#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 0.98 -0.26 2.53 1.01 -1.06 -4.99 120.40 118.61 2k33 s VAL 2 Ca 0.00 -1.04 -0.05 0.00 0.00 0.00 0.00 61.98 60.88 2k33 s VAL 2 Cb 0.00 -0.93 0.00 0.00 0.00 0.00 0.00 36.38 35.46 2k33 s VAL 2 CO 0.00 -0.11 0.03 -0.63 0.00 0.00 0.00 175.10 174.39 2k33 s ILE 3 N -0.99 3.74 0.34 2.22 1.01 -1.26 0.10 121.20 126.35 2k33 s ILE 3 Ca -0.01 -0.60 -0.29 0.00 0.00 0.00 0.00 60.65 59.75 2k33 s ILE 3 Cb -0.08 -2.84 -0.11 0.00 0.01 0.00 0.00 42.46 39.44 2k33 s ILE 3 CO 0.01 0.22 1.51 -0.63 0.00 0.00 0.00 174.94 176.05 2k33 s ILE 4 N 1.49 2.14 0.26 2.92 1.01 -0.13 -4.95 121.20 123.94 2k33 s ILE 4 Ca 0.04 0.13 0.12 0.00 0.00 0.00 0.00 60.65 60.94 2k33 s ILE 4 Cb -0.16 -3.09 -0.05 0.00 0.01 0.00 0.00 42.46 39.18 2k33 s ILE 4 CO 0.00 0.03 -0.19 -0.54 0.00 0.00 0.00 174.94 174.24 2k33 s LYS 5 N -1.43 1.70 0.00 2.79 -0.14 -1.26 -3.81 119.74 117.58 2k33 s LYS 5 Ca 0.56 -1.68 0.14 0.00 -1.36 0.00 0.00 55.97 53.64 2k33 s LYS 5 Cb -0.46 -1.83 0.64 0.00 -1.68 0.00 0.00 37.83 34.50 2k33 s LYS 5 CO 0.56 0.35 1.45 -0.35 -0.76 0.00 0.00 175.35 176.60 2k33 n PRO 6 N -0.42 0.04 0.00 -1.68 -0.04 -1.26 -4.87 135.00 126.77 2k33 n PRO 6 Ca -0.07 0.23 0.00 0.00 -0.04 0.00 0.00 63.50 63.62 2k33 n PRO 6 Cb 0.59 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.55 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 -1.45 0.00 -3.80 0.54 7.27 -1.26 -4.81 117.38 113.86 2k33 n GLN 7 Ca 0.04 0.00 -0.19 0.00 0.07 0.00 0.00 57.00 56.92 2k33 n GLN 7 Cb 0.16 -0.03 -0.05 0.00 2.41 0.00 0.00 30.24 32.73 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 0.00 0.00 -3.51 1.69 0.24 -1.26 -4.74 118.33 110.75 2k33 n VAL 8 Ca 0.00 -1.79 -0.41 0.00 -2.04 0.00 0.00 64.34 60.10 2k33 n VAL 8 Cb 0.00 0.65 -0.10 0.00 -1.47 0.00 0.00 33.84 32.92 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 -2.88 6.08 0.00 -1.34 0.01 -1.26 -2.58 113.70 111.73 2k33 s SER 9 Ca 0.16 -0.52 0.00 0.00 1.31 0.00 0.00 55.95 56.89 2k33 s SER 9 Cb 0.01 -2.15 0.00 0.00 0.21 0.00 0.00 66.02 64.09 2k33 s SER 9 CO 0.11 -0.29 0.00 0.61 0.41 0.00 0.00 173.24 174.08 2k33 n GLY 10 N 5.11 2.96 2.96 3.44 0.00 -0.88 -4.65 105.19 114.13 2k33 n GLY 10 Ca -0.12 -0.06 -0.11 0.00 0.00 0.00 0.00 46.02 45.73 2k33 n GLY 10 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2k33 s VAL 11 N 0.40 0.03 0.45 1.61 -7.23 -0.92 0.76 120.40 115.51 2k33 s VAL 11 Ca 0.00 -0.26 -0.25 0.00 -1.81 0.00 0.00 61.98 59.66 2k33 s VAL 11 Cb 0.00 -0.16 -0.08 0.00 0.56 0.00 0.00 36.38 36.70 2k33 s VAL 11 CO 0.00 -0.14 1.37 -0.63 -0.31 0.00 0.00 175.10 175.39 2k33 s ILE 12 N -0.42 2.27 0.00 -0.62 -1.09 -0.05 -1.18 121.20 120.10 2k33 s ILE 12 Ca -0.05 0.23 0.00 0.00 -2.23 0.00 0.00 60.65 58.61 2k33 s ILE 12 Cb -0.03 -3.13 0.00 0.00 -1.58 0.00 0.00 42.46 37.71 2k33 s ILE 12 CO 0.00 0.03 0.00 0.52 -1.23 0.00 0.00 174.94 174.26 2k33 n VAL 13 N -0.24 0.00 -3.58 2.92 0.31 0.17 -0.50 118.33 117.41 2k33 n VAL 13 Ca 0.06 0.00 -0.06 0.00 -0.01 0.00 0.00 64.34 64.33 2k33 n VAL 13 Cb 0.43 -0.62 -0.02 0.00 -0.91 0.00 0.00 33.84 32.72 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 -3.47 -0.27 -0.31 4.52 2.47 -1.22 -4.81 114.94 111.85 2k33 s ASN 14 Ca 0.00 -0.11 -0.02 0.00 0.42 0.00 0.00 52.86 53.15 2k33 s ASN 14 Cb 0.00 0.36 0.11 0.00 -1.45 0.00 0.00 41.25 40.27 2k33 s ASN 14 CO 0.00 -0.61 0.16 -1.59 -3.72 0.00 0.00 177.10 171.33 2k33 s LYS 15 N -3.02 0.35 -0.67 0.43 0.00 -1.26 -0.38 119.74 115.19 2k33 s LYS 15 Ca 0.08 -0.85 -0.07 0.00 0.00 0.00 0.00 55.97 55.14 2k33 s LYS 15 Cb -0.01 -1.26 -0.11 0.00 0.00 0.00 0.00 37.83 36.44 2k33 s LYS 15 CO -0.05 -1.08 3.15 1.28 0.00 0.00 0.00 175.35 178.64 2k33 n LEU 16 N 4.80 6.73 -4.01 2.77 4.77 0.13 -4.84 117.00 127.36 2k33 n LEU 16 Ca 0.00 -3.86 -0.08 0.00 -0.03 0.00 0.00 56.01 52.04 2k33 