#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2k33 s VAL 2 N 0.00 1.76 -0.06 5.18 1.01 -1.05 -5.00 120.40 122.24 2k33 s VAL 2 Ca 0.00 -1.41 -0.01 0.00 0.00 0.00 0.00 61.98 60.56 2k33 s VAL 2 Cb 0.00 -1.56 -0.03 0.00 0.00 0.00 0.00 36.38 34.78 2k33 s VAL 2 CO 0.00 0.09 0.01 -0.63 0.00 0.00 0.00 175.10 174.57 2k33 s ILE 3 N -0.98 4.32 -0.13 2.22 1.01 -1.26 0.34 121.20 126.72 2k33 s ILE 3 Ca 0.08 -0.32 -0.17 0.00 0.00 0.00 0.00 60.65 60.24 2k33 s ILE 3 Cb -0.09 -2.85 -0.04 0.00 0.01 0.00 0.00 42.46 39.48 2k33 s ILE 3 CO 0.03 0.54 0.42 -0.63 0.00 0.00 0.00 174.94 175.31 2k33 s ILE 4 N -0.95 5.22 0.11 2.92 1.01 0.88 -4.94 121.20 125.45 2k33 s ILE 4 Ca 0.15 0.83 0.04 0.00 0.00 0.00 0.00 60.65 61.67 2k33 s ILE 4 Cb -0.11 -3.76 -0.04 0.00 0.01 0.00 0.00 42.46 38.56 2k33 s ILE 4 CO 0.05 0.35 -0.11 -0.54 0.00 0.00 0.00 174.94 174.69 2k33 s LYS 5 N 0.54 0.91 0.00 2.79 -0.14 -1.26 -3.45 119.74 119.13 2k33 s LYS 5 Ca 0.23 -1.21 0.00 0.00 -1.36 0.00 0.00 55.97 53.63 2k33 s LYS 5 Cb -0.14 -0.62 0.00 0.00 -1.68 0.00 0.00 37.83 35.38 2k33 s LYS 5 CO 0.08 0.10 0.00 -0.35 -0.76 0.00 0.00 175.35 174.42 2k33 n PRO 6 N 0.45 -0.17 -0.00 -1.68 -0.04 -1.26 -4.94 135.00 127.36 2k33 n PRO 6 Ca -0.15 0.00 0.02 0.00 -0.04 0.00 0.00 63.50 63.33 2k33 n PRO 6 Cb 0.58 0.00 -0.03 0.00 -0.04 0.00 0.00 33.50 34.01 2k33 n PRO 6 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 2k33 n GLN 7 N -0.87 4.01 -2.61 0.54 7.27 -1.26 -4.27 117.38 120.18 2k33 n GLN 7 Ca 0.00 -0.01 -0.06 0.00 0.07 0.00 0.00 57.00 56.99 2k33 n GLN 7 Cb 0.00 -0.84 -0.01 0.00 2.41 0.00 0.00 30.24 31.81 2k33 n GLN 7 CO 0.00 0.00 0.00 1.33 0.07 0.00 0.00 177.06 178.46 2k33 n VAL 8 N -1.26 0.00 -4.17 1.69 0.24 -1.26 -4.81 118.33 108.76 2k33 n VAL 8 Ca 0.00 -0.75 -0.34 0.00 -2.04 0.00 0.00 64.34 61.21 2k33 n VAL 8 Cb 0.09 0.51 -0.11 0.00 -1.47 0.00 0.00 33.84 32.86 2k33 n VAL 8 CO 0.00 0.00 0.00 -0.44 -2.14 0.00 0.00 176.83 174.25 2k33 s SER 9 N -2.02 5.08 0.00 -1.34 0.01 -1.26 -3.96 113.70 110.21 2k33 s SER 9 Ca 0.12 -0.08 0.00 0.00 1.31 0.00 0.00 55.95 57.30 2k33 s SER 9 Cb -0.01 -1.86 0.00 0.00 0.21 0.00 0.00 66.02 64.36 2k33 s SER 9 CO 0.09 0.14 0.00 0.61 0.41 0.00 0.00 173.24 174.48 2k33 n GLY 10 N 3.77 1.73 3.05 3.44 0.00 -0.71 -4.75 105.19 111.72 2k33 n GLY 10 Ca -0.17 0.24 -0.13 0.00 0.00 0.00 0.00 46.02 45.96 2k33 n GLY 10 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2k33 s VAL 11 N 1.72 -0.00 0.51 1.61 1.01 -0.98 -0.70 120.40 123.56 2k33 s VAL 11 Ca 0.00 0.01 -0.22 0.00 0.00 0.00 0.00 61.98 61.77 2k33 s VAL 11 Cb 0.00 -0.26 -0.07 0.00 0.00 0.00 0.00 36.38 36.05 2k33 s VAL 11 CO 0.00 0.00 1.11 -0.38 0.00 0.00 0.00 175.10 175.83 2k33 n ILE 12 N 3.07 3.15 0.00 2.22 2.08 -0.98 -1.78 119.36 127.12 2k33 n ILE 12 Ca -0.13 -0.50 0.00 0.00 0.56 0.00 0.00 62.75 62.68 2k33 n ILE 12 Cb 0.58 -1.33 0.00 0.00 -0.75 0.00 0.00 39.64 38.14 2k33 n ILE 12 CO 0.00 0.00 0.00 0.52 0.56 0.00 0.00 176.55 177.63 2k33 n VAL 13 N -0.97 0.00 -3.80 1.39 0.31 0.19 -2.27 118.33 113.17 2k33 n VAL 13 Ca 0.10 0.00 -0.01 0.00 -0.01 0.00 0.00 64.34 64.43 2k33 n VAL 13 Cb 0.43 -0.68 0.00 0.00 -0.91 0.00 0.00 33.84 32.68 2k33 n VAL 13 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 2k33 s ASN 14 N -3.39 -0.05 -0.22 4.52 2.47 -1.24 -4.85 114.94 112.18 2k33 s ASN 14 Ca 0.00 -0.37 -0.04 0.00 0.42 0.00 0.00 52.86 52.87 2k33 s ASN 14 Cb 0.00 0.33 0.09 0.00 -1.45 0.00 0.00 41.25 40.23 2k33 s ASN 14 CO 0.00 -0.64 0.20 -1.59 -3.72 0.00 0.00 177.10 171.35 2k33 s LYS 15 N -2.46 0.19 -0.89 0.43 -2.85 -1.26 -1.81 119.74 111.09 2k33 s LYS 15 Ca 0.19 0.06 -0.03 0.00 -1.00 0.00 0.00 55.97 55.19 2k33 s LYS 15 Cb 0.00 -1.24 0.21 0.00 -2.06 0.00 0.00 37.83 34.74 2k33 s LYS 15 CO 0.01 -0.73 2.26 1.28 0.10 0.00 0.00 175.35 178.27 2k33 n LEU 16 N 5.31 7.33 -3.62 2.77 4.77 0.12 -4.91 117.00 128.77 2k33 n LEU 16 Ca -0.05 -4.78 -0.10 0.00 -0.03 0.00 0.00 56.01 51.05 2k33 n LEU 16 Cb 0.48 -1.20 -0.03 0.00 -2.33 0.00 0.00 43.42 40.35 2k33 n LEU 16 CO 0.07 1.89 0.36 0.72 -1.33 0.00 0.00 177.39 179.11 2k33 s PHE 17 N -2.87 -0.33 0.30 -1.77 -0.71 -1.24 -4.29 117.98 107.07 2k33 s PHE 17 Ca 0.51 0.02 0.04 0.00 -1.04 0.00 0.00 56.93 56.46 2k33 s PHE 17 Cb 0.31 0.52 -0.06 0.00 -1.21 0.00 0.00 43.02 42.58 2k33 s PHE 17 CO -0.23 -0.94 0.02 0.15 -1.34 0.00 0.00 175.22 172.89 2k33 s LYS 18 N -3.82 1.56 -0.36 1.99 3.01 -1.26 -5.08 119.74 115.78 2k33 s LYS 18 Ca 0.05 -1.84 -0.23 0.00 -1.01 0.00 0.00 55.97 52.95 2k33 s LYS 18 Cb -0.02 -0.87 0.01 0.00 -1.01 0.00 0.00 37.83 35.94 2k33 s LYS 18 CO -0.06 -0.12 0.77 0.00 0.51 0.00 0.00 175.35 176.44 2k33 s ALA 19 N -3.27 3.44 0.00 5.17 0.00 -1.26 -3.71 121.76 122.13 2k33 s ALA 19 Ca 0.33 -0.65 0.00 0.00 0.00 0.00 0.00 51.96 51.64 2k33 s ALA 19 Cb 0.07 -3.34 0.00 0.00 0.00 0.00 0.00 23.12 19.85 2k33 s ALA 19 CO 0.13 -1.44 0.00 0.41 0.00 0.00 0.00 175.76 174.86 2k33 n GLY 20 N 4.51 0.74 0.50 0.00 0.00 0.85 -4.95 105.19 106.84 2k33 n GLY 20 Ca 0.03 -0.61 -0.03 0.00 0.00 0.00 0.00 46.02 45.42 2k33 n GLY 20 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2k33 n ASP 21 N 1.15 0.38 -4.88 1.61 2.03 -1.24 -4.84 116.55 110.75 2k33 n ASP 21 Ca 0.00 -1.20 -0.36 0.00 0.52 0.00 0.00 54.79 53.75 2k33 n ASP 21 Cb 0.07 -0.05 -0.06 0.00 -0.72 0.00 0.00 41.12 40.36 2k33 n ASP 21 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 2k33 s LYS 22 N -2.33 3.43 0.21 -0.67 1.02 -1.26 -2.38 119.74 117.75 2k33 s LYS 22 Ca 0.07 -0.18 0.10 0.00 0.02 0.00 0.00 55.97 55.98 2k33 s LYS 22 Cb -0.01 -3.16 -0.05 0.00 -0.52 0.00 0.00 37.83 34.10 2k33 s LYS 22 CO 0.05 0.76 -0.19 0.54 -0.92 0.00 0.00 175.35 175.59 2k33 s VAL 23 N -1.09 2.05 0.14 3.17 0.11 0.62 -4.92 120.40 120.48 2k33 s VAL 23 Ca 0.17 -2.12 0.10 0.00 -2.93 0.00 0.00 61.98 57.21 2k33 s VAL 23 Cb -0.12 -2.04 -0.04 0.00 -1.53 0.00 0.00 36.38 32.65 2k33 s VAL 23 CO 0.07 -0.36 -0.24 -0.75 -3.33 0.00 0.00 175.10 170.49 2k33 s LYS 24 N -3.12 1.34 -0.85 1.54 2.47 -1.26 -2.13 119.74 117.72 2k33 s LYS 24 Ca 0.21 -1.35 -0.25 0.00 -1.56 0.00 0.00 55.97 53.03 2k33 s LYS 24 Cb -0.05 -1.70 -0.09 0.00 -1.46 0.00 0.00 37.83 34.53 2k33 s LYS 24 CO 0.09 0.39 2.17 0.15 0.16 0.00 0.00 175.35 178.31 2k33 s LYS 25 N -2.22 2.10 0.00 4.03 1.02 -1.26 -1.33 119.74 122.08 2k33 s LYS 25 Ca 0.14 0.08 0.00 0.00 0.02 0.00 0.00 55.97 56.20 2k33 s LYS 25 Cb -0.09 -4.93 0.00 0.00 -0.52 0.00 0.00 37.83 32.29 2k33 s LYS 25 CO 0.06 -3.89 0.00 0.41 -0.92 0.00 0.00 175.35 171.01 2k33 n GLY 26 N 6.84 1.58 3.82 -3.33 0.00 -0.85 -4.95 105.19 108.30 2k33 n GLY 26 Ca 0.43 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 46.07 2k33 n GLY 26 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2k33 s GLN 27 N -0.11 4.05 0.39 1.61 -2.07 -0.44 -4.71 119.66 118.38 2k33 s GLN 27 Ca 0.00 0.56 -0.26 0.00 -1.82 0.00 0.00 55.36 53.84 2k33 s GLN 27 Cb 0.00 -3.23 -0.09 0.00 -1.09 0.00 0.00 33.01 28.60 2k33 s GLN 27 CO 0.00 0.67 1.24 0.99 -1.32 0.00 0.00 175.29 176.86 2k33 s THR 28 N -1.08 2.88 0.00 3.63 2.01 -1.26 0.14 115.64 121.96 2k33 s THR 28 Ca 0.26 0.79 0.00 0.00 0.31 0.00 0.00 61.69 63.05 2k33 s THR 28 Cb -0.18 -3.46 0.00 0.00 0.01 0.00 0.00 72.50 68.87 2k33 s THR 28 CO 0.16 0.11 0.00 0.18 -0.69 0.00 0.00 174.62 174.38 2k33 n LEU 29 N 0.23 0.36 -4.48 4.42 4.77 0.16 -4.60 117.00 117.86 2k33 n LEU 29 Ca 0.03 0.00 -0.23 0.00 -0.03 0.00 0.00 56.01 55.78 2k33 n LEU 29 Cb 0.45 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.43 2k33 n LEU 29 CO 0.54 -0.00 -0.26 -0.36 -1.33 0.00 0.00 177.39 175.98 2k33 s PHE 30 N -1.27 1.96 -0.16 -1.77 0.08 -0.99 0.10 117.98 115.93 2k33 s PHE 30 Ca 0.00 -0.99 -0.12 0.00 0.12 0.00 0.00 56.93 55.94 2k33 s PHE 30 Cb 0.00 -1.30 0.05 0.00 -0.57 0.00 0.00 43.02 41.20 2k33 s PHE 30 CO 