#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 0.82 -0.09 5.18 1.01 -1.05 -5.02 120.40 121.25 2k33 s VAL 2 Ca 0.00 -0.89 -0.05 0.00 0.00 0.00 0.00 61.98 61.03 2k33 s VAL 2 Cb 0.00 -0.78 -0.04 0.00 0.00 0.00 0.00 36.38 35.57 2k33 s VAL 2 CO 0.00 -0.10 0.13 -0.63 0.00 0.00 0.00 175.10 174.50 2k33 s ILE 3 N -0.89 5.33 -0.32 2.22 -1.09 -1.26 0.56 121.20 125.75 2k33 s ILE 3 Ca -0.02 0.07 -0.15 0.00 -2.23 0.00 0.00 60.65 58.32 2k33 s ILE 3 Cb -0.07 -3.35 -0.02 0.00 -1.58 0.00 0.00 42.46 37.43 2k33 s ILE 3 CO 0.01 0.55 0.34 -0.63 -1.23 0.00 0.00 174.94 173.99 2k33 s ILE 4 N -1.07 5.19 0.09 2.92 1.01 0.98 -4.89 121.20 125.42 2k33 s ILE 4 Ca 0.17 0.18 0.03 0.00 0.00 0.00 0.00 60.65 61.03 2k33 s ILE 4 Cb -0.12 -3.76 -0.03 0.00 0.01 0.00 0.00 42.46 38.56 2k33 s ILE 4 CO 0.07 0.00 -0.10 -0.54 0.00 0.00 0.00 174.94 174.38 2k33 s LYS 5 N 2.00 0.80 0.00 2.79 1.02 -1.26 -3.70 119.74 121.39 2k33 s LYS 5 Ca 0.12 -1.12 0.00 0.00 0.02 0.00 0.00 55.97 54.99 2k33 s LYS 5 Cb -0.16 -0.48 0.00 0.00 -0.52 0.00 0.00 37.83 36.66 2k33 s LYS 5 CO 0.11 0.07 0.00 -0.35 -0.92 0.00 0.00 175.35 174.26 2k33 n PRO 6 N 0.64 -0.80 0.00 -1.68 -0.04 -1.26 -4.95 135.00 126.91 2k33 n PRO 6 Ca -0.17 0.00 0.01 0.00 -0.04 0.00 0.00 63.50 63.30 2k33 n PRO 6 Cb 0.57 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.04 2k33 n PRO 6 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2k33 n GLN 7 N -1.35 1.22 -3.89 0.54 10.64 -1.26 -4.08 117.38 119.20 2k33 n GLN 7 Ca 0.00 -0.47 -0.14 0.00 -1.83 0.00 0.00 57.00 54.55 2k33 n GLN 7 Cb 0.00 -0.93 -0.03 0.00 -0.86 0.00 0.00 30.24 28.42 2k33 n GLN 7 CO 0.00 0.00 0.00 1.33 -1.83 0.00 0.00 177.06 176.56 2k33 n VAL 8 N -0.18 0.00 -4.81 -0.39 0.24 -1.26 -4.79 118.33 107.13 2k33 n VAL 8 Ca 0.01 -1.74 -0.33 0.00 -2.04 0.00 0.00 64.34 60.24 2k33 n VAL 8 Cb 0.06 1.05 -0.14 0.00 -1.47 0.00 0.00 33.84 33.34 2k33 n VAL 8 CO 0.00 0.00 0.00 -0.94 -2.14 0.00 0.00 176.83 173.75 2k33 s SER 9 N -3.08 3.96 0.00 -1.34 1.04 -1.26 -3.97 113.70 109.05 2k33 s SER 9 Ca 0.28 -0.33 0.00 0.00 0.48 0.00 0.00 55.95 56.38 2k33 s SER 9 Cb -0.01 -1.56 0.00 0.00 0.10 0.00 0.00 66.02 64.56 2k33 s SER 9 CO 0.20 0.18 0.00 0.61 0.98 0.00 0.00 173.24 175.21 2k33 n GLY 10 N 3.45 1.60 2.90 7.32 0.00 -0.74 -4.65 105.19 115.07 2k33 n GLY 10 Ca -0.18 0.26 -0.13 0.00 0.00 0.00 0.00 46.02 45.97 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 1.82 -0.03 0.22 1.61 1.01 -0.76 -0.78 120.40 123.48 2k33 s VAL 11 Ca 0.00 0.11 -0.32 0.00 0.00 0.00 0.00 61.98 61.78 2k33 s VAL 11 Cb 0.00 -0.15 -0.14 0.00 0.00 0.00 0.00 36.38 36.09 2k33 s VAL 11 CO 0.00 0.05 1.38 -0.38 0.00 0.00 0.00 175.10 176.15 2k33 n ILE 12 N 3.71 0.83 -0.08 2.22 2.08 -0.99 -0.74 119.36 126.39 2k33 n ILE 12 Ca -0.21 -0.21 -0.09 0.00 0.56 0.00 0.00 62.75 62.80 2k33 n ILE 12 Cb 0.55 -1.35 -0.10 0.00 -0.75 0.00 0.00 39.64 37.98 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 1.99 0.99 -3.81 1.39 0.31 0.11 -2.28 118.33 117.03 2k33 n VAL 13 Ca 0.13 -0.52 0.02 0.00 -0.01 0.00 0.00 64.34 63.96 2k33 n VAL 13 Cb 0.30 -0.82 0.01 0.00 -0.91 0.00 0.00 33.84 32.42 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 -5.10 -0.02 -0.33 4.52 2.47 -1.25 -4.85 114.94 110.38 2k33 s ASN 14 Ca -0.13 -0.19 -0.01 0.00 0.42 0.00 0.00 52.86 52.95 2k33 s ASN 14 Cb 0.05 0.16 0.11 0.00 -1.45 0.00 0.00 41.25 40.12 2k33 s ASN 14 CO 0.52 -0.32 0.15 -0.54 -3.72 0.00 0.00 177.10 173.19 2k33 s LYS 15 N -2.20 0.64 -0.33 0.43 1.02 -1.26 -2.15 119.74 115.88 2k33 s LYS 15 Ca 0.22 -1.12 -0.04 0.00 0.02 0.00 0.00 55.97 55.04 2k33 s LYS 15 Cb 0.02 -1.72 -0.03 0.00 -0.52 0.00 0.00 37.83 35.59 2k33 s LYS 15 CO -0.02 -1.06 3.00 1.28 -0.92 0.00 0.00 175.35 177.63 2k33 n LEU 16 N 4.61 6.14 -4.09 3.17 4.77 0.11 -4.87 117.00 126.85 2k33 n LEU 16 Ca 0.01 -3.83 -0.11 0.00 -0.03 0.00 0.00 56.01 