n LEU 16 Cb 0.40 -1.41 -0.10 0.00 -2.33 0.00 0.00 43.42 39.98 2k33 n LEU 16 CO 0.08 1.85 -0.30 0.72 -1.33 0.00 0.00 177.39 178.41 2k33 s PHE 17 N 0.54 0.35 0.36 -1.77 -0.71 -1.21 -4.31 117.98 111.23 2k33 s PHE 17 Ca 0.65 -0.77 0.08 0.00 -1.04 0.00 0.00 56.93 55.85 2k33 s PHE 17 Cb 0.28 -0.26 -0.04 0.00 -1.21 0.00 0.00 43.02 41.79 2k33 s PHE 17 CO -0.07 -0.35 0.17 0.15 -1.34 0.00 0.00 175.22 173.78 2k33 s LYS 18 N -3.04 2.35 -0.41 1.99 -0.14 -1.26 -5.05 119.74 114.19 2k33 s LYS 18 Ca -0.01 -1.60 -0.24 0.00 -1.36 0.00 0.00 55.97 52.76 2k33 s LYS 18 Cb 0.01 -2.15 0.02 0.00 -1.68 0.00 0.00 37.83 34.03 2k33 s LYS 18 CO -0.07 0.04 0.81 0.00 -0.76 0.00 0.00 175.35 175.37 2k33 s ALA 19 N -2.46 3.34 0.00 5.17 0.00 -1.26 -3.63 121.76 122.92 2k33 s ALA 19 Ca 0.39 -0.81 0.00 0.00 0.00 0.00 0.00 51.96 51.54 2k33 s ALA 19 Cb -0.01 -3.45 0.00 0.00 0.00 0.00 0.00 23.12 19.66 2k33 s ALA 19 CO 0.23 -1.75 0.00 0.41 0.00 0.00 0.00 175.76 174.65 2k33 n GLY 20 N 4.77 0.64 4.00 0.00 0.00 -0.45 -4.93 105.19 109.22 2k33 n GLY 20 Ca 0.03 -0.32 -0.22 0.00 0.00 0.00 0.00 46.02 45.51 2k33 n GLY 20 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2k33 s ASP 21 N -2.29 4.57 0.04 1.61 1.11 -1.24 -4.86 116.67 115.61 2k33 s ASP 21 Ca 0.00 -0.46 0.01 0.00 0.18 0.00 0.00 52.55 52.28 2k33 s ASP 21 Cb 0.00 0.02 -0.04 0.00 1.07 0.00 0.00 42.92 43.97 2k33 s ASP 21 CO 0.00 -1.71 0.09 -0.54 1.18 0.00 0.00 175.17 174.20 2k33 s LYS 22 N -5.01 3.03 0.11 8.23 1.02 -1.26 -2.22 119.74 123.64 2k33 s LYS 22 Ca 0.65 -0.57 0.04 0.00 0.02 0.00 0.00 55.97 56.11 2k33 s LYS 22 Cb -0.06 -2.82 -0.04 0.00 -0.52 0.00 0.00 37.83 34.39 2k33 s LYS 22 CO 0.43 0.61 -0.09 0.14 -0.92 0.00 0.00 175.35 175.51 2k33 s VAL 23 N -1.31 0.96 -0.05 3.17 -7.23 -0.94 -4.96 120.40 110.03 2k33 s VAL 23 Ca 0.27 -1.83 0.01 0.00 -1.81 0.00 0.00 61.98 58.62 2k33 s VAL 23 Cb -0.12 -1.57 -0.03 0.00 0.56 0.00 0.00 36.38 35.21 2k33 s VAL 23 CO 0.19 -0.68 -0.07 -1.59 -0.31 0.00 0.00 175.10 172.64 2k33 s LYS 24 N -3.29 2.71 -0.74 4.82 0.00 -1.26 -2.73 119.74 119.25 2k33 s LYS 24 Ca 0.10 -0.58 -0.25 0.00 0.00 0.00 0.00 55.97 55.24 2k33 s LYS 24 Cb 0.00 -2.57 -0.15 0.00 0.00 0.00 0.00 37.83 35.11 2k33 s LYS 24 CO -0.01 0.65 2.43 0.36 0.00 0.00 0.00 175.35 178.79 2k33 n LYS 25 N 2.06 0.58 0.00 1.78 2.85 -1.26 -0.13 118.16 124.04 2k33 n LYS 25 Ca -0.17 -0.27 0.00 0.00 -1.05 0.00 0.00 58.31 56.82 2k33 n LYS 25 Cb 0.53 -2.88 0.00 0.00 -0.65 0.00 0.00 35.03 32.03 2k33 n LYS 25 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 177.40 177.76 2k33 n GLY 26 N 6.27 1.05 3.57 2.58 0.00 -0.80 -4.90 105.19 112.96 2k33 n GLY 26 Ca 0.49 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 46.19 2k33 n GLY 26 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2k33 n GLN 27 N 0.00 -0.38 -2.98 1.61 1.13 0.81 -4.42 117.38 113.14 2k33 n GLN 27 Ca 0.00 -0.05 -0.41 0.00 -1.94 0.00 0.00 57.00 54.60 2k33 n GLN 27 Cb 0.00 -2.18 -0.05 0.00 0.11 0.00 0.00 30.24 28.13 2k33 n GLN 27 CO 0.00 0.00 0.00 0.99 -1.44 0.00 0.00 177.06 176.61 2k33 s THR 28 N -2.53 4.97 0.00 5.09 2.01 -1.26 -2.08 115.64 121.84 2k33 s THR 28 Ca 0.63 1.50 0.00 0.00 0.31 0.00 0.00 61.69 64.13 2k33 s THR 28 Cb -0.22 -4.07 0.00 0.00 0.01 0.00 0.00 72.50 68.21 2k33 s THR 28 CO 0.62 0.13 0.00 0.18 -0.69 0.00 0.00 174.62 174.86 2k33 n LEU 29 N 4.61 1.51 -4.42 4.42 4.77 -0.71 -4.51 117.00 122.67 2k33 n LEU 29 Ca 0.01 0.00 -0.21 0.00 -0.03 0.00 0.00 56.01 55.79 2k33 n LEU 29 Cb 0.50 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.49 2k33 n LEU 29 CO 0.47 0.21 -0.25 -0.36 -1.33 0.00 0.00 177.39 176.13 2k33 s PHE 30 N -1.86 1.81 -0.16 -1.77 0.40 -1.05 0.20 117.98 115.56 2k33 s PHE 30 Ca 0.00 -1.09 -0.10 0.00 -0.60 0.00 0.00 56.93 55.14 2k33 s PHE 30 Cb 0.00 -1.14 0.05 0.00 0.51 0.00 0.00 43.02 42.44 