0.00 -0.01 0.41 0.42 -0.10 0.00 0.00 175.22 175.95 2k33 s ILE 31 N -3.24 -0.01 -0.02 0.64 1.01 -0.75 0.22 121.20 119.05 2k33 s ILE 31 Ca 0.33 0.05 -0.01 0.00 0.00 0.00 0.00 60.65 61.02 2k33 s ILE 31 Cb 0.08 -0.60 0.01 0.00 0.01 0.00 0.00 42.46 41.96 2k33 s ILE 31 CO 0.15 0.02 0.04 -0.63 0.00 0.00 0.00 174.94 174.52 2k33 s ILE 32 N 0.85 -0.02 0.05 2.92 1.01 -0.97 0.52 121.20 125.57 2k33 s ILE 32 Ca -0.05 0.08 0.05 0.00 0.00 0.00 0.00 60.65 60.73 2k33 s ILE 32 Cb -0.06 -0.08 -0.04 0.00 0.01 0.00 0.00 42.46 42.30 2k33 s ILE 32 CO -0.07 0.03 -0.08 -0.70 0.00 0.00 0.00 174.94 174.13 2k33 s GLU 33 N 0.45 2.36 0.45 2.79 2.12 -0.73 -0.77 118.70 125.36 2k33 s GLU 33 Ca -0.04 -0.87 0.03 0.00 0.36 0.00 0.00 54.97 54.45 2k33 s GLU 33 Cb -0.05 -2.41 -0.03 0.00 0.26 0.00 0.00 34.13 31.90 2k33 s GLU 33 CO -0.01 0.55 0.05 1.14 -0.54 0.00 0.00 175.26 176.45 2k33 s GLN 34 N -1.83 2.04 0.10 4.30 0.00 -1.26 -2.31 119.66 120.70 2k33 s GLN 34 Ca 0.20 -2.26 0.24 0.00 -0.00 0.00 0.00 55.36 53.53 2k33 s GLN 34 Cb -0.11 -1.20 0.24 0.00 0.00 0.00 0.00 33.01 31.93 2k33 s GLN 34 CO 0.11 -0.35 1.21 -0.25 0.00 0.00 0.00 175.29 176.01 2k33 n ASP 35 N -1.20 0.67 -0.24 12.60 9.92 -1.26 -4.06 116.55 132.97 2k33 n ASP 35 Ca -0.12 0.03 0.26 0.00 -0.53 0.00 0.00 54.79 54.42 2k33 n ASP 35 Cb 0.66 0.38 0.63 0.00 -0.64 0.00 0.00 41.12 42.15 2k33 n ASP 35 CO 0.00 0.00 0.00 1.56 0.13 0.00 0.00 177.20 178.89 2k33 h GLN 36 N 0.00 0.18 -0.98 -1.24 4.20 -1.96 0.32 115.11 115.62 2k33 h GLN 36 Ca 0.00 -0.01 -0.62 0.00 0.06 0.00 0.00 58.65 58.08 2k33 h GLN 36 Cb 0.75 -0.04 -0.30 0.00 0.30 0.00 0.00 27.48 28.20 2k33 h GLN 36 CO 0.00 0.12 0.75 0.00 -0.67 0.00 0.00 178.83 179.03 2k33 n ALA 37 N -2.62 6.07 -0.18 3.87 0.00 -1.26 -4.55 120.51 121.84 2k33 n ALA 37 Ca 0.21 -3.33 -0.05 0.00 0.00 0.00 0.00 53.44 50.28 2k33 n ALA 37 Cb 0.91 -1.63 0.17 0.00 0.00 0.00 0.00 19.45 18.91 2k33 n ALA 37 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 2k33 n SER 38 N -0.98 3.58 -0.11 0.00 3.41 0.11 -4.04 113.62 115.59 2k33 n SER 38 Ca 0.61 -2.72 -0.20 0.00 -0.26 0.00 0.00 58.87 56.30 2k33 n SER 38 Cb 0.95 -0.65 -0.09 0.00 -0.26 0.00 0.00 64.21 64.17 2k33 n SER 38 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 2k33 n LYS 39 N -0.03 0.49 -1.02 4.33 4.01 -1.26 -4.54 118.16 120.14 2k33 n LYS 39 Ca 0.25 0.17 -0.22 0.00 -0.51 0.00 0.00 58.31 58.00 2k33 n LYS 39 Cb 0.98 -1.34 0.07 0.00 -0.51 0.00 0.00 35.03 34.23 2k33 n LYS 39 CO 0.00 0.00 0.00 -0.40 -1.11 0.00 0.00 177.40 175.89 2k33 n ASP 40 N -3.65 6.27 -3.86 4.39 5.75 -1.26 -4.85 116.55 119.34 2k33 n ASP 40 Ca -0.41 -3.29 -0.19 0.00 -0.01 0.00 0.00 54.79 50.88 2k33 n ASP 40 Cb 0.84 -0.97 -0.16 0.00 -1.03 0.00 0.00 41.12 39.80 2k33 n ASP 40 CO 0.00 0.00 0.00 0.72 -0.11 0.00 0.00 177.20 177.81 2k33 s PHE 41 N -2.52 0.61 -1.17 2.11 -0.71 -1.26 -4.93 117.98 110.12 2k33 s PHE 41 Ca 0.43 -0.14 0.00 0.00 -1.04 0.00 0.00 56.93 56.18 2k33 s PHE 41 Cb 0.34 -0.60 0.00 0.00 -1.21 0.00 0.00 43.02 41.55 2k33 s PHE 41 CO 0.01 -0.18 0.00 0.27 -1.34 0.00 0.00 175.22 173.98 2k33 n ASN 42 N 4.16 0.00 -3.81 1.98 0.23 -1.26 -5.01 115.26 111.55 2k33 n ASN 42 Ca -0.24 0.00 -0.42 0.00 -0.53 0.00 0.00 54.58 53.39 2k33 n ASN 42 Cb 0.51 0.00 0.01 0.00 -2.08 0.00 0.00 39.78 38.22 2k33 n ASN 42 CO 0.00 0.00 0.00 -1.14 -0.93 0.00 0.00 177.26 175.19 2k33 n ARG 43 N 0.00 4.79 0.00 -3.83 0.63 -1.26 -4.34 116.66 112.65 2k33 n ARG 43 Ca 0.00 -4.41 0.00 0.00 -0.92 0.00 0.00 57.85 52.52 2k33 n ARG 43 Cb 0.00 -2.54 0.00 0.00 0.45 0.00 0.00 32.46 30.37 2k33 n ARG 43 CO 0.00 0.00 0.00 0.43 -2.51 0.00 0.00 177.63 175.55 2k33 n SER 44 N 1.06 1.21 -0.30 6.15 7.64 -1.26 -4.80 113.62 123.31 2k33 n SER 44 Ca 0.38 0.00 0.28 0.00 1.01 0.00 0.00 58.87 60.54 2k33 n SER 44 Cb 0.30 0.05 0.62 0.00 -1.01 0.00 0.00 64.21 64.17 2k33 n SER 44 CO 0.00 0.00 0.00 0.11 -3.01 0.00 0.00 