52.06 2k33 n LEU 16 Cb 0.40 -1.28 -0.07 0.00 -2.33 0.00 0.00 43.42 40.13 2k33 n LEU 16 CO 0.12 1.72 -0.01 0.72 -1.33 0.00 0.00 177.39 178.62 2k33 s PHE 17 N -0.99 0.73 0.15 -1.77 -0.71 -1.20 -4.16 117.98 110.03 2k33 s PHE 17 Ca 0.61 -1.03 0.06 0.00 -1.04 0.00 0.00 56.93 55.54 2k33 s PHE 17 Cb 0.37 -0.15 -0.04 0.00 -1.21 0.00 0.00 43.02 41.99 2k33 s PHE 17 CO -0.16 -0.84 -0.14 0.15 -1.34 0.00 0.00 175.22 172.88 2k33 s LYS 18 N -4.05 1.12 -0.49 1.99 3.01 -1.26 -5.11 119.74 114.94 2k33 s LYS 18 Ca 0.30 -1.36 -0.24 0.00 -1.01 0.00 0.00 55.97 53.66 2k33 s LYS 18 Cb 0.03 -0.95 0.03 0.00 -1.01 0.00 0.00 37.83 35.93 2k33 s LYS 18 CO 0.11 0.17 0.87 0.00 0.51 0.00 0.00 175.35 177.01 2k33 s ALA 19 N -2.47 3.23 0.00 5.17 0.00 -1.26 -3.57 121.76 122.86 2k33 s ALA 19 Ca 0.13 -1.08 0.00 0.00 0.00 0.00 0.00 51.96 51.01 2k33 s ALA 19 Cb -0.03 -3.61 0.00 0.00 0.00 0.00 0.00 23.12 19.48 2k33 s ALA 19 CO 0.04 -2.14 0.00 0.41 0.00 0.00 0.00 175.76 174.07 2k33 n GLY 20 N 5.04 1.12 3.22 0.00 0.00 -0.72 -4.93 105.19 108.91 2k33 n GLY 20 Ca 0.02 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.86 2k33 n GLY 20 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2k33 n ASP 21 N 0.00 2.03 -4.73 1.61 9.92 -1.23 -4.82 116.55 119.33 2k33 n ASP 21 Ca 0.00 -2.40 -0.27 0.00 -0.53 0.00 0.00 54.79 51.59 2k33 n ASP 21 Cb 0.00 -0.23 -0.07 0.00 -0.64 0.00 0.00 41.12 40.18 2k33 n ASP 21 CO 0.00 0.00 0.00 -0.54 0.13 0.00 0.00 177.20 176.79 2k33 s LYS 22 N -4.07 2.65 0.54 -1.24 1.02 -1.26 -0.07 119.74 117.31 2k33 s LYS 22 Ca 0.41 -0.94 0.01 0.00 0.02 0.00 0.00 55.97 55.47 2k33 s LYS 22 Cb -0.03 -2.52 0.01 0.00 -0.52 0.00 0.00 37.83 34.77 2k33 s LYS 22 CO 0.26 0.49 0.11 0.14 -0.92 0.00 0.00 175.35 175.43 2k33 s VAL 23 N -1.64 1.15 0.28 3.17 -7.23 0.13 -4.91 120.40 111.35 2k33 s VAL 23 Ca 0.29 -1.87 0.02 0.00 -1.81 0.00 0.00 61.98 58.60 2k33 s VAL 23 Cb -0.10 -2.02 -0.05 0.00 0.56 0.00 0.00 36.38 34.77 2k33 s VAL 23 CO 0.21 0.00 0.12 -0.54 -0.31 0.00 0.00 175.10 174.57 2k33 s LYS 24 N -4.01 1.48 -0.87 4.82 1.02 -1.26 -2.39 119.74 118.54 2k33 s LYS 24 Ca 0.09 -1.82 -0.25 0.00 0.02 0.00 0.00 55.97 54.01 2k33 s LYS 24 Cb -0.00 -0.21 -0.00 0.00 -0.52 0.00 0.00 37.83 37.10 2k33 s LYS 24 CO 0.05 -0.36 1.68 0.15 -0.92 0.00 0.00 175.35 175.96 2k33 s LYS 25 N -3.95 2.99 0.00 1.68 1.02 -1.26 -2.54 119.74 117.67 2k33 s LYS 25 Ca 0.37 -0.39 0.00 0.00 0.02 0.00 0.00 55.97 55.97 2k33 s LYS 25 Cb 0.07 -4.91 0.00 0.00 -0.52 0.00 0.00 37.83 32.47 2k33 s LYS 25 CO 0.15 -2.72 0.00 0.41 -0.92 0.00 0.00 175.35 172.27 2k33 n GLY 26 N 6.45 1.12 3.70 -3.33 0.00 -0.91 -4.98 105.19 107.24 2k33 n GLY 26 Ca 0.29 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.90 2k33 n GLY 26 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2k33 s GLN 27 N -0.43 4.45 0.34 1.61 0.74 -1.05 -4.70 119.66 120.61 2k33 s GLN 27 Ca 0.00 1.09 -0.29 0.00 0.05 0.00 0.00 55.36 56.22 2k33 s GLN 27 Cb 0.00 -3.48 -0.11 0.00 1.10 0.00 0.00 33.01 30.52 2k33 s GLN 27 CO 0.00 -0.06 1.46 0.99 -0.55 0.00 0.00 175.29 177.13 2k33 s THR 28 N 1.16 2.26 0.00 -0.34 2.01 -1.26 -1.08 115.64 118.39 2k33 s THR 28 Ca 0.43 0.25 0.00 0.00 0.31 0.00 0.00 61.69 62.68 2k33 s THR 28 Cb -0.19 -3.16 0.00 0.00 0.01 0.00 0.00 72.50 69.16 2k33 s THR 28 CO 0.20 0.06 0.00 0.18 -0.69 0.00 0.00 174.62 174.37 2k33 n LEU 29 N 0.94 0.48 -4.24 4.42 4.77 -0.09 -4.62 117.00 118.67 2k33 n LEU 29 Ca 0.02 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.87 2k33 n LEU 29 Cb 0.40 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.38 2k33 n LEU 29 CO 0.62 0.08 -0.29 -0.36 -1.33 0.00 0.00 177.39 176.12 2k33 s PHE 30 N -1.18 1.23 -0.04 -1.77 0.40 -1.06 0.10 117.98 115.66 2k33 s PHE 30 Ca 0.00 -1.16 -0.05 0.00 -0.60 0.00 0.00 56.93 55.12 2k33 s PHE 30 Cb 0.00 -0.69 0.01 0.00 0.51 0.00 0.00 43.02 42.85 2k33 