2k33 s PHE 30 CO 0.00 -0.15 0.39 0.42 0.70 0.00 0.00 175.22 176.58 2k33 s ILE 31 N -3.42 -0.02 0.00 0.64 1.01 0.49 0.34 121.20 120.23 2k33 s ILE 31 Ca 0.35 0.07 0.00 0.00 0.00 0.00 0.00 60.65 61.06 2k33 s ILE 31 Cb 0.07 -0.57 -0.00 0.00 0.01 0.00 0.00 42.46 41.97 2k33 s ILE 31 CO 0.15 0.03 -0.00 -0.63 0.00 0.00 0.00 174.94 174.48 2k33 s ILE 32 N 0.99 0.02 -0.13 2.92 1.01 -0.99 0.46 121.20 125.48 2k33 s ILE 32 Ca -0.06 -0.09 -0.02 0.00 0.00 0.00 0.00 60.65 60.47 2k33 s ILE 32 Cb -0.07 -0.04 -0.02 0.00 0.01 0.00 0.00 42.46 42.34 2k33 s ILE 32 CO -0.08 -0.05 -0.06 -1.83 0.00 0.00 0.00 174.94 172.92 2k33 s GLU 33 N -0.14 3.45 0.00 2.79 4.04 -0.33 0.16 118.70 128.67 2k33 s GLU 33 Ca -0.01 -0.56 0.00 0.00 0.04 0.00 0.00 54.97 54.43 2k33 s GLU 33 Cb -0.01 -2.80 0.00 0.00 0.02 0.00 0.00 34.13 31.34 2k33 s GLU 33 CO -0.00 0.31 0.00 0.00 -1.84 0.00 0.00 175.26 173.73 2k33 n GLN 34 N 3.30 5.33 -2.67 -4.83 0.00 -1.24 -2.16 117.38 115.10 2k33 n GLN 34 Ca -0.18 0.00 -0.05 0.00 0.00 0.00 0.00 57.00 56.77 2k33 n GLN 34 Cb 0.53 -0.45 -0.04 0.00 0.00 0.00 0.00 30.24 30.27 2k33 n GLN 34 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.06 173.59 2k33 n ASP 35 N -0.02 -1.45 -0.80 2.61 -0.08 -1.24 -4.90 116.55 110.68 2k33 n ASP 35 Ca 0.00 1.30 0.00 0.00 -1.51 0.00 0.00 54.79 54.58 2k33 n ASP 35 Cb 0.00 -4.75 -0.00 0.00 2.34 0.00 0.00 41.12 38.70 2k33 n ASP 35 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 2k33 n GLN 36 N 1.83 0.00 -0.41 -0.67 10.64 -1.26 -4.79 117.38 122.71 2k33 n GLN 36 Ca -0.37 -1.04 0.07 0.00 -1.83 0.00 0.00 57.00 53.84 2k33 n GLN 36 Cb 0.57 -0.16 0.25 0.00 -0.86 0.00 0.00 30.24 30.04 2k33 n GLN 36 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.06 175.23 2k33 n ALA 37 N 0.12 2.82 0.00 2.61 0.00 -1.26 -4.92 120.51 119.89 2k33 n ALA 37 Ca -0.02 -1.08 0.00 0.00 0.00 0.00 0.00 53.44 52.34 2k33 n ALA 37 Cb 0.77 -1.01 0.00 0.00 0.00 0.00 0.00 19.45 19.21 2k33 n ALA 37 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 2k33 n SER 38 N 0.81 0.00 0.00 0.00 7.64 -1.26 -5.00 113.62 115.81 2k33 n SER 38 Ca 0.18 0.00 0.14 0.00 1.01 0.00 0.00 58.87 60.20 2k33 n SER 38 Cb 0.62 0.00 0.69 0.00 -1.01 0.00 0.00 64.21 64.51 2k33 n SER 38 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 2k33 n LYS 39 N -0.04 0.25 -0.22 1.43 4.76 -1.26 -2.96 118.16 120.12 2k33 n LYS 39 Ca 0.00 0.01 0.07 0.00 -2.87 0.00 0.00 58.31 55.52 2k33 n LYS 39 Cb 0.00 -1.50 0.16 0.00 -1.84 0.00 0.00 35.03 31.85 2k33 n LYS 39 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 2k33 n ASP 40 N -1.37 3.00 -4.07 4.39 2.03 -1.26 -4.94 116.55 114.33 2k33 n ASP 40 Ca 0.11 -2.62 -0.32 0.00 0.52 0.00 0.00 54.79 52.48 2k33 n ASP 40 Cb 0.27 -0.35 -0.15 0.00 -0.72 0.00 0.00 41.12 40.16 2k33 n ASP 40 CO 0.00 0.00 0.00 -0.36 -1.92 0.00 0.00 177.20 174.92 2k33 s PHE 41 N -2.10 3.00 -0.27 -0.67 0.40 -1.15 -5.08 117.98 112.10 2k33 s PHE 41 Ca 0.28 -2.03 -0.32 0.00 -0.60 0.00 0.00 56.93 54.26 2k33 s PHE 41 Cb 0.22 -1.88 0.18 0.00 0.51 0.00 0.00 43.02 42.05 2k33 s PHE 41 CO 0.08 -0.84 1.34 0.54 0.70 0.00 0.00 175.22 177.03 2k33 s ASN 42 N 1.20 -0.05 -1.03 1.36 6.03 -1.24 -4.59 114.94 116.62 2k33 s ASN 42 Ca -0.04 0.04 -0.21 0.00 -1.03 0.00 0.00 52.86 51.62 2k33 s ASN 42 Cb -0.18 0.05 0.08 0.00 -3.03 0.00 0.00 41.25 38.17 2k33 s ASN 42 CO -0.08 -0.06 1.38 -0.60 -2.03 0.00 0.00 177.10 175.72 2k33 s ARG 43 N -1.40 3.66 0.00 3.55 3.52 -1.22 -4.49 118.95 122.57 2k33 s ARG 43 Ca 0.09 -1.47 0.04 0.00 -0.13 0.00 0.00 55.73 54.25 2k33 s ARG 43 Cb -0.01 -5.23 0.06 0.00 -1.56 0.00 0.00 34.95 28.21 2k33 s ARG 43 CO -0.06 -2.06 0.84 0.45 -0.81 0.00 0.00 175.30 173.66 2k33 n SER 44 N 7.98 -0.17 0.05 -2.12 2.88 -1.26 -4.88 113.62 116.12 2k33 n SER 44 Ca 0.32 -1.63 -0.04 0.00 -1.33 0.00 0.00 58.87 56.19 2k33 n SER 44 Cb 