175.04 172.14 2k33 h LYS 45 N 0.00 0.20 -4.71 1.43 1.57 -1.99 -3.41 116.57 109.66 2k33 h LYS 45 Ca 0.00 -0.01 -0.25 0.00 -1.87 0.00 0.00 60.65 58.52 2k33 h LYS 45 Cb 0.28 -0.05 -0.15 0.00 0.08 0.00 0.00 32.23 32.39 2k33 h LYS 45 CO 0.00 0.13 -0.68 0.00 -0.57 0.00 0.00 179.45 178.34 2k33 s ALA 46 N -5.24 1.16 -0.30 3.86 0.00 -1.26 -5.08 121.76 114.90 2k33 s ALA 46 Ca -0.07 -1.48 0.19 0.00 0.00 0.00 0.00 51.96 50.61 2k33 s ALA 46 Cb 0.24 0.39 0.47 0.00 0.00 0.00 0.00 23.12 24.22 2k33 s ALA 46 CO 0.80 -0.29 1.05 1.28 0.00 0.00 0.00 175.76 178.60 2k33 n LEU 47 N -0.14 1.19 -1.57 0.00 4.32 -1.26 -4.96 117.00 114.57 2k33 n LEU 47 Ca -0.09 -3.43 0.00 0.00 -0.02 0.00 0.00 56.01 52.47 2k33 n LEU 47 Cb 0.62 0.41 0.00 0.00 -1.62 0.00 0.00 43.42 42.83 2k33 n LEU 47 CO 0.32 1.40 -0.44 2.22 -1.22 0.00 0.00 177.39 179.66 2k33 n PHE 48 N -0.34 -3.98 -2.86 -1.77 1.16 -1.26 -5.03 117.46 103.39 2k33 n PHE 48 Ca 0.07 2.15 0.00 0.00 -1.87 0.00 0.00 57.45 57.80 2k33 n PHE 48 Cb 0.82 -3.29 0.01 0.00 -1.61 0.00 0.00 39.48 35.40 2k33 n PHE 48 CO 0.00 0.00 0.00 0.45 -1.87 0.00 0.00 176.76 175.34 2k33 s SER 49 N -4.88 -0.71 0.00 5.98 0.15 -1.26 -4.96 113.70 108.03 2k33 s SER 49 Ca 0.00 -0.48 0.00 0.00 0.70 0.00 0.00 55.95 56.17 2k33 s SER 49 Cb 0.00 0.91 0.00 0.00 -1.71 0.00 0.00 66.02 65.22 2k33 s SER 49 CO 0.00 -0.06 0.00 0.00 1.20 0.00 0.00 173.24 174.38 2k33 n GLN 50 N 3.61 0.00 -3.10 5.44 3.00 -1.26 -3.70 117.38 121.37 2k33 n GLN 50 Ca 0.09 0.00 -0.25 0.00 -0.01 0.00 0.00 57.00 56.83 2k33 n GLN 50 Cb 0.61 0.00 -0.05 0.00 0.00 0.00 0.00 30.24 30.81 2k33 n GLN 50 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 2k33 n SER 51 N 2.35 3.42 0.08 1.08 2.88 -1.26 -4.93 113.62 117.24 2k33 n SER 51 Ca 0.00 -3.45 -0.14 0.00 -1.33 0.00 0.00 58.87 53.94 2k33 n SER 51 Cb 0.00 -0.60 -0.08 0.00 -0.75 0.00 0.00 64.21 62.79 2k33 n SER 51 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2k33 h ALA 52 N 3.30 -0.75 -2.83 -1.46 0.00 -1.93 -3.37 119.26 112.22 2k33 h ALA 52 Ca 0.14 -0.06 -0.59 0.00 0.00 0.00 0.00 54.91 54.40 2k33 h ALA 52 Cb 0.64 0.76 -0.40 0.00 0.00 0.00 0.00 17.79 18.80 2k33 h ALA 52 CO 0.74 -1.00 -0.79 0.42 0.00 0.00 0.00 179.25 178.63 2k33 s ILE 53 N -5.88 0.67 -0.74 0.00 1.01 -1.26 -4.94 121.20 110.06 2k33 s ILE 53 Ca -0.16 -1.86 -0.26 0.00 0.00 0.00 0.00 60.65 58.37 2k33 s ILE 53 Cb 0.08 -1.49 -0.09 0.00 0.01 0.00 0.00 42.46 40.97 2k33 s ILE 53 CO 0.63 -0.88 2.24 -0.55 0.00 0.00 0.00 174.94 176.38 2k33 s SER 54 N 1.01 4.43 0.60 3.58 0.15 -1.26 -4.76 113.70 117.44 2k33 s SER 54 Ca 0.16 0.12 0.29 0.00 0.70 0.00 0.00 55.95 57.22 2k33 s SER 54 Cb -0.22 -2.54 1.34 0.00 -1.71 0.00 0.00 66.02 62.89 2k33 s SER 54 CO -0.07 -3.26 1.73 1.56 1.20 0.00 0.00 173.24 174.41 2k33 h GLN 55 N 14.03 0.00 -1.04 5.44 4.20 -1.97 0.86 115.11 136.63 2k33 h GLN 55 Ca -0.05 0.00 0.34 0.00 0.06 0.00 0.00 58.65 58.99 2k33 h GLN 55 Cb 1.07 0.00 -0.15 0.00 0.30 0.00 0.00 27.48 28.71 2k33 h GLN 55 CO 1.11 0.00 0.61 1.57 -0.67 0.00 0.00 178.83 181.44 2k33 h LYS 56 N 0.00 0.27 0.00 1.46 2.10 -2.05 -3.37 116.57 114.98 2k33 h LYS 56 Ca 0.29 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.93 2k33 h LYS 56 Cb 1.67 -0.06 0.00 0.00 -0.90 0.00 0.00 32.23 32.94 2k33 h LYS 56 CO -0.00 0.18 0.00 0.39 -2.00 0.00 0.00 179.45 178.02 2k33 n GLU 57 N -5.00 0.00 -1.44 0.07 1.02 -0.24 -5.16 120.64 109.88 2k33 n GLU 57 Ca 0.32 0.00 0.03 0.00 -0.02 0.00 0.00 57.16 57.49 2k33 n GLU 57 Cb 1.05 -0.17 -0.02 0.00 -0.02 0.00 0.00 31.44 32.29 2k33 n GLU 57 CO 0.00 0.00 0.00 2.48 1.18 0.00 0.00 177.13 180.79 2k33 n TYR 58 N -0.58 -3.43 -4.42 -0.32 0.18 0.28 -5.02 117.16 103.87 2k33 n TYR 58 Ca 0.00 1.86 -0.20 0.00 1.88 0.00 0.00 57.90 61.44 2k33 n TYR 58 Cb 0.00 -2.92 -0.10 0.00 -0.38 0.00 0.00 39.34 35.94 2k33 n TYR 58 CO 0.00 0.00 0.00 0.34 -2.08 0.00 0.00 176.86 175.12 2k33 s ASP 59 