s PHE 30 CO 0.00 -0.37 0.12 0.42 0.70 0.00 0.00 175.22 176.09 2k33 s ILE 31 N -3.84 0.02 -0.01 0.64 1.09 -0.91 0.57 121.20 118.75 2k33 s ILE 31 Ca 0.30 -0.16 -0.00 0.00 -1.10 0.00 0.00 60.65 59.69 2k33 s ILE 31 Cb 0.07 -0.23 0.02 0.00 -1.06 0.00 0.00 42.46 41.26 2k33 s ILE 31 CO 0.07 -0.09 0.02 -0.63 -0.10 0.00 0.00 174.94 174.22 2k33 s ILE 32 N -0.25 -0.03 -0.22 2.92 1.01 -1.07 0.08 121.20 123.64 2k33 s ILE 32 Ca -0.03 0.11 -0.10 0.00 0.00 0.00 0.00 60.65 60.62 2k33 s ILE 32 Cb -0.02 -0.06 -0.05 0.00 0.01 0.00 0.00 42.46 42.34 2k33 s ILE 32 CO 0.00 0.04 0.14 -0.70 0.00 0.00 0.00 174.94 174.43 2k33 s GLU 33 N 0.53 4.13 0.00 2.79 -6.30 0.08 -0.18 118.70 119.76 2k33 s GLU 33 Ca -0.04 -0.25 0.00 0.00 -2.50 0.00 0.00 54.97 52.18 2k33 s GLU 33 Cb -0.06 -3.47 0.00 0.00 0.00 0.00 0.00 34.13 30.60 2k33 s GLU 33 CO -0.02 0.19 0.00 0.00 0.02 0.00 0.00 175.26 175.45 2k33 n GLN 34 N 3.87 0.00 -3.69 4.30 0.00 0.10 -1.83 117.38 120.13 2k33 n GLN 34 Ca -0.16 0.00 -0.29 0.00 0.00 0.00 0.00 57.00 56.56 2k33 n GLN 34 Cb 0.52 0.00 -0.16 0.00 0.00 0.00 0.00 30.24 30.60 2k33 n GLN 34 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.06 177.40 2k33 s ASP 35 N -0.30 3.44 0.00 2.61 2.15 -1.26 -3.26 116.67 120.05 2k33 s ASP 35 Ca 0.00 -1.22 0.00 0.00 0.43 0.00 0.00 52.55 51.76 2k33 s ASP 35 Cb 0.00 -0.63 0.00 0.00 -0.30 0.00 0.00 42.92 41.99 2k33 s ASP 35 CO 0.00 -0.38 0.61 0.00 -0.17 0.00 0.00 175.17 175.23 2k33 n GLN 36 N 5.03 0.00 0.27 4.34 10.64 -1.26 -4.97 117.38 131.43 2k33 n GLN 36 Ca -0.06 -0.33 -0.11 0.00 -1.83 0.00 0.00 57.00 54.67 2k33 n GLN 36 Cb 0.44 -0.18 -0.05 0.00 -0.86 0.00 0.00 30.24 29.59 2k33 n GLN 36 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 2k33 h ALA 37 N 0.00 -0.78 0.00 2.61 0.00 -1.96 -3.49 119.26 115.63 2k33 h ALA 37 Ca 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.75 2k33 h ALA 37 Cb 1.12 0.29 0.00 0.00 0.00 0.00 0.00 17.79 19.20 2k33 h ALA 37 CO 0.00 -0.73 0.00 0.45 0.00 0.00 0.00 179.25 178.97 2k33 n SER 38 N -5.11 0.00 -1.02 0.00 2.88 -1.26 -4.97 113.62 104.14 2k33 n SER 38 Ca -0.09 0.00 0.12 0.00 -1.33 0.00 0.00 58.87 57.57 2k33 n SER 38 Cb 0.29 0.00 0.19 0.00 -0.75 0.00 0.00 64.21 63.95 2k33 n SER 38 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2k33 n LYS 39 N -0.02 2.37 -1.03 -1.46 4.01 -1.26 -4.27 118.16 116.50 2k33 n LYS 39 Ca 0.00 -2.03 -0.00 0.00 -0.51 0.00 0.00 58.31 55.77 2k33 n LYS 39 Cb 0.00 -1.49 -0.01 0.00 -0.51 0.00 0.00 35.03 33.02 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 1.32 0.15 0.00 4.39 5.75 -1.26 -4.98 116.55 121.92 2k33 n ASP 40 Ca 0.17 -1.87 0.00 0.00 -0.01 0.00 0.00 54.79 53.08 2k33 n ASP 40 Cb 0.58 -0.09 0.00 0.00 -1.03 0.00 0.00 41.12 40.58 2k33 n ASP 40 CO 0.00 0.00 0.00 0.49 -0.11 0.00 0.00 177.20 177.58 2k33 n PHE 41 N 0.20 0.00 -1.92 2.11 3.01 -1.26 -4.99 117.46 114.62 2k33 n PHE 41 Ca -0.05 0.00 -0.41 0.00 1.01 0.00 0.00 57.45 58.01 2k33 n PHE 41 Cb 0.85 -0.00 -0.01 0.00 -0.01 0.00 0.00 39.48 40.32 2k33 n PHE 41 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 2k33 s ASN 42 N -2.33 6.42 0.00 4.37 4.22 -1.26 -4.92 114.94 121.45 2k33 s ASN 42 Ca 0.00 2.90 0.24 0.00 -2.14 0.00 0.00 52.86 53.86 2k33 s ASN 42 Cb 0.00 -2.66 0.23 0.00 1.28 0.00 0.00 41.25 40.10 2k33 s ASN 42 CO 0.00 -0.80 1.27 -1.14 -2.04 0.00 0.00 177.10 174.39 2k33 n ARG 43 N 0.47 2.02 -1.36 3.55 0.00 -1.26 -5.06 116.66 115.02 2k33 n ARG 43 Ca 0.01 -1.64 0.17 0.00 -0.00 0.00 0.00 57.85 56.39 2k33 n ARG 43 Cb 0.41 -1.47 -0.09 0.00 0.00 0.00 0.00 32.46 31.31 2k33 n ARG 43 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.63 178.08 2k33 n SER 44 N 0.94 -7.49 -0.68 6.15 2.88 -1.26 -4.61 113.62 109.55 2k33 n SER 44 Ca 0.13 1.31 0.13 0.00 -1.33 0.00 0.00 58.87 59.11 2k33 n SER 44 Cb 0.55 -4.63 0.27 0.00 -0.75 0.00 0.00 64.21 59.65 2k33 n