0.49 0.01 -0.09 0.00 -0.75 0.00 0.00 64.21 63.88 2k33 n SER 44 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 2k33 h LYS 45 N 0.14 0.00 0.00 -1.46 1.57 -1.99 -3.46 116.57 111.38 2k33 h LYS 45 Ca -0.21 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.57 2k33 h LYS 45 Cb 1.33 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.64 2k33 h LYS 45 CO -0.08 0.65 0.00 0.00 -0.57 0.00 0.00 179.45 179.45 2k33 n ALA 46 N -2.38 0.00 -0.75 3.86 0.00 -1.26 -5.16 120.51 114.82 2k33 n ALA 46 Ca -0.05 0.00 0.01 0.00 0.00 0.00 0.00 53.44 53.40 2k33 n ALA 46 Cb 0.90 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 20.35 2k33 n ALA 46 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2k33 n LEU 47 N -0.14 0.00 -4.34 0.00 4.32 -1.26 -4.77 117.00 110.81 2k33 n LEU 47 Ca 0.00 0.09 -0.34 0.00 -0.02 0.00 0.00 56.01 55.74 2k33 n LEU 47 Cb 0.00 -0.26 -0.14 0.00 -1.62 0.00 0.00 43.42 41.40 2k33 n LEU 47 CO 0.00 -1.17 -0.41 0.72 -1.22 0.00 0.00 177.39 175.31 2k33 s PHE 48 N -0.15 2.90 -0.34 -1.77 -0.71 -1.26 -4.88 117.98 111.77 2k33 s PHE 48 Ca 0.00 -0.80 -0.01 0.00 -1.04 0.00 0.00 56.93 55.08 2k33 s PHE 48 Cb 0.00 -1.98 0.12 0.00 -1.21 0.00 0.00 43.02 39.95 2k33 s PHE 48 CO 0.00 -0.38 0.17 0.45 -1.34 0.00 0.00 175.22 174.12 2k33 s SER 49 N 0.92 3.44 -0.75 1.98 0.15 -1.26 -4.91 113.70 113.27 2k33 s SER 49 Ca -0.02 -1.87 -0.03 0.00 0.70 0.00 0.00 55.95 54.73 2k33 s SER 49 Cb -0.15 -0.56 -0.03 0.00 -1.71 0.00 0.00 66.02 63.57 2k33 s SER 49 CO 0.00 -0.36 0.67 1.67 1.20 0.00 0.00 173.24 176.42 2k33 n GLN 50 N 4.49 -1.50 -2.56 5.44 7.27 -1.26 -4.47 117.38 124.79 2k33 n GLN 50 Ca 0.03 0.97 -0.02 0.00 0.07 0.00 0.00 57.00 58.05 2k33 n GLN 50 Cb 0.39 -5.01 0.00 0.00 2.41 0.00 0.00 30.24 28.04 2k33 n GLN 50 CO 0.00 0.00 0.00 0.43 0.07 0.00 0.00 177.06 177.56 2k33 n SER 51 N -2.35 -7.07 -0.08 1.69 7.64 -1.26 -5.02 113.62 107.16 2k33 n SER 51 Ca -0.03 0.96 -0.09 0.00 1.01 0.00 0.00 58.87 60.72 2k33 n SER 51 Cb 0.56 -4.68 -0.04 0.00 -1.01 0.00 0.00 64.21 59.04 2k33 n SER 51 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2k33 n ALA 52 N 0.29 0.67 -0.16 -0.43 0.00 -1.26 -4.78 120.51 114.84 2k33 n ALA 52 Ca 0.03 -0.60 0.00 0.00 0.00 0.00 0.00 53.44 52.88 2k33 n ALA 52 Cb 0.13 -0.03 0.00 0.00 0.00 0.00 0.00 19.45 19.55 2k33 n ALA 52 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 2k33 n ILE 53 N -4.53 0.00 -1.54 0.00 -5.35 -1.26 -5.05 119.36 101.63 2k33 n ILE 53 Ca -0.15 -0.37 0.00 0.00 -0.27 0.00 0.00 62.75 61.96 2k33 n ILE 53 Cb 0.43 1.16 0.00 0.00 -1.74 0.00 0.00 39.64 39.48 2k33 n ILE 53 CO 0.00 0.00 0.00 -0.24 -1.76 0.00 0.00 176.55 174.55 2k33 n SER 54 N -0.30 -7.52 -0.04 7.28 2.88 -1.26 -4.82 113.62 109.84 2k33 n SER 54 Ca 0.00 1.04 -0.04 0.00 -1.33 0.00 0.00 58.87 58.54 2k33 n SER 54 Cb 0.04 -3.83 -0.03 0.00 -0.75 0.00 0.00 64.21 59.64 2k33 n SER 54 CO 0.00 0.00 0.00 0.06 -1.23 0.00 0.00 175.04 173.87 2k33 h GLN 55 N 2.75 -0.09 0.00 -1.46 -0.00 -2.00 -3.43 115.11 110.88 2k33 h GLN 55 Ca 0.00 0.01 0.00 0.00 -0.00 0.00 0.00 58.65 58.66 2k33 h GLN 55 Cb 0.00 0.02 0.00 0.00 -0.00 0.00 0.00 27.48 27.50 2k33 h GLN 55 CO 0.00 -0.06 0.00 1.63 -0.00 0.00 0.00 178.83 180.40 2k33 n LYS 56 N -3.42 0.00 0.03 0.06 4.76 -1.26 -1.16 118.16 117.17 2k33 n LYS 56 Ca -0.01 0.00 0.06 0.00 -2.87 0.00 0.00 58.31 55.49 2k33 n LYS 56 Cb 0.09 0.00 0.26 0.00 -1.84 0.00 0.00 35.03 33.54 2k33 n LYS 56 CO 0.00 0.00 0.00 0.39 -1.37 0.00 0.00 177.40 176.42 2k33 n GLU 57 N 0.00 0.03 -1.75 1.97 1.02 -1.26 -4.73 120.64 115.92 2k33 n GLU 57 Ca 0.00 0.37 -0.42 0.00 -0.02 0.00 0.00 57.16 57.09 2k33 n GLU 57 Cb 0.00 -1.58 -0.03 0.00 -0.02 0.00 0.00 31.44 29.81 2k33 n GLU 57 CO 0.00 0.00 0.00 0.71 1.18 0.00 0.00 177.13 179.02 2k33 s TYR 58 N -3.08 2.17 0.00 -0.32 1.51 -0.31 -4.99 117.35 112.34 2k33 s TYR 58 