N -5.53 2.37 0.19 9.48 2.15 -1.26 -5.02 116.67 119.05 2k33 s ASP 59 Ca 0.00 -1.28 0.23 0.00 0.43 0.00 0.00 52.55 51.93 2k33 s ASP 59 Cb 0.00 -0.09 0.90 0.00 -0.30 0.00 0.00 42.92 43.44 2k33 s ASP 59 CO 0.00 -0.50 1.70 -1.20 -0.17 0.00 0.00 175.17 174.99 2k33 n SER 60 N -0.59 0.55 -0.26 -0.34 7.64 -1.26 -3.21 113.62 116.15 2k33 n SER 60 Ca -0.04 0.61 0.23 0.00 1.01 0.00 0.00 58.87 60.68 2k33 n SER 60 Cb 0.65 -0.74 0.56 0.00 -1.01 0.00 0.00 64.21 63.68 2k33 n SER 60 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 2k33 h SER 61 N 0.00 0.32 0.15 6.43 0.02 -2.00 0.68 113.55 119.15 2k33 h SER 61 Ca 0.00 0.04 -0.30 0.00 -0.84 0.00 0.00 61.79 60.70 2k33 h SER 61 Cb 0.42 -0.01 0.03 0.00 0.14 0.00 0.00 62.40 62.98 2k33 h SER 61 CO 0.00 0.10 -1.23 0.17 -1.14 0.00 0.00 176.83 174.73 2k33 h LEU 62 N 0.30 0.86 -9.01 5.07 8.10 -1.91 -3.43 115.31 115.29 2k33 h LEU 62 Ca 0.50 -0.79 -0.57 0.00 0.11 0.00 0.00 57.88 57.14 2k33 h LEU 62 Cb 1.42 -0.27 -0.04 0.00 -0.44 0.00 0.00 40.66 41.33 2k33 h LEU 62 CO -0.16 1.59 1.03 0.00 -4.11 0.00 0.00 178.44 176.78 2k33 s ALA 63 N -2.99 3.36 -0.29 0.17 0.00 0.23 -4.95 121.76 117.29 2k33 s ALA 63 Ca -0.09 0.29 0.05 0.00 0.00 0.00 0.00 51.96 52.21 2k33 s ALA 63 Cb 0.06 -3.79 0.20 0.00 0.00 0.00 0.00 23.12 19.58 2k33 s ALA 63 CO 0.93 -1.79 0.58 0.99 0.00 0.00 0.00 175.76 176.47 2k33 s THR 64 N 4.62 -0.97 -0.22 0.00 2.01 -1.26 -4.93 115.64 114.89 2k33 s THR 64 Ca 0.62 -0.02 0.22 0.00 0.31 0.00 0.00 61.69 62.82 2k33 s THR 64 Cb -0.21 -1.00 0.47 0.00 0.01 0.00 0.00 72.50 71.77 2k33 s THR 64 CO 0.25 -0.02 1.17 0.18 -0.69 0.00 0.00 174.62 175.51 2k33 n LEU 65 N 5.42 1.02 -2.15 4.42 4.32 -1.26 -4.88 117.00 123.88 2k33 n LEU 65 Ca 0.04 -2.83 0.00 0.00 -0.02 0.00 0.00 56.01 53.20 2k33 n LEU 65 Cb 0.53 0.33 0.00 0.00 -1.62 0.00 0.00 43.42 42.67 2k33 n LEU 65 CO -0.05 1.04 -0.45 0.47 -1.22 0.00 0.00 177.39 177.17 2k33 n ASP 66 N -0.51 -8.86 -4.07 -1.43 8.00 -1.26 -4.82 116.55 103.60 2k33 n ASP 66 Ca 0.03 1.58 -0.18 0.00 0.71 0.00 0.00 54.79 56.93 2k33 n ASP 66 Cb 0.87 -4.87 -0.13 0.00 -0.02 0.00 0.00 41.12 36.96 2k33 n ASP 66 CO 0.00 0.00 0.00 -1.00 -0.39 0.00 0.00 177.20 175.81 2k33 s HIS 67 N -0.53 0.91 -0.56 1.24 3.76 -1.26 -4.45 115.29 114.40 2k33 s HIS 67 Ca 0.00 -0.30 -0.17 0.00 -0.15 0.00 0.00 55.06 54.44 2k33 s HIS 67 Cb 0.00 -0.56 0.11 0.00 1.11 0.00 0.00 32.58 33.25 2k33 s HIS 67 CO 0.00 -0.01 0.59 0.99 -0.85 0.00 0.00 174.74 175.46 2k33 s THR 68 N -0.71 5.04 0.06 1.30 2.01 0.05 -4.95 115.64 118.44 2k33 s THR 68 Ca -0.00 -1.24 -0.31 0.00 0.31 0.00 0.00 61.69 60.45 2k33 s THR 68 Cb -0.06 -4.39 -0.05 0.00 0.01 0.00 0.00 72.50 68.00 2k33 s THR 68 CO 0.00 -0.96 1.18 -1.61 -0.69 0.00 0.00 174.62 172.54 2k33 s GLU 69 N 2.09 4.44 -0.40 4.92 2.02 -1.26 -2.29 118.70 128.22 2k33 s GLU 69 Ca 0.07 1.74 -0.22 0.00 0.02 0.00 0.00 54.97 56.58 2k33 s GLU 69 Cb -0.27 -3.36 0.02 0.00 0.10 0.00 0.00 34.13 30.62 2k33 s GLU 69 CO 0.05 -0.24 0.73 0.42 0.02 0.00 0.00 175.26 176.24 2k33 s ILE 70 N 1.06 4.75 0.35 -1.63 1.09 0.13 -4.96 121.20 121.99 2k33 s ILE 70 Ca 0.58 0.56 -0.02 0.00 -1.10 0.00 0.00 60.65 60.67 2k33 s ILE 70 Cb -0.29 -4.22 -0.04 0.00 -1.06 0.00 0.00 42.46 36.86 2k33 s ILE 70 CO 0.29 -0.52 0.58 -1.59 -0.10 0.00 0.00 174.94 173.60 2k33 s LYS 71 N 3.04 3.53 0.34 2.79 -2.85 -1.26 -0.66 119.74 124.67 2k33 s LYS 71 Ca 0.28 -0.16 -0.26 0.00 -1.00 0.00 0.00 55.97 54.83 2k33 s LYS 71 Cb -0.13 -2.62 -0.09 0.00 -2.06 0.00 0.00 37.83 32.93 2k33 s LYS 71 CO 0.19 0.12 1.02 0.00 0.10 0.00 0.00 175.35 176.77 2k33 s ALA 72 N -2.31 3.20 0.16 0.59 0.00 0.12 -4.88 121.76 118.63 2k33 s ALA 72 Ca 0.42 0.67 -0.09 0.00 0.00 0.00 0.00 51.96 52.96 2k33 s ALA 72 Cb -0.10 -3.25 0.01 0.00 0.00 0.00 0.00 23.12 19.79 2k33 s ALA 72 CO 0.36 -0.05 1.50 -1.00 0.00 0.00 0.00 175.76 176.57 2k33 h PRO 73 N 3.05 0.86 -2.78 0.00 0.13 -1.91 -2.26 132.00 129.09 2k33 h PRO 73 Ca -0.47 -0.45 -0.07 0.00 -0.87 0.00 0.00 66.00 64.14 2k33 h PRO 73 Cb 1.21 0.01 -0.17 0.00 0.13 0.00 0.00 31.00 32.18 2k33 h PRO 73 CO 0.64 1.09 -0.00 -0.59 -0.23 0.00 0.00 178.00 178.92 2k33 s PHE 74 N -4.36 -0.39 1.29 1.56 -0.12 -1.26 -4.67 117.98 110.02 2k33 s PHE 74 Ca -0.10 0.46 -0.21 0.00 -0.05 0.00 0.00 56.93 57.03 2k33 s PHE 74 Cb 0.11 0.30 0.33 0.00 -0.63 0.00 0.00 43.02 43.14 2k33 s PHE 74 CO 0.87 -0.61 0.77 -0.40 -0.05 0.00 0.00 175.22 175.80 2k33 n ASP 75 N 0.53 -3.87 0.00 1.98 5.75 -1.26 -4.56 116.55 115.13 2k33 n ASP 75 Ca -0.19 -0.78 0.00 0.00 -0.01 0.00 0.00 54.79 53.81 2k33 n ASP 75 Cb 0.60 -0.87 0.00 0.00 -1.03 0.00 0.00 41.12 39.81 2k33 n ASP 75 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2k33 n GLY 76 N -5.05 0.36 3.86 6.12 0.00 -0.91 -4.72 105.19 104.85 2k33 n GLY 76 Ca 0.12 -2.20 -0.36 0.00 0.00 0.00 0.00 46.02 43.57 2k33 n GLY 76 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2k33 s THR 77 N 0.00 5.15 -0.00 2.61 2.01 -0.64 -0.28 115.64 124.49 2k33 s THR 77 Ca 0.00 0.54 0.02 0.00 0.31 0.00 0.00 61.69 62.57 2k33 s THR 77 Cb 0.00 -3.63 -0.03 0.00 0.01 0.00 0.00 72.50 68.85 2k33 s THR 77 CO 0.00 0.47 -0.04 -0.51 -0.69 0.00 0.00 174.62 173.85 2k33 s ILE 78 N -1.20 3.85 0.00 1.82 2.07 -1.00 -0.53 121.20 126.21 2k33 s ILE 78 Ca 0.26 -0.69 0.00 0.00 -1.41 0.00 0.00 60.65 58.81 2k33 s ILE 78 Cb -0.15 -2.69 0.00 0.00 0.13 0.00 0.00 42.46 39.75 2k33 s ILE 78 CO 0.14 0.40 0.00 0.61 -1.91 0.00 0.00 174.94 174.18 2k33 n GLY 79 N 1.53 0.30 3.92 1.50 0.00 0.85 -0.11 105.19 113.17 2k33 n GLY 79 Ca -0.15 -1.67 -0.27 0.00 0.00 0.00 0.00 46.02 43.92 2k33 n GLY 79 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 2k33 s ASP 80 N -1.00 6.39 0.77 1.61 1.47 -1.26 -3.96 116.67 120.70 2k33 s ASP 80 Ca 0.00 0.57 -0.12 0.00 1.18 0.00 0.00 52.55 54.18 2k33 s ASP 80 Cb 0.00 -2.08 0.06 0.00 -0.34 0.00 0.00 42.92 40.55 2k33 s ASP 80 CO 0.00 -0.18 1.12 0.00 0.68 0.00 0.00 175.17 176.79 2k33 s ALA 81 N -2.08 2.55 0.00 2.11 0.00 -1.26 -4.33 121.76 118.74 2k33 s ALA 81 Ca 0.41 -0.38 0.00 0.00 0.00 0.00 0.00 51.96 51.99 2k33 s ALA 81 Cb -0.11 -3.04 0.00 0.00 0.00 0.00 0.00 23.12 19.98 2k33 s ALA 81 CO 0.31 -1.53 0.00 1.28 0.00 0.00 0.00 175.76 175.82 2k33 n LEU 82 N -3.27 2.72 -4.89 0.00 4.32 0.14 -4.90 117.00 111.12 2k33 n LEU 82 Ca 0.07 0.00 -0.25 0.00 -0.02 0.00 0.00 56.01 55.81 2k33 n LEU 82 Cb 0.58 0.00 -0.04 0.00 -1.62 0.00 0.00 43.42 42.34 2k33 n LEU 82 CO 0.57 0.45 -0.14 0.68 -1.22 0.00 0.00 177.39 177.74 2k33 s VAL 83 N -1.96 4.99 0.50 4.08 -7.23 -1.26 -5.05 120.40 114.47 2k33 s VAL 83 Ca 0.00 -0.88 0.04 0.00 -1.81 0.00 0.00 61.98 59.33 2k33 s VAL 83 Cb 0.00 -3.58 0.04 0.00 0.56 0.00 0.00 36.38 33.40 2k33 s VAL 83 CO 0.00 -0.13 0.35 0.59 -0.31 0.00 0.00 175.10 175.60 2k33 n ASN 84 N -0.59 2.66 -4.80 4.85 3.02 -1.26 -5.07 115.26 114.08 2k33 n ASN 84 Ca -0.08 -2.76 -0.33 0.00 -0.03 0.00 0.00 54.58 51.38 2k33 n ASN 84 Cb 0.55 -0.01 0.02 0.00 -0.61 0.00 0.00 39.78 39.72 2k33 n ASN 84 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 2k33 s ILE 85 N -2.52 3.73 -0.94 2.41 -1.09 -1.26 -3.29 121.20 118.24 2k33 s ILE 85 Ca 0.27 0.81 0.00 0.00 -2.23 0.00 0.00 60.65 59.49 2k33 s ILE 85 Cb -0.02 -3.34 0.00 0.00 -1.58 0.00 0.00 42.46 37.52 2k33 s ILE 85 CO 0.17 -0.50 0.00 0.61 -1.23 0.00 0.00 174.94 173.99 2k33 n GLY 86 N -0.95 0.92 3.49 6.18 0.00 -0.96 -4.94 105.19 108.92 2k33 n GLY 86 Ca 0.09 -0.10 -0.36 0.00 0.00 0.00 0.00 46.02 45.65 2k33 n GLY 86 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2k33 s ASP 87 N -2.42 5.17 0.38 1.61 1.11 -1.21 -4.89 116.67 116.43 2k33 s ASP 87 Ca 0.00 -0.15 -0.28 0.00 0.18 0.00 0.00 52.55 52.31 2k33 s ASP 87 Cb 0.00 -1.91 -0.10 0.00 1.07 0.00 0.00 42.92 41.98 2k33 s ASP 87 CO 0.00 0.03 1.42 -0.47 1.18 0.00 0.00 175.17 177.33 2k33 s TYR 88 