SER 44 CO 0.00 0.00 0.00 0.29 -1.23 0.00 0.00 175.04 174.10 2k33 n LYS 45 N -4.20 1.85 -1.56 -1.46 4.01 -1.26 -5.02 118.16 110.52 2k33 n LYS 45 Ca -0.08 -1.36 -0.00 0.00 -0.51 0.00 0.00 58.31 56.35 2k33 n LYS 45 Cb 0.64 -1.47 -0.00 0.00 -0.51 0.00 0.00 35.03 33.69 2k33 n LYS 45 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2k33 n ALA 46 N 0.61 -3.04 -3.83 7.82 0.00 -1.26 -5.07 120.51 115.74 2k33 n ALA 46 Ca 0.15 0.11 -0.29 0.00 0.00 0.00 0.00 53.44 53.42 2k33 n ALA 46 Cb 0.48 -0.22 -0.17 0.00 0.00 0.00 0.00 19.45 19.54 2k33 n ALA 46 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2k33 s LEU 47 N -0.05 1.63 -0.35 0.00 1.43 -1.26 -4.98 118.68 115.09 2k33 s LEU 47 Ca -0.01 -0.43 0.12 0.00 -1.03 0.00 0.00 54.13 52.78 2k33 s LEU 47 Cb 0.00 -1.08 0.41 0.00 0.03 0.00 0.00 46.19 45.55 2k33 s LEU 47 CO 0.04 -0.03 1.50 2.22 0.23 0.00 0.00 176.35 180.31 2k33 n PHE 48 N 4.52 -2.15 -1.06 0.29 -1.74 -1.26 -4.37 117.46 111.69 2k33 n PHE 48 Ca -0.17 -1.77 -0.27 0.00 -0.56 0.00 0.00 57.45 54.67 2k33 n PHE 48 Cb 0.51 1.57 -0.06 0.00 1.52 0.00 0.00 39.48 43.01 2k33 n PHE 48 CO 0.00 0.00 0.00 0.45 -0.56 0.00 0.00 176.76 176.65 2k33 n SER 49 N -1.33 6.73 0.00 5.98 2.88 -1.26 -4.61 113.62 122.01 2k33 n SER 49 Ca -0.14 -2.45 0.00 0.00 -1.33 0.00 0.00 58.87 54.94 2k33 n SER 49 Cb 0.87 -1.36 0.00 0.00 -0.75 0.00 0.00 64.21 62.97 2k33 n SER 49 CO 0.00 0.00 0.00 1.67 -1.23 0.00 0.00 175.04 175.48 2k33 n GLN 50 N 3.43 0.00 -0.08 -1.46 -0.06 -1.26 -3.91 117.38 114.03 2k33 n GLN 50 Ca 0.59 0.00 -0.14 0.00 -2.00 0.00 0.00 57.00 55.45 2k33 n GLN 50 Cb 0.37 0.00 -0.03 0.00 -4.06 0.00 0.00 30.24 26.52 2k33 n GLN 50 CO 0.00 0.00 0.00 1.03 -0.20 0.00 0.00 177.06 177.89 2k33 h SER 51 N 0.00 0.96 -0.98 1.69 0.87 -2.00 -3.13 113.55 110.97 2k33 h SER 51 Ca 0.00 -0.50 0.15 0.00 -1.23 0.00 0.00 61.79 60.22 2k33 h SER 51 Cb 0.00 -0.27 -0.10 0.00 -0.44 0.00 0.00 62.40 61.59 2k33 h SER 51 CO 0.00 1.29 0.59 0.00 -0.53 0.00 0.00 176.83 178.19 2k33 h ALA 52 N 0.73 1.54 -0.17 6.23 0.00 -1.86 -3.46 119.26 122.26 2k33 h ALA 52 Ca 0.03 0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2k33 h ALA 52 Cb 1.11 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.77 2k33 h ALA 52 CO 0.11 0.06 0.00 0.44 0.00 0.00 0.00 179.25 179.87 2k33 n ILE 53 N -4.72 0.00 -2.90 0.00 -5.35 -1.18 -4.81 119.36 100.40 2k33 n ILE 53 Ca 0.20 0.00 -0.07 0.00 -0.27 0.00 0.00 62.75 62.61 2k33 n ILE 53 Cb 0.46 0.00 0.03 0.00 -1.74 0.00 0.00 39.64 38.38 2k33 n ILE 53 CO 0.00 0.00 0.00 -1.20 -1.76 0.00 0.00 176.55 173.59 2k33 n SER 54 N -3.88 0.69 0.00 7.28 7.64 -1.26 -4.50 113.62 119.59 2k33 n SER 54 Ca 0.00 -1.51 0.10 0.00 1.01 0.00 0.00 58.87 58.47 2k33 n SER 54 Cb 0.00 -0.16 0.49 0.00 -1.01 0.00 0.00 64.21 63.53 2k33 n SER 54 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2k33 n GLN 55 N -1.48 0.15 0.00 1.43 0.00 -1.26 -4.04 117.38 112.18 2k33 n GLN 55 Ca 0.06 0.11 0.00 0.00 0.00 0.00 0.00 57.00 57.17 2k33 n GLN 55 Cb 0.21 -1.50 0.00 0.00 0.00 0.00 0.00 30.24 28.95 2k33 n GLN 55 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.06 177.42 2k33 n LYS 56 N -1.39 0.00 -3.79 2.61 2.85 -1.26 -3.98 118.16 113.20 2k33 n LYS 56 Ca 0.08 0.84 -0.35 0.00 -1.05 0.00 0.00 58.31 57.82 2k33 n LYS 56 Cb 0.21 -1.46 -0.11 0.00 -0.65 0.00 0.00 35.03 33.01 2k33 n LYS 56 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 177.40 176.14 2k33 s GLU 57 N -2.84 2.15 -0.00 -1.58 2.02 -1.26 -5.03 118.70 112.17 2k33 s GLU 57 Ca 0.00 -2.14 -0.04 0.00 0.02 0.00 0.00 54.97 52.81 2k33 s GLU 57 Cb 0.00 -3.58 0.01 0.00 0.10 0.00 0.00 34.13 30.66 2k33 s GLU 57 CO 0.00 -1.10 0.20 0.66 0.02 0.00 0.00 175.26 175.04 2k33 n TYR 58 N 4.06 -0.24 -4.14 1.61 4.01 -1.26 -4.92 117.16 116.28 2k33 n TYR 58 Ca 0.02 -0.12 -0.26 0.00 -0.16 0.00 0.00 57.90 57.38 2k33 n TYR 58 Cb 0.39 