Ca 0.04 0.03 0.00 0.00 -1.01 0.00 0.00 57.07 56.12 2k33 s TYR 58 Cb 0.06 -4.14 0.00 0.00 -0.11 0.00 0.00 41.96 37.77 2k33 s TYR 58 CO 0.20 -4.71 0.00 -0.25 -1.11 0.00 0.00 175.55 169.67 2k33 n ASP 59 N 5.70 1.33 0.09 2.29 8.00 -1.26 -4.87 116.55 127.84 2k33 n ASP 59 Ca 0.17 -0.99 0.12 0.00 0.71 0.00 0.00 54.79 54.80 2k33 n ASP 59 Cb 0.39 0.00 0.03 0.00 -0.02 0.00 0.00 41.12 41.52 2k33 n ASP 59 CO 0.00 0.00 0.00 0.77 -0.39 0.00 0.00 177.20 177.58 2k33 h SER 60 N 0.00 0.00 -0.16 -2.24 4.64 -1.94 -3.34 113.55 110.51 2k33 h SER 60 Ca 0.00 -0.06 0.05 0.00 -0.47 0.00 0.00 61.79 61.31 2k33 h SER 60 Cb 0.00 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.08 2k33 h SER 60 CO 0.00 0.03 0.12 -1.28 -0.87 0.00 0.00 176.83 174.83 2k33 h SER 61 N 0.00 0.00 -0.31 4.97 0.87 -1.96 0.24 113.55 117.36 2k33 h SER 61 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2k33 h SER 61 Cb 0.94 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.90 2k33 h SER 61 CO 0.00 0.00 0.00 0.00 -0.53 0.00 0.00 176.83 176.30 2k33 n LEU 62 N -4.48 2.12 -4.37 2.23 -0.00 -1.25 -4.89 117.00 106.36 2k33 n LEU 62 Ca 0.01 -0.98 -0.21 0.00 -0.00 0.00 0.00 56.01 54.83 2k33 n LEU 62 Cb 0.25 -0.20 -0.10 0.00 -0.00 0.00 0.00 43.42 43.36 2k33 n LEU 62 CO 0.35 0.49 -0.46 0.00 -0.00 0.00 0.00 177.39 177.76 2k33 s ALA 63 N -1.59 2.17 -0.82 1.47 0.00 0.83 -5.08 121.76 118.74 2k33 s ALA 63 Ca 0.31 -1.65 -0.21 0.00 0.00 0.00 0.00 51.96 50.41 2k33 s ALA 63 Cb 0.17 -0.16 0.10 0.00 0.00 0.00 0.00 23.12 23.23 2k33 s ALA 63 CO 0.23 0.17 1.09 0.95 0.00 0.00 0.00 175.76 178.20 2k33 s THR 64 N -2.57 4.47 -0.39 0.00 -4.23 -1.26 -4.84 115.64 106.83 2k33 s THR 64 Ca 0.22 -0.96 -0.02 0.00 -1.18 0.00 0.00 61.69 59.75 2k33 s THR 64 Cb -0.03 -4.76 0.19 0.00 1.34 0.00 0.00 72.50 69.24 2k33 s THR 64 CO 0.08 -1.53 0.90 -1.48 -0.54 0.00 0.00 174.62 172.06 2k33 s LEU 65 N 3.51 -0.81 1.24 4.79 0.05 -1.26 -3.43 118.68 122.78 2k33 s LEU 65 Ca 0.29 -0.65 -0.18 0.00 0.05 0.00 0.00 54.13 53.64 2k33 s LEU 65 Cb -0.10 1.04 0.26 0.00 -2.05 0.00 0.00 46.19 45.35 2k33 s LEU 65 CO -0.01 -0.06 0.61 -0.67 -0.55 0.00 0.00 176.35 175.67 2k33 n ASP 66 N 3.44 -2.99 -3.96 1.48 2.03 -1.26 -4.80 116.55 110.48 2k33 n ASP 66 Ca 0.11 -0.45 -0.09 0.00 0.52 0.00 0.00 54.79 54.87 2k33 n ASP 66 Cb 0.61 -1.00 -0.11 0.00 -0.72 0.00 0.00 41.12 39.89 2k33 n ASP 66 CO 0.00 0.00 0.00 -1.00 -1.92 0.00 0.00 177.20 174.28 2k33 s HIS 67 N -2.20 0.22 -0.34 -0.67 3.76 -1.26 -3.60 115.29 111.21 2k33 s HIS 67 Ca 0.59 -0.46 0.03 0.00 -0.15 0.00 0.00 55.06 55.06 2k33 s HIS 67 Cb -0.14 -0.16 0.10 0.00 1.11 0.00 0.00 32.58 33.49 2k33 s HIS 67 CO 0.56 -0.17 0.08 0.99 -0.85 0.00 0.00 174.74 175.35 2k33 s THR 68 N -1.28 1.84 -0.03 1.30 2.01 0.12 -4.98 115.64 114.63 2k33 s THR 68 Ca -0.14 -2.10 -0.30 0.00 0.31 0.00 0.00 61.69 59.46 2k33 s THR 68 Cb -0.09 -2.37 -0.06 0.00 0.01 0.00 0.00 72.50 70.00 2k33 s THR 68 CO -0.01 -0.64 1.59 -1.83 -0.69 0.00 0.00 174.62 173.05 2k33 s GLU 69 N 1.07 4.20 0.06 4.92 -1.05 -1.26 -2.33 118.70 124.30 2k33 s GLU 69 Ca 0.11 2.15 -0.26 0.00 -0.15 0.00 0.00 54.97 56.82 2k33 s GLU 69 Cb -0.19 -3.84 -0.06 0.00 -0.44 0.00 0.00 34.13 29.60 2k33 s GLU 69 CO -0.13 -0.78 0.79 0.42 0.95 0.00 0.00 175.26 176.52 2k33 s ILE 70 N 3.51 4.69 0.43 1.83 1.09 0.15 -4.96 121.20 127.94 2k33 s ILE 70 Ca 0.71 1.69 0.04 0.00 -1.10 0.00 0.00 60.65 61.99 2k33 s ILE 70 Cb -0.33 -4.14 -0.05 0.00 -1.06 0.00 0.00 42.46 36.87 2k33 s ILE 70 CO 0.29 0.36 0.03 -1.59 -0.10 0.00 0.00 174.94 173.93 2k33 s LYS 71 N -0.09 1.98 0.22 2.79 -2.85 -1.26 -1.73 119.74 118.80 2k33 s LYS 71 Ca 0.39 -2.18 -0.30 0.00 -1.00 0.00 0.00 55.97 52.89 2k33 s LYS 71 Cb -0.21 -1.39 -0.09 0.00 -2.06 0.00 0.00 37.83 34.09 2k33 s LYS 71 CO 0.24 -0.21 1.26 0.00 0.10 0.00 0.00 175.35 176.74 2k33 s ALA 72 N -2.90 