 2j57 n GLY 128 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 2j57 n LYS 129 N -0.46 0.92 0.00 1.61 4.81 -1.26 -1.27 118.16 122.51 2j57 n LYS 129 Ca -0.07 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.37 2j57 n LYS 129 Cb 0.51 -1.00 0.00 0.00 0.02 0.00 0.00 35.03 34.55 2j57 n LYS 129 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 2j57 n ALA 130 N -0.50 0.00 -0.48 3.14 0.00 -1.19 -4.60 120.51 116.89 2j57 n ALA 130 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 2j57 n ALA 130 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 2j57 n ALA 130 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95