0.06 -0.02 0.00 -0.31 0.00 0.00 39.34 39.46 2k33 n TYR 58 CO 0.00 0.00 0.00 -0.25 -0.46 0.00 0.00 176.86 176.15 2k33 n ASP 59 N -0.34 2.85 0.04 7.72 8.00 -1.26 -5.05 116.55 128.51 2k33 n ASP 59 Ca 0.01 -2.85 0.11 0.00 0.71 0.00 0.00 54.79 52.77 2k33 n ASP 59 Cb 0.09 0.09 -0.08 0.00 -0.02 0.00 0.00 41.12 41.19 2k33 n ASP 59 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 2k33 n SER 60 N -1.66 0.42 -0.06 -2.24 7.64 -1.26 -4.18 113.62 112.29 2k33 n SER 60 Ca -0.08 0.11 0.21 0.00 1.01 0.00 0.00 58.87 60.12 2k33 n SER 60 Cb 0.58 1.23 0.66 0.00 -1.01 0.00 0.00 64.21 65.67 2k33 n SER 60 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 2k33 h SER 61 N 0.00 0.08 1.29 6.43 4.64 -1.96 0.26 113.55 124.29 2k33 h SER 61 Ca 0.00 0.01 -0.12 0.00 -0.47 0.00 0.00 61.79 61.21 2k33 h SER 61 Cb 0.97 -0.01 -0.02 0.00 -0.31 0.00 0.00 62.40 63.03 2k33 h SER 61 CO 0.00 0.04 -0.74 0.17 -0.87 0.00 0.00 176.83 175.43 2k33 h LEU 62 N 0.09 0.00 -9.64 5.97 8.10 -1.99 -3.46 115.31 114.37 2k33 h LEU 62 Ca 0.31 0.00 -0.53 0.00 0.11 0.00 0.00 57.88 57.77 2k33 h LEU 62 Cb 1.09 0.00 0.03 0.00 -0.44 0.00 0.00 40.66 41.34 2k33 h LEU 62 CO -0.03 0.50 0.67 0.00 -4.11 0.00 0.00 178.44 175.47 2k33 s ALA 63 N -2.96 3.54 0.22 0.17 0.00 0.92 -4.81 121.76 118.84 2k33 s ALA 63 Ca 0.02 1.11 0.00 0.00 0.00 0.00 0.00 51.96 53.09 2k33 s ALA 63 Cb 0.08 -3.50 0.00 0.00 0.00 0.00 0.00 23.12 19.70 2k33 s ALA 63 CO 0.76 -0.56 0.00 0.25 0.00 0.00 0.00 175.76 176.22 2k33 n THR 64 N 2.96 0.00 -2.18 0.00 -2.24 -1.26 -4.55 114.28 107.00 2k33 n THR 64 Ca 0.07 0.00 0.01 0.00 -2.27 0.00 0.00 64.05 61.86 2k33 n THR 64 Cb 0.43 -0.32 -0.00 0.00 -2.10 0.00 0.00 70.33 68.33 2k33 n THR 64 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 2k33 n LEU 65 N 0.00 0.24 -4.72 3.22 4.32 -1.26 -4.93 117.00 113.86 2k33 n LEU 65 Ca 0.01 -1.50 -0.42 0.00 -0.02 0.00 0.00 56.01 54.08 2k33 n LEU 65 Cb 0.43 0.00 -0.03 0.00 -1.62 0.00 0.00 43.42 42.20 2k33 n LEU 65 CO 0.01 0.61 0.97 -1.81 -1.22 0.00 0.00 177.39 175.94 2k33 s ASP 66 N -1.24 6.96 0.52 -1.43 1.11 -1.20 -4.78 116.67 116.61 2k33 s ASP 66 Ca 0.13 2.23 0.02 0.00 0.18 0.00 0.00 52.55 55.10 2k33 s ASP 66 Cb 0.14 -2.59 -0.00 0.00 1.07 0.00 0.00 42.92 41.54 2k33 s ASP 66 CO -0.06 -0.53 0.06 -1.38 1.18 0.00 0.00 175.17 174.44 2k33 s HIS 67 N 0.72 1.80 -0.03 4.23 -3.43 -1.26 0.03 115.29 117.35 2k33 s HIS 67 Ca 0.59 -0.95 0.02 0.00 -0.80 0.00 0.00 55.06 53.92 2k33 s HIS 67 Cb -0.34 -1.65 0.01 0.00 -1.43 0.00 0.00 32.58 29.17 2k33 s HIS 67 CO 0.32 0.11 -0.05 0.99 -2.00 0.00 0.00 174.74 174.11 2k33 s THR 68 N -2.87 0.53 -0.52 -5.38 2.01 0.75 -4.91 115.64 105.26 2k33 s THR 68 Ca 0.09 -0.19 -0.28 0.00 0.31 0.00 0.00 61.69 61.61 2k33 s THR 68 Cb 0.01 -0.51 0.03 0.00 0.01 0.00 0.00 72.50 72.03 2k33 s THR 68 CO 0.05 0.19 1.15 -1.61 -0.69 0.00 0.00 174.62 173.71 2k33 s GLU 69 N 0.48 3.63 -0.71 4.92 2.02 -1.26 -2.59 118.70 125.19 2k33 s GLU 69 Ca -0.06 0.42 -0.26 0.00 0.02 0.00 0.00 54.97 55.09 2k33 s GLU 69 Cb -0.10 -3.95 -0.01 0.00 0.10 0.00 0.00 34.13 30.17 2k33 s GLU 69 CO 0.00 -1.49 1.72 0.42 0.02 0.00 0.00 175.26 175.93 2k33 s ILE 70 N 4.60 3.49 0.20 -1.63 1.09 0.19 -4.94 121.20 124.20 2k33 s ILE 70 Ca 0.45 0.09 -0.09 0.00 -1.10 0.00 0.00 60.65 60.01 2k33 s ILE 70 Cb -0.07 -4.24 -0.07 0.00 -1.06 0.00 0.00 42.46 37.02 2k33 s ILE 70 CO 0.29 -1.20 0.50 -1.59 -0.10 0.00 0.00 174.94 172.85 2k33 s LYS 71 N 6.61 3.76 0.50 2.79 -2.85 -1.26 -0.91 119.74 128.37 2k33 s LYS 71 Ca 0.59 0.18 -0.22 0.00 -1.00 0.00 0.00 55.97 55.53 2k33 s LYS 71 Cb -0.10 -2.72 -0.07 0.00 -2.06 0.00 0.00 37.83 32.89 2k33 s LYS 71 CO 0.14 0.37 1.17 0.00 0.10 0.00 0.00 175.35 177.13 2k33 s ALA 72 N -1.75 2.85 0.23 0.59 0.00 -0.24 -4.85 121.76 118.59 2k33 s ALA 72 Ca 0.45 0.93 -0.00 0.00 0.00 0.00 0.00 51.96 53.34 2k33 s ALA 72 Cb -0.12 -3.39 