3.49 0.18 0.59 0.00 -0.88 -4.82 121.76 117.41 2k33 s ALA 72 Ca 0.25 1.06 -0.06 0.00 0.00 0.00 0.00 51.96 53.22 2k33 s ALA 72 Cb 0.06 -3.45 0.09 0.00 0.00 0.00 0.00 23.12 19.83 2k33 s ALA 72 CO 0.13 -0.47 1.53 -1.00 0.00 0.00 0.00 175.76 175.95 2k33 h PRO 73 N 4.98 0.72 0.00 0.00 0.13 -1.94 -2.13 132.00 133.76 2k33 h PRO 73 Ca -0.45 -0.38 0.00 0.00 -0.87 0.00 0.00 66.00 64.29 2k33 h PRO 73 Cb 1.22 0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.36 2k33 h PRO 73 CO 0.74 1.00 0.00 1.97 -0.23 0.00 0.00 178.00 181.48 2k33 n PHE 74 N -4.03 0.00 -0.31 1.56 1.16 -1.26 -4.87 117.46 109.71 2k33 n PHE 74 Ca -0.02 0.00 0.04 0.00 -1.87 0.00 0.00 57.45 55.60 2k33 n PHE 74 Cb 0.54 0.10 -0.02 0.00 -1.61 0.00 0.00 39.48 38.50 2k33 n PHE 74 CO 0.00 0.00 0.00 -0.40 -1.87 0.00 0.00 176.76 174.49 2k33 n ASP 75 N 0.00 -1.84 0.00 5.98 5.75 -1.26 -4.38 116.55 120.80 2k33 n ASP 75 Ca 0.00 0.25 0.00 0.00 -0.01 0.00 0.00 54.79 55.03 2k33 n ASP 75 Cb 0.46 -1.04 0.00 0.00 -1.03 0.00 0.00 41.12 39.51 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 -2.78 0.38 3.51 6.12 0.00 -1.11 -4.89 105.19 106.42 2k33 n GLY 76 Ca -0.01 -1.64 -0.43 0.00 0.00 0.00 0.00 46.02 43.93 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 -2.77 4.84 0.31 2.61 2.01 -0.41 -2.22 115.64 120.00 2k33 s THR 77 Ca 0.00 0.03 -0.27 0.00 0.31 0.00 0.00 61.69 61.76 2k33 s THR 77 Cb 0.00 -4.21 -0.10 0.00 0.01 0.00 0.00 72.50 68.21 2k33 s THR 77 CO 0.00 -0.61 0.94 -0.51 -0.69 0.00 0.00 174.62 173.75 2k33 s ILE 78 N 2.77 4.18 0.00 1.82 2.07 -0.94 -0.06 121.20 131.04 2k33 s ILE 78 Ca 0.21 1.88 0.00 0.00 -1.41 0.00 0.00 60.65 61.33 2k33 s ILE 78 Cb -0.15 -4.08 0.00 0.00 0.13 0.00 0.00 42.46 38.37 2k33 s ILE 78 CO 0.18 0.21 0.00 0.61 -1.91 0.00 0.00 174.94 174.03 2k33 n GLY 79 N 0.75 1.35 3.90 1.50 0.00 -0.99 -1.35 105.19 110.35 2k33 n GLY 79 Ca 0.01 -1.69 -0.28 0.00 0.00 0.00 0.00 46.02 44.06 2k33 n GLY 79 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2k33 s ASP 80 N -1.00 6.36 -0.34 1.61 1.01 -1.26 -3.36 116.67 119.69 2k33 s ASP 80 Ca 0.00 0.95 -0.29 0.00 0.71 0.00 0.00 52.55 53.92 2k33 s ASP 80 Cb 0.00 -2.25 0.02 0.00 1.01 0.00 0.00 42.92 41.69 2k33 s ASP 80 CO 0.00 -0.48 1.15 0.00 0.21 0.00 0.00 175.17 176.05 2k33 s ALA 81 N -2.56 3.40 -0.03 5.23 0.00 -1.26 -4.75 121.76 121.79 2k33 s ALA 81 Ca 0.48 -0.09 0.08 0.00 0.00 0.00 0.00 51.96 52.43 2k33 s ALA 81 Cb -0.10 -3.74 -0.24 0.00 0.00 0.00 0.00 23.12 19.04 2k33 s ALA 81 CO 0.39 -1.69 0.70 1.25 0.00 0.00 0.00 175.76 176.41 2k33 h LEU 82 N 10.49 0.10-10.24 0.00 5.85 -1.87 -3.48 115.31 116.16 2k33 h LEU 82 Ca -0.22 -0.20 -0.49 0.00 0.84 0.00 0.00 57.88 57.82 2k33 h LEU 82 Cb 1.07 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 42.05 2k33 h LEU 82 CO 1.05 1.17 -0.34 0.68 -0.34 0.00 0.00 178.44 180.66 2k33 s VAL 83 N -2.60 2.64 0.17 1.05 -7.23 -1.24 -5.08 120.40 108.10 2k33 s VAL 83 Ca -0.07 -1.28 0.01 0.00 -1.81 0.00 0.00 61.98 58.83 2k33 s VAL 83 Cb 0.08 -2.92 -0.01 0.00 0.56 0.00 0.00 36.38 34.09 2k33 s VAL 83 CO 0.82 0.00 0.05 0.59 -0.31 0.00 0.00 175.10 176.25 2k33 n ASN 84 N -1.63 1.23 -4.84 4.85 3.02 -1.26 -5.09 115.26 111.53 2k33 n ASN 84 Ca 0.04 -1.86 -0.31 0.00 -0.03 0.00 0.00 54.58 52.42 2k33 n ASN 84 Cb 0.61 0.38 0.03 0.00 -0.61 0.00 0.00 39.78 40.20 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 -2.10 4.34 -1.51 2.41 -1.09 -1.26 -3.68 121.20 118.31 2k33 s ILE 85 Ca 0.07 0.76 0.00 0.00 -2.23 0.00 0.00 60.65 59.25 2k33 s ILE 85 Cb 0.00 -3.62 0.00 0.00 -1.58 0.00 0.00 42.46 37.27 2k33 s ILE 85 CO 0.05 -0.99 0.00 0.61 -1.23 0.00 0.00 174.94 173.38 2k33 n GLY 86 N -2.35 1.44 3.58 6.18 0.00 0.34 -4.91 105.19 109.47 2k33 n GLY 86 Ca 0.07 -0.20 -0.39 0.00 0.00 0.00 0.00 46.02 45.50 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 -2.71 6.15 -0.45 1.61 1.11 -1.24 -4.81 116.67 116.33 2k33 s ASP 87 Ca 0.00 0.02 -0.28 0.00 0.18 0.00 0.00 52.55 52.47 2k33 s ASP 87 Cb 0.00 -2.17 -0.01 0.00 1.07 0.00 0.00 42.92 41.80 2k33 s ASP 87 CO 0.00 -0.18 1.73 -0.47 1.18 0.00 0.00 175.17 177.42 2k33 s TYR 88 N 1.93 1.90 0.19 4.23 5.04 -1.26 -0.87 117.35 128.51 2k33 s TYR 88 Ca 0.11 0.67 -0.06 0.00 -2.44 0.00 0.00 57.07 55.35 2k33 s TYR 88 Cb -0.16 -4.17 -0.06 0.00 0.35 0.00 0.00 41.96 37.92 2k33 s TYR 88 CO 0.11 -2.52 0.45 0.14 -1.34 0.00 0.00 175.55 172.39 2k33 s VAL 89 N 7.25 5.08 -0.75 3.14 -7.23 0.23 -4.94 120.40 123.19 2k33 s VAL 89 Ca 0.71 0.15 0.03 0.00 -1.81 0.00 0.00 61.98 61.06 2k33 s VAL 89 Cb -0.17 -3.64 0.18 0.00 0.56 0.00 0.00 36.38 33.31 2k33 s VAL 89 CO 0.29 -0.05 0.56 -0.44 -0.31 0.00 0.00 175.10 175.15 2k33 s SER 90 N -2.53 5.15 0.35 4.85 0.01 -1.26 -2.06 113.70 118.21 2k33 s SER 90 Ca 0.43 -3.73 0.00 0.00 1.31 0.00 0.00 55.95 53.96 2k33 s SER 90 Cb -0.12 -1.73 0.00 0.00 0.21 0.00 0.00 66.02 64.39 2k33 s SER 90 CO 0.24 -0.13 0.00 0.00 0.41 0.00 0.00 173.24 173.76 2k33 n ALA 91 N 2.20 0.00 0.33 1.44 0.00 -1.06 -1.30 120.51 122.11 2k33 n ALA 91 Ca 0.19 0.00 0.19 0.00 0.00 0.00 0.00 53.44 53.82 2k33 n ALA 91 Cb 0.35 0.00 1.00 0.00 0.00 0.00 0.00 19.45 20.80 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 1.50 0.00 -0.28 0.00 0.87 -1.85 -0.73 113.55 113.06 2k33 h SER 92 Ca 0.00 0.00 0.06 0.00 -1.23 0.00 0.00 61.79 60.62 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 0.20 0.74 -0.53 0.00 0.00 176.83 177.24 2k33 h THR 93 N 0.00 0.90 -3.42 2.23 2.02 -1.61 -3.36 112.91 109.67 2k33 h THR 93 Ca 0.01 -0.03 -0.73 0.00 0.77 0.00 0.00 66.41 66.43 2k33 h THR 93 Cb 0.37 0.81 -0.23 0.00 -1.74 0.00 0.00 68.15 67.36 2k33 h THR 93 CO -0.00 0.02 -0.40 -0.89 0.37 0.00 0.00 175.52 174.61 2k33 s THR 94 N -5.12 4.99 -0.06 3.16 2.01 -0.28 -4.93 115.64 115.41 2k33 s THR 94 Ca -0.06 -0.99 -0.26 0.00 0.31 0.00 0.00 61.69 60.70 2k33 s THR 94 Cb 0.18 -3.91 -0.03 0.00 0.01 0.00 0.00 72.50 68.75 2k33 s THR 94 CO 0.70 -0.45 0.80 -1.61 -0.69 0.00 0.00 174.62 173.37 2k33 s GLU 95 N 1.60 4.45 -0.20 4.92 2.02 -1.26 -4.45 118.70 125.78 2k33 s GLU 95 Ca 0.04 1.05 -0.15 0.00 0.02 0.00 0.00 54.97 55.93 2k33 s GLU 95 Cb -0.22 -3.47 -0.08 0.00 0.10 0.00 0.00 34.13 30.46 2k33 s GLU 95 CO 0.07 -0.03 -0.33 1.47 0.02 0.00 0.00 175.26 176.47 2k33 n LEU 96 N 4.03 1.84 -3.67 1.80 -0.00 -1.25 -4.76 117.00 114.99 2k33 n LEU 96 Ca 0.02 0.31 -0.14 0.00 -0.00 0.00 0.00 56.01 56.20 2k33 n LEU 96 Cb 0.51 -0.73 -0.08 0.00 -0.00 0.00 0.00 43.42 43.12 2k33 n LEU 96 CO 0.49 0.09 0.24 -0.69 -0.00 0.00 0.00 177.39 177.52 2k33 s VAL 97 N -2.66 0.01 0.17 1.47 1.01 -1.26 -2.58 120.40 116.55 2k33 s VAL 97 Ca -0.31 -0.05 0.04 0.00 0.00 0.00 0.00 61.98 61.65 2k33 s VAL 97 Cb 0.08 -0.79 -0.04 0.00 0.00 0.00 0.00 36.38 35.64 2k33 s VAL 97 CO 0.42 -0.03 0.25 0.00 0.00 0.00 0.00 175.10 175.75 2k33 s ARG 98 N -0.08 3.29 -0.08 2.72 3.03 -1.26 -0.96 118.95 125.60 2k33 s ARG 98 Ca -0.03 -0.70 0.05 0.00 2.03 0.00 0.00 55.73 57.07 2k33 s ARG 98 Cb -0.03 -2.86 -0.01 0.00 -1.03 0.00 0.00 34.95 31.02 2k33 s ARG 98 CO 0.02 0.50 -0.23 0.08 -1.13 0.00 0.00 175.30 174.54 2k33 s VAL 99 N -1.79 2.16 0.44 4.99 1.01 0.11 -2.35 120.40 124.98 2k33 s VAL 99 Ca 0.34 -1.00 0.08 0.00 0.00 0.00 0.00 61.98 61.39 2k33 s VAL 99 Cb -0.10 -1.81 0.01 0.00 0.00 0.00 0.00 36.38 34.47 2k33 s VAL 99 CO 0.27 0.56 0.55 0.42 0.00 0.00 0.00 175.10 176.90 2k33 s THR 100 N 0.09 2.82 -0.19 3.92 -4.23 0.91 -2.58 115.64 116.39 2k33 s THR 100 Ca -0.11 -1.08 -0.02 0.00 -1.18 0.00 0.00 61.69 59.30 2k33 s THR 100 Cb -0.16 -2.91 0.00 0.00 1.34 0.00 0.00 72.50 70.78 2k33 s THR 100 CO 0.06 0.00 0.07 -3.20 -0.54 0.00 0.00 174.62 171.01 2k33 n ASN 101 N -1.82 -5.41 0.05 3.99 5.15 -1.26 -1.29 115.26 114.66 2k33 