N 1.23 2.68 0.03 4.23 6.14 -1.26 -2.31 117.35 128.08 2k33 s TYR 88 Ca 0.04 1.26 -0.04 0.00 0.64 0.00 0.00 57.07 58.97 2k33 s TYR 88 Cb -0.14 -3.90 -0.01 0.00 0.42 0.00 0.00 41.96 38.32 2k33 s TYR 88 CO 0.03 -2.67 0.07 0.14 0.64 0.00 0.00 175.55 173.76 2k33 s VAL 89 N -1.15 0.12 0.13 3.14 -7.23 0.12 -4.93 120.40 110.60 2k33 s VAL 89 Ca 0.54 -1.01 -0.01 0.00 -1.81 0.00 0.00 61.98 59.68 2k33 s VAL 89 Cb -0.44 -0.70 0.03 0.00 0.56 0.00 0.00 36.38 35.83 2k33 s VAL 89 CO 0.59 -0.56 0.18 -1.20 -0.31 0.00 0.00 175.10 173.80 2k33 n SER 90 N 1.05 0.10 -3.73 4.85 7.64 -1.26 -1.74 113.62 120.53 2k33 n SER 90 Ca -0.21 -1.12 0.00 0.00 1.01 0.00 0.00 58.87 58.56 2k33 n SER 90 Cb 0.57 -0.13 0.00 0.00 -1.01 0.00 0.00 64.21 63.64 2k33 n SER 90 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2k33 n ALA 91 N -3.07 0.00 0.24 -0.43 0.00 -1.25 -4.13 120.51 111.86 2k33 n ALA 91 Ca -0.03 0.00 0.16 0.00 0.00 0.00 0.00 53.44 53.57 2k33 n ALA 91 Cb 0.09 0.00 0.67 0.00 0.00 0.00 0.00 19.45 20.21 2k33 n ALA 91 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2k33 h SER 92 N 0.00 0.00 -0.17 0.00 0.87 -1.80 0.21 113.55 112.67 2k33 h SER 92 Ca 0.00 0.00 0.05 0.00 -1.23 0.00 0.00 61.79 60.61 2k33 h SER 92 Cb 0.00 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 61.95 2k33 h SER 92 CO 0.00 0.00 0.15 0.74 -0.53 0.00 0.00 176.83 177.19 2k33 h THR 93 N 0.00 0.64 -2.89 2.23 2.02 -1.93 -3.39 112.91 109.59 2k33 h THR 93 Ca 0.08 0.00 -0.55 0.00 0.77 0.00 0.00 66.41 66.71 2k33 h THR 93 Cb 1.09 0.88 -0.05 0.00 -1.74 0.00 0.00 68.15 68.33 2k33 h THR 93 CO -0.00 0.00 1.12 0.28 0.37 0.00 0.00 175.52 177.29 2k33 s THR 94 N -4.80 3.77 -0.23 3.16 -1.32 0.74 -4.98 115.64 111.98 2k33 s THR 94 Ca -0.05 0.70 -0.19 0.00 -1.21 0.00 0.00 61.69 60.94 2k33 s THR 94 Cb 0.16 -4.29 -0.03 0.00 -1.51 0.00 0.00 72.50 66.84 2k33 s THR 94 CO 0.61 -0.99 0.56 -1.83 -2.21 0.00 0.00 174.62 170.76 2k33 s GLU 95 N 5.46 4.14 -0.05 7.08 -1.05 -1.26 -4.46 118.70 128.55 2k33 s GLU 95 Ca 0.57 0.45 -0.05 0.00 -0.15 0.00 0.00 54.97 55.80 2k33 s GLU 95 Cb -0.12 -3.61 -0.02 0.00 -0.44 0.00 0.00 34.13 29.94 2k33 s GLU 95 CO 0.27 -0.29 -0.09 1.28 0.95 0.00 0.00 175.26 177.38 2k33 n LEU 96 N 5.30 0.57 -4.15 1.83 7.99 -1.22 -4.55 117.00 122.76 2k33 n LEU 96 Ca -0.03 0.09 -0.12 0.00 -0.01 0.00 0.00 56.01 55.94 2k33 n LEU 96 Cb 0.50 -0.52 -0.11 0.00 -0.11 0.00 0.00 43.42 43.18 2k33 n LEU 96 CO 0.42 -0.45 -0.40 0.54 -1.51 0.00 0.00 177.39 175.99 2k33 s VAL 97 N -1.56 0.74 0.12 4.08 0.11 -1.26 0.28 120.40 122.92 2k33 s VAL 97 Ca -0.08 -1.65 0.10 0.00 -2.93 0.00 0.00 61.98 57.43 2k33 s VAL 97 Cb 0.01 -1.33 -0.04 0.00 -1.53 0.00 0.00 36.38 33.49 2k33 s VAL 97 CO 0.12 -0.66 -0.23 0.00 -3.33 0.00 0.00 175.10 171.00 2k33 s ARG 98 N -2.98 1.58 -0.15 1.54 3.03 -1.26 -0.09 118.95 120.62 2k33 s ARG 98 Ca 0.05 -1.27 -0.04 0.00 2.03 0.00 0.00 55.73 56.50 2k33 s ARG 98 Cb -0.01 -2.00 -0.03 0.00 -1.03 0.00 0.00 34.95 31.88 2k33 s ARG 98 CO -0.02 0.47 -0.01 0.08 -1.13 0.00 0.00 175.30 174.69 2k33 s VAL 99 N -1.09 4.16 0.09 4.99 1.01 0.15 -0.11 120.40 129.60 2k33 s VAL 99 Ca 0.16 -0.27 0.02 0.00 0.00 0.00 0.00 61.98 61.89 2k33 s VAL 99 Cb -0.10 -2.82 -0.04 0.00 0.00 0.00 0.00 36.38 33.42 2k33 s VAL 99 CO 0.08 0.51 -0.07 0.28 0.00 0.00 0.00 175.10 175.90 2k33 s THR 100 N 0.12 0.68 0.08 3.92 -1.32 0.31 -2.51 115.64 116.92 2k33 s THR 100 Ca 0.01 -1.81 0.00 0.00 -1.21 0.00 0.00 61.69 58.67 2k33 s THR 100 Cb -0.13 -1.53 0.00 0.00 -1.51 0.00 0.00 72.50 69.33 2k33 s THR 100 CO 0.02 -0.80 0.00 0.59 -2.21 0.00 0.00 174.62 172.22 2k33 n ASN 101 N 0.17 -7.54 0.12 8.08 5.03 -1.26 -1.62 115.26 118.25 2k33 n ASN 101 Ca -0.14 1.24 0.00 0.00 0.87 0.00 0.00 54.58 56.56 2k33 n ASN 101 Cb 0.60 -4.15 0.00 0.00 -1.02 0.00 0.00 39.78 35.21 2k33 n ASN 101 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2k33 n LEU 102 N 1.41 -0.19 -4.82 3.41 -0.00 -1.26 -1.67 117.00 113.89 2k33 n LEU 102 Ca 0.00 0.41 -0.26 0.00 -0.00 0.00 0.00 56.01 56.16 2k33 n LEU 102 Cb 0.00 0.38 -0.05 0.00 -0.00 0.00 0.00 43.42 43.74 2k33 n LEU 102 CO 0.00 -0.73 -0.20 0.20 -0.00 0.00 0.00 177.39 176.66 2k33 s ASN 103 N -4.97 5.64 -0.79 1.45 -0.87 -1.26 -4.86 114.94 109.29 2k33 s ASN 103 Ca 0.00 -0.08 -0.25 0.00 -1.57 0.00 0.00 52.86 50.96 2k33 s ASN 103 Cb 0.00 -1.51 -0.04 0.00 -0.02 0.00 0.00 41.25 39.68 2k33 s ASN 103 CO 0.00 0.07 1.92 -2.16 -2.57 0.00 0.00 177.10 174.36 2k33 s PRO 104 N -3.08 2.58 0.29 -0.60 0.04 -1.26 -4.97 135.00 128.01 2k33 s PRO 104 Ca 0.31 0.05 -0.11 0.00 0.04 0.00 0.00 61.00 61.30 2k33 s PRO 104 Cb -0.10 -4.81 -0.08 0.00 0.04 0.00 0.00 34.50 29.56 2k33 s PRO 104 CO 0.24 -3.13 0.65 0.42 0.04 0.00 0.00 177.00 175.21 2k33 s ILE 105 N 9.71 4.83 -0.45 0.56 -1.09 -1.26 -5.04 121.20 128.46 2k33 s ILE 105 Ca 0.69 0.63 0.07 0.00 -2.23 0.00 0.00 60.65 59.81 2k33 s ILE 105 Cb -0.09 -3.64 0.28 0.00 -1.58 0.00 0.00 42.46 37.43 2k33 s ILE 105 CO 0.07 -0.20 0.86 0.00 -1.23 0.00 0.00 174.94 174.45 2k33 n TYR 106 N -0.45 -2.25 0.00 3.97 4.11 -1.26 -5.00 117.16 116.27 2k33 n TYR 106 Ca 0.02 -2.44 0.00 0.00 -0.00 0.00 0.00 57.90 55.48 2k33 n TYR 106 Cb 0.53 0.99 0.00 0.00 -0.00 0.00 0.00 39.34 40.86 2k33 n TYR 106 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 2k33 n ALA 107 N 1.10 0.12 -2.87 -3.48 0.00 -1.26 -5.12 120.51 109.00 2k33 n ALA 107 Ca 0.12 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.56 2k33 n ALA 107 Cb 0.63 0.00 0.00 0.00 0.00 0.00 0.00 19.45 20.08 2k33 n ALA 107 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2k33 n ASP 108 N -2.14 -7.58 -2.92 0.00 2.03 -1.26 -5.01 116.55 99.67 2k33 n ASP 108 Ca 0.00 1.10 -0.14 0.00 0.52 0.00 0.00 54.79 56.28 2k33 n ASP 108 Cb 0.00 -4.14 0.01 0.00 -0.72 0.00 0.00 41.12 36.27 2k33 n ASP 108 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2k33 n GLY 109 N 0.89 1.29 0.07 0.27 0.00 -1.26 -4.99 105.19 101.45 2k33 n GLY 109 Ca 0.00 -0.56 -0.08 0.00 0.00 0.00 0.00 46.02 45.38 2k33 n GLY 109 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 2k33 h SER 110 N 3.78 0.00 0.00 1.61 0.02 -2.09 -3.47 113.55 113.40 2k33 h SER 110 Ca -0.05 -0.31 0.00 0.00 -0.84 0.00 0.00 61.79 60.59 2k33 h SER 110 Cb 0.99 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.53 2k33 h SER 110 CO 0.36 0.84 0.00 1.41 -1.14 0.00 0.00 176.83 178.30 2k33 n HIS 111 N -4.64 0.00 -1.21 3.45 8.25 -1.26 -4.93 115.22 114.87 2k33 n HIS 111 Ca -0.09 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.37 2k33 n HIS 111 Cb 0.29 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.40 2k33 n HIS 111 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 2k33 n HIS 112 N 0.00 -0.76 -2.19 4.41 1.44 -1.26 -3.64 115.22 113.21 2k33 n HIS 112 Ca 0.00 0.00 -0.31 0.00 -2.01 0.00 0.00 57.72 55.40 2k33 n HIS 112 Cb 0.00 0.06 -0.04 0.00 0.12 0.00 0.00 29.99 30.13 2k33 n HIS 112 CO 0.00 0.00 0.00 -1.01 -2.81 0.00 0.00 176.34 172.52 2k33 s HIS 113 N 0.00 2.05 0.14 -1.40 3.76 -1.26 -4.73 115.29 113.85 2k33 s HIS 113 Ca 0.00 0.14 0.08 0.00 -0.15 0.00 0.00 55.06 55.13 2k33 s HIS 113 Cb 0.00 -4.22 -0.12 0.00 1.11 0.00 0.00 32.58 29.35 2k33 s HIS 113 CO 0.00 -1.69 1.33 1.25 -0.85 0.00 0.00 174.74 174.78 2k33 h HIS 114 N 10.44 0.00 -3.34 1.40 2.76 -2.00 -3.47 115.15 120.94 2k33 h HIS 114 Ca 0.16 0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.32 2k33 h HIS 114 Cb 0.98 0.00 -0.09 0.00 1.55 0.00 0.00 27.41 29.86 2k33 h HIS 114 CO 1.24 0.94 0.03 -1.58 -1.30 0.00 0.00 177.93 177.26 2k33 s HIS 115 N -2.85 -0.00 -1.89 5.26 2.46 -1.26 -5.24 115.29 111.77 2k33 s HIS 115 Ca 0.01 -0.37 0.15 0.00 0.47 0.00 0.00 55.06 55.32 2k33 s HIS 115 Cb 0.10 0.40 0.12 0.00 -0.13 0.00 0.00 32.58 33.07 2k33 s HIS 115 CO 0.81 -1.00 0.98 1.58 -2.47 0.00 0.00 174.74 174.64