0.24 0.00 0.00 0.00 0.00 23.12 19.85 2k33 s ALA 72 CO 0.22 -0.77 1.59 -1.00 0.00 0.00 0.00 175.76 175.81 2k33 h PRO 73 N 1.68 0.49 -1.75 0.00 0.13 -1.93 -2.42 132.00 128.21 2k33 h PRO 73 Ca -0.50 -0.26 0.02 0.00 -0.87 0.00 0.00 66.00 64.39 2k33 h PRO 73 Cb 1.26 0.01 -0.23 0.00 0.13 0.00 0.00 31.00 32.17 2k33 h PRO 73 CO 0.59 0.84 0.37 -0.59 -0.23 0.00 0.00 178.00 178.97 2k33 s PHE 74 N -4.16 -0.54 0.49 1.56 -0.12 -1.26 -4.71 117.98 109.24 2k33 s PHE 74 Ca -0.07 1.11 -0.21 0.00 -0.05 0.00 0.00 56.93 57.71 2k33 s PHE 74 Cb 0.12 0.39 -0.10 0.00 -0.63 0.00 0.00 43.02 42.80 2k33 s PHE 74 CO 0.82 -0.38 0.70 -0.40 -0.05 0.00 0.00 175.22 175.90 2k33 n ASP 75 N 1.51 -0.24 0.00 1.98 5.75 -1.25 -4.61 116.55 119.68 2k33 n ASP 75 Ca -0.14 0.87 0.00 0.00 -0.01 0.00 0.00 54.79 55.51 2k33 n ASP 75 Cb 0.57 -1.22 0.00 0.00 -1.03 0.00 0.00 41.12 39.44 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 1.59 1.39 3.76 6.12 0.00 -1.01 -4.78 105.19 112.26 2k33 n GLY 76 Ca 0.11 -1.29 -0.36 0.00 0.00 0.00 0.00 46.02 44.48 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 -1.94 2.77 0.06 2.61 2.01 0.84 0.17 115.64 122.16 2k33 s THR 77 Ca 0.00 0.49 0.06 0.00 0.31 0.00 0.00 61.69 62.55 2k33 s THR 77 Cb 0.00 -3.20 -0.03 0.00 0.01 0.00 0.00 72.50 69.28 2k33 s THR 77 CO 0.00 -0.09 -0.16 -0.51 -0.69 0.00 0.00 174.62 173.17 2k33 s ILE 78 N -1.62 1.28 0.00 1.82 2.07 0.90 -0.22 121.20 125.44 2k33 s ILE 78 Ca 0.75 -1.21 0.00 0.00 -1.41 0.00 0.00 60.65 58.78 2k33 s ILE 78 Cb -0.29 -1.18 0.00 0.00 0.13 0.00 0.00 42.46 41.12 2k33 s ILE 78 CO 0.32 -0.06 0.00 0.61 -1.91 0.00 0.00 174.94 173.91 2k33 n GLY 79 N 1.56 1.57 3.96 1.50 0.00 -0.96 -1.75 105.19 111.07 2k33 n GLY 79 Ca -0.19 -1.75 -0.22 0.00 0.00 0.00 0.00 46.02 43.85 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 6.15 0.58 1.61 -4.77 -1.26 -3.67 116.67 114.30 2k33 s ASP 80 Ca 0.00 0.20 -0.14 0.00 -3.30 0.00 0.00 52.55 49.31 2k33 s ASP 80 Cb 0.00 -1.74 -0.05 0.00 -1.09 0.00 0.00 42.92 40.03 2k33 s ASP 80 CO 0.00 -0.34 1.02 0.00 0.70 0.00 0.00 175.17 176.54 2k33 s ALA 81 N -2.25 3.00 -0.14 2.11 0.00 -1.26 -4.32 121.76 118.89 2k33 s ALA 81 Ca 0.41 0.11 0.04 0.00 0.00 0.00 0.00 51.96 52.52 2k33 s ALA 81 Cb -0.09 -3.13 -0.11 0.00 0.00 0.00 0.00 23.12 19.79 2k33 s ALA 81 CO 0.34 -0.55 -0.09 1.28 0.00 0.00 0.00 175.76 176.74 2k33 n LEU 82 N -2.17 2.20 -4.95 0.00 4.77 0.11 -4.94 117.00 112.03 2k33 n LEU 82 Ca 0.07 -0.06 -0.19 0.00 -0.03 0.00 0.00 56.01 55.80 2k33 n LEU 82 Cb 0.54 -0.31 -0.01 0.00 -2.33 0.00 0.00 43.42 41.31 2k33 n LEU 82 CO 0.51 0.63 0.05 0.68 -1.33 0.00 0.00 177.39 177.93 2k33 s VAL 83 N -2.29 3.44 0.45 4.08 -7.23 -1.26 -5.04 120.40 112.54 2k33 s VAL 83 Ca -0.16 -1.13 0.06 0.00 -1.81 0.00 0.00 61.98 58.94 2k33 s VAL 83 Cb 0.05 -3.18 -0.04 0.00 0.56 0.00 0.00 36.38 33.76 2k33 s VAL 83 CO 0.38 -0.09 0.14 0.20 -0.31 0.00 0.00 175.10 175.41 2k33 s ASN 84 N -4.18 4.28 0.62 4.85 0.01 -1.26 -5.09 114.94 114.16 2k33 s ASN 84 Ca 0.48 -1.27 -0.15 0.00 -0.71 0.00 0.00 52.86 51.20 2k33 s ASN 84 Cb -0.08 -0.16 -0.03 0.00 0.41 0.00 0.00 41.25 41.40 2k33 s ASN 84 CO 0.30 -0.65 1.07 -0.63 -1.51 0.00 0.00 177.10 175.67 2k33 s ILE 85 N -2.70 3.74 -0.66 0.60 -1.09 -1.26 -3.36 121.20 116.47 2k33 s ILE 85 Ca 0.32 0.79 0.00 0.00 -2.23 0.00 0.00 60.65 59.53 2k33 s ILE 85 Cb 0.04 -3.33 0.00 0.00 -1.58 0.00 0.00 42.46 37.59 2k33 s ILE 85 CO 0.18 -0.52 0.00 0.61 -1.23 0.00 0.00 174.94 173.98 2k33 n GLY 86 N -1.02 0.75 3.45 6.18 0.00 -0.97 -4.97 105.19 108.61 2k33 n GLY 86 Ca 0.09 -0.17 -0.35 0.00 0.00 0.00 0.00 46.02 45.59 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 -2.39 4.77 0.09 1.61 1.01 -1.21 -4.90 116.67 115.65 2k33 s ASP 87 Ca 0.00 -0.20 -0.31 0.00 0.71 0.00 0.00 52.55 52.76 2k33 s ASP 87 Cb 0.00 -1.80 -0.08 0.00 1.01 0.00 0.00 42.92 42.04 2k33 s ASP 87 CO 0.00 0.09 1.59 -0.47 0.21 0.00 0.00 175.17 176.59 2k33 s TYR 88 N 0.84 2.67 0.12 4.23 6.14 -1.26 -2.35 117.35 127.74 2k33 s TYR 88 Ca 0.00 0.48 0.09 0.00 0.64 0.00 0.00 57.07 58.28 2k33 s TYR 88 Cb -0.14 -3.91 -0.04 0.00 0.42 0.00 0.00 41.96 38.29 2k33 s TYR 88 CO 0.02 -3.54 -0.22 0.14 0.64 0.00 0.00 175.55 172.59 2k33 s VAL 89 N 2.15 1.87 0.24 3.14 -7.23 0.04 -4.97 120.40 115.64 2k33 s VAL 89 Ca 0.71 -1.68 -0.04 0.00 -1.81 0.00 0.00 61.98 59.16 2k33 s VAL 89 Cb -0.40 -1.73 0.05 0.00 0.56 0.00 0.00 36.38 34.87 2k33 s VAL 89 CO 0.31 -0.08 0.32 -1.20 -0.31 0.00 0.00 175.10 174.14 2k33 n SER 90 N 0.85 0.04 -3.76 4.85 7.64 -1.26 -1.78 113.62 120.20 2k33 n SER 90 Ca -0.18 -1.13 0.00 0.00 1.01 0.00 0.00 58.87 58.58 2k33 n SER 90 Cb 0.54 -0.24 0.00 0.00 -1.01 0.00 0.00 64.21 63.50 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 -3.20 0.00 0.16 -0.43 0.00 -1.25 -4.16 120.51 111.63 2k33 n ALA 91 Ca -0.05 0.00 0.17 0.00 0.00 0.00 0.00 53.44 53.56 2k33 n ALA 91 Cb 0.14 0.00 0.64 0.00 0.00 0.00 0.00 19.45 20.24 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 -0.28 0.00 0.87 -1.77 0.22 113.55 112.59 2k33 h SER 92 Ca 0.00 0.00 0.08 0.00 -1.23 0.00 0.00 61.79 60.64 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 0.29 0.74 -0.53 0.00 0.00 176.83 177.33 2k33 h THR 93 N 0.00 0.47 -2.85 2.23 2.02 -1.91 -3.40 112.91 109.46 2k33 h THR 93 Ca 0.15 0.00 -0.57 0.00 0.77 0.00 0.00 66.41 66.75 2k33 h THR 93 Cb 1.30 0.77 -0.03 0.00 -1.74 0.00 0.00 68.15 68.44 2k33 h THR 93 CO -0.00 0.00 1.21 0.28 0.37 0.00 0.00 175.52 177.38 2k33 s THR 94 N -4.66 3.61 -0.35 3.16 -1.32 0.75 -4.97 115.64 111.86 2k33 s THR 94 Ca -0.05 0.62 -0.17 0.00 -1.21 0.00 0.00 61.69 60.89 2k33 s THR 94 Cb 0.16 -3.81 -0.01 0.00 -1.51 0.00 0.00 72.50 67.34 2k33 s THR 94 CO 0.56 -0.50 0.43 -1.61 -2.21 0.00 0.00 174.62 171.29 2k33 s GLU 95 N 5.40 3.54 -0.06 7.08 2.02 -1.26 -4.55 118.70 130.87 2k33 s GLU 95 Ca 0.74 -0.35 -0.06 0.00 0.02 0.00 0.00 54.97 55.32 2k33 s GLU 95 Cb -0.20 -3.82 -0.02 0.00 0.10 0.00 0.00 34.13 30.19 2k33 s GLU 95 CO 0.33 -0.60 -0.12 1.28 0.02 0.00 0.00 175.26 176.17 2k33 n LEU 96 N 5.55 0.68 -3.99 1.80 7.99 -1.24 -4.51 117.00 123.28 2k33 n LEU 96 Ca -0.07 0.12 -0.09 0.00 -0.01 0.00 0.00 56.01 55.96 2k33 n LEU 96 Cb 0.49 -0.56 -0.11 0.00 -0.11 0.00 0.00 43.42 43.13 2k33 n LEU 96 CO 0.43 -0.43 -0.34 0.54 -1.51 0.00 0.00 177.39 176.08 2k33 s VAL 97 N -1.67 0.13 0.11 4.08 0.11 -1.26 0.07 120.40 121.97 2k33 s VAL 97 Ca -0.10 -1.08 0.06 0.00 -2.93 0.00 0.00 61.98 57.94 2k33 s VAL 97 Cb 0.01 -0.54 -0.04 0.00 -1.53 0.00 0.00 36.38 34.28 2k33 s VAL 97 CO 0.15 -0.59 -0.06 0.00 -3.33 0.00 0.00 175.10 171.26 2k33 s ARG 98 N -1.98 2.29 -0.16 1.54 3.03 -1.26 -0.01 118.95 122.39 2k33 s ARG 98 Ca -0.11 -0.98 -0.07 0.00 2.03 0.00 0.00 55.73 56.60 2k33 s ARG 98 Cb -0.06 -2.38 -0.04 0.00 -1.03 0.00 0.00 34.95 31.43 2k33 s ARG 98 CO -0.03 0.51 0.08 0.54 -1.13 0.00 0.00 175.30 175.27 2k33 s VAL 99 N -1.30 4.95 0.28 4.99 0.11 0.19 -2.26 120.40 127.36 2k33 s VAL 99 Ca 0.23 0.02 0.03 0.00 -2.93 0.00 0.00 61.98 59.33 2k33 s VAL 99 Cb -0.11 -3.20 -0.06 0.00 -1.53 0.00 0.00 36.38 31.48 2k33 s VAL 99 CO 0.16 0.51 0.04 0.28 -3.33 0.00 0.00 175.10 172.76 2k33 s THR 100 N -0.06 1.03 0.00 5.04 -1.32 0.70 -2.53 115.64 118.49 2k33 s THR 100 Ca 0.07 -2.02 0.00 0.00 -1.21 0.00 0.00 61.69 58.54 2k33 s THR 100 Cb -0.12 -2.62 0.00 0.00 -1.51 0.00 0.00 72.50 68.25 2k33 s THR 100 CO 0.01 -0.10 0.00 -3.20 -2.21 0.00 0.00 174.62 169.11 2k33 n ASN 101 N -0.56 -3.26 0.00 8.08 5.15 -1.26 -0.11 115.26 123.29 2k33 n ASN 101 Ca -0.03 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.95 2k33 n ASN 101 Cb 0.66 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.91 2k33 n ASN 101 CO 0.00 0.00 0.00 -0.11 1.40 0.00 0.00 177.26 178.55 2k33 n LEU 102 N 0.00 0.00 -4.80 1.20 -0.00 -1.26 -4.01 117.00 108.13 2k33 n LEU 102 Ca 0.00 0.00 -0.33 0.00 -0.00 0.00 0.00 56.01 55.68 2k33 n LEU 102 Cb 0.00 0.15 0.01 0.00 -0.00 0.00 0.00 43.42 43.58 2k33 n LEU 102 CO 0.00 -0.22 0.72 0.20 -0.00 0.00 0.00 177.39 178.09 2k33 s ASN 103 N -2.22 5.80 1.22 1.96 0.01 -1.26 -4.36 114.94 116.09 2k33 s ASN 103 Ca 0.00 1.82 -0.20 0.00 -0.71 0.00 0.00 52.86 53.77 2k33 s ASN 103 Cb 0.00 -2.53 0.29 0.00 0.41 0.00 0.00 41.25 39.42 2k33 s ASN 103 CO 0.00 -1.16 1.11 -2.16 -1.51 0.00 0.00 177.10 173.39 2k33 s PRO 104 N -4.06 -1.35 -0.03 -0.60 0.04 -1.26 -4.77 135.00 122.97 2k33 s PRO 104 Ca 0.64 -0.12 -0.05 0.00 0.04 0.00 0.00 61.00 61.51 2k33 s PRO 104 Cb -0.16 -1.59 0.01 0.00 0.04 0.00 0.00 34.50 32.80 2k33 s PRO 104 CO 0.37 -3.78 0.11 0.42 0.04 0.00 0.00 177.00 174.16 2k33 s ILE 105 N -3.02 0.04 -0.11 0.56 -1.09 -1.26 -5.04 121.20 111.27 2k33 s ILE 105 Ca 0.71 -0.29 0.04 0.00 -2.23 0.00 0.00 60.65 58.89 2k33 s ILE 105 Cb -0.09 -0.26 0.14 0.00 -1.58 0.00 0.00 42.46 40.67 2k33 s ILE 105 CO 0.56 -0.16 1.07 0.00 -1.23 0.00 0.00 174.94 175.18 2k33 n TYR 106 N 2.42 -0.70 -2.78 3.97 4.11 -1.26 -5.06 117.16 117.87 2k33 n TYR 106 Ca -0.17 -0.84 0.00 0.00 -0.00 0.00 0.00 57.90 56.90 2k33 n TYR 106 Cb 0.58 0.84 0.01 0.00 -0.00 0.00 0.00 39.34 40.77 2k33 n TYR 106 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.86 176.86 2k33 s ALA 107 N 0.04 -4.23 0.12 -3.48 0.00 -1.26 -5.05 121.76 107.91 2k33 s ALA 107 Ca 0.03 0.97 0.00 0.00 0.00 0.00 0.00 51.96 52.96 2k33 s ALA 107 Cb 0.15 -2.98 0.00 0.00 0.00 0.00 0.00 23.12 20.29 2k33 s ALA 107 CO -0.04 -2.48 0.00 -3.47 0.00 0.00 0.00 175.76 169.77 2k33 n ASP 108 N 3.45 -1.12 -2.38 0.00 -0.08 -1.26 -5.12 116.55 110.03 2k33 n ASP 108 Ca 0.08 0.40 -0.01 0.00 -1.51 0.00 0.00 54.79 53.75 2k33 n ASP 108 Cb 0.63 1.29 -0.01 0.00 2.34 0.00 0.00 41.12 45.37 2k33 n ASP 108 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2k33 n GLY 109 N -1.34 -4.12 0.09 0.27 0.00 -1.26 -5.02 105.19 93.80 2k33 n GLY 109 Ca 0.00 0.50 -0.10 0.00 0.00 0.00 0.00 46.02 46.42 2k33 n GLY 109 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2k33 n SER 110 N 0.69 1.86 -2.69 1.61 2.88 -1.26 -5.07 113.62 111.64 2k33 n SER 110 Ca -0.07 0.51 -0.04 0.00 -1.33 0.00 0.00 58.87 57.93 2k33 n SER 110 Cb 0.11 -0.85 0.01 0.00 -0.75 0.00 0.00 64.21 62.72 2k33 n SER 110 CO 0.00 0.00 0.00 1.57 -1.23 0.00 0.00 175.04 175.38 2k33 n HIS 111 N -4.52 -2.79 -1.73 0.66 -0.00 -1.26 -5.02 115.22 100.55 2k33 n HIS 111 Ca -0.16 1.10 -0.30 0.00 0.46 0.00 0.00 57.72 58.83 2k33 n HIS 111 Cb 0.44 -3.69 0.18 0.00 -0.12 0.00 0.00 29.99 26.80 2k33 n HIS 111 CO 0.00 0.00 0.00 -1.01 0.46 0.00 0.00 176.34 175.79 2k33 s HIS 112 N -2.57 1.70 0.21 1.57 3.76 -1.26 -5.10 115.29 113.60 2k33 s HIS 112 Ca 0.14 0.47 -0.05 0.00 -0.15 0.00 0.00 55.06 55.47 2k33 s HIS 112 Cb -0.04 -3.83 -0.03 0.00 1.11 0.00 0.00 32.58 29.79 2k33 s HIS 112 CO 0.64 -2.71 0.24 -3.38 -0.85 0.00 0.00 174.74 168.68 2k33 s HIS 113 N -3.62 0.86 -0.20 1.40 -3.43 -1.26 -5.18 115.29 103.86 2k33 s HIS 113 Ca 0.71 -1.14 -0.36 0.00 -0.80 0.00 0.00 55.06 53.47 2k33 s HIS 113 Cb -0.07 -0.30 0.14 0.00 -1.43 0.00 0.00 32.58 30.92 2k33 s HIS 113 CO 0.53 -0.75 1.28 -1.58 -2.00 0.00 0.00 174.74 172.23 2k33 s HIS 114 N -4.10 -0.08 0.08 0.38 2.46 -1.26 -5.19 115.29 107.58 2k33 s HIS 114 Ca 0.32 0.04 -0.16 0.00 0.47 0.00 0.00 55.06 55.73 2k33 s HIS 114 Cb 0.04 0.51 0.06 0.00 -0.13 0.00 0.00 32.58 33.06 2k33 s HIS 114 CO 0.10 -0.14 0.75 -2.39 -2.47 0.00 0.00 174.74 170.59 2k33 n HIS 115 N -0.12 -0.84 -0.58 3.88 1.44 -1.26 -5.37 115.22 112.37 2k33 n HIS 115 Ca 0.01 -0.74 0.00 0.00 -2.01 0.00 0.00 57.72 54.98 2k33 n HIS 115 Cb 0.58 0.35 0.00 0.00 0.12 0.00 0.00 29.99 31.05 2k33 n HIS 115 CO 0.00 0.00 0.00 1.58 -2.81 0.00 0.00 176.34 175.11