n ASN 101 Ca 0.08 0.71 0.00 0.00 -0.60 0.00 0.00 54.58 54.76 2k33 n ASN 101 Cb 0.60 -3.47 0.00 0.00 -0.53 0.00 0.00 39.78 36.38 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 0.23 -0.81 -4.71 1.20 -0.00 -1.26 -4.46 117.00 107.19 2k33 n LEU 102 Ca 0.01 0.38 -0.26 0.00 -0.00 0.00 0.00 56.01 56.15 2k33 n LEU 102 Cb 0.06 1.02 -0.07 0.00 -0.00 0.00 0.00 43.42 44.42 2k33 n LEU 102 CO 0.26 0.00 -0.29 0.20 -0.00 0.00 0.00 177.39 177.56 2k33 s ASN 103 N -1.60 5.00 1.20 1.96 0.01 -1.26 -5.02 114.94 115.23 2k33 s ASN 103 Ca 0.00 -0.33 -0.19 0.00 -0.71 0.00 0.00 52.86 51.62 2k33 s ASN 103 Cb 0.00 -1.14 0.28 0.00 0.41 0.00 0.00 41.25 40.80 2k33 s ASN 103 CO 0.00 0.07 1.11 -2.16 -1.51 0.00 0.00 177.10 174.61 2k33 s PRO 104 N -3.10 -1.19 -0.01 -0.60 0.04 -1.26 -4.07 135.00 124.81 2k33 s PRO 104 Ca 0.29 -0.07 -0.04 0.00 0.04 0.00 0.00 61.00 61.22 2k33 s PRO 104 Cb -0.09 -1.60 0.00 0.00 0.04 0.00 0.00 34.50 32.85 2k33 s PRO 104 CO 0.20 -3.69 0.09 0.42 0.04 0.00 0.00 177.00 174.06 2k33 s ILE 105 N -3.01 0.05 -0.41 0.56 -1.09 -1.26 -4.50 121.20 111.53 2k33 s ILE 105 Ca 0.71 -0.40 0.06 0.00 -2.23 0.00 0.00 60.65 58.79 2k33 s ILE 105 Cb -0.10 -0.27 0.32 0.00 -1.58 0.00 0.00 42.46 40.83 2k33 s ILE 105 CO 0.56 -0.22 1.22 0.00 -1.23 0.00 0.00 174.94 175.26 2k33 n TYR 106 N 2.22 -2.21 -3.64 3.97 4.11 -1.26 -5.11 117.16 115.24 2k33 n TYR 106 Ca -0.18 -1.75 -0.04 0.00 -0.00 0.00 0.00 57.90 55.92 2k33 n TYR 106 Cb 0.57 1.52 -0.07 0.00 -0.00 0.00 0.00 39.34 41.37 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 0.20 -2.20 0.00 -3.48 0.00 -1.26 -5.02 121.76 110.00 2k33 s ALA 107 Ca 0.21 1.99 0.00 0.00 0.00 0.00 0.00 51.96 54.15 2k33 s ALA 107 Cb 0.30 -1.65 0.00 0.00 0.00 0.00 0.00 23.12 21.77 2k33 s ALA 107 CO -0.08 -0.27 0.00 -3.47 0.00 0.00 0.00 175.76 171.94 2k33 n ASP 108 N 2.80 0.00 0.00 0.00 -0.08 -1.26 -4.79 116.55 113.22 2k33 n ASP 108 Ca -0.15 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.13 2k33 n ASP 108 Cb 0.57 0.00 0.00 0.00 2.34 0.00 0.00 41.12 44.03 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 0.00 -0.15 0.13 0.27 0.00 -1.26 -4.94 105.19 99.24 2k33 n GLY 109 Ca 0.00 -0.42 -0.18 0.00 0.00 0.00 0.00 46.02 45.42 2k33 n GLY 109 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2k33 n SER 110 N 0.00 1.85 -2.30 1.61 7.64 -1.26 -4.93 113.62 116.22 2k33 n SER 110 Ca 0.00 -0.04 -0.03 0.00 1.01 0.00 0.00 58.87 59.81 2k33 n SER 110 Cb 0.00 -0.40 -0.02 0.00 -1.01 0.00 0.00 64.21 62.77 2k33 n SER 110 CO 0.00 0.00 0.00 1.57 -3.01 0.00 0.00 175.04 173.60 2k33 n HIS 111 N -3.27 -3.98 -1.15 1.43 -0.00 -1.26 -4.89 115.22 102.10 2k33 n HIS 111 Ca -0.41 2.34 -0.16 0.00 0.46 0.00 0.00 57.72 59.95 2k33 n HIS 111 Cb 1.02 -3.58 0.24 0.00 -0.12 0.00 0.00 29.99 27.55 2k33 n HIS 111 CO 0.00 0.00 0.00 0.72 0.46 0.00 0.00 176.34 177.52 2k33 n HIS 112 N 1.50 2.78 -4.32 1.57 8.25 -1.26 -4.91 115.22 118.84 2k33 n HIS 112 Ca -0.20 -1.56 -0.38 0.00 -0.26 0.00 0.00 57.72 55.31 2k33 n HIS 112 Cb 0.32 -0.83 -0.06 0.00 1.12 0.00 0.00 29.99 30.53 2k33 n HIS 112 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 2k33 n HIS 113 N -0.70 -1.32 -0.00 4.41 1.44 -1.26 -4.80 115.22 112.99 2k33 n HIS 113 Ca 0.51 0.65 -0.18 0.00 -2.01 0.00 0.00 57.72 56.69 2k33 n HIS 113 Cb 1.54 -1.96 -0.09 0.00 0.12 0.00 0.00 29.99 29.60 2k33 n HIS 113 CO 0.00 0.00 0.00 1.25 -2.81 0.00 0.00 176.34 174.78 2k33 h HIS 114 N -0.89 0.85 -0.10 -1.40 6.17 -2.02 -3.34 115.15 114.41 2k33 h HIS 114 Ca -0.55 -0.42 -0.13 0.00 0.71 0.00 0.00 60.37 59.97 2k33 h HIS 114 Cb 1.36 -0.11 -0.21 0.00 2.52 0.00 0.00 27.41 30.96 2k33 h HIS 114 CO 0.71 1.24 -0.77 1.58 0.71 0.00 0.00 177.93 181.40 2k33 n HIS 115 N -4.07 0.36 -1.14 5.26 -0.00 -1.26 -5.30 115.22 109.06 2k33 n HIS 115 Ca -0.09 -1.26 0.00 0.00 -0.00 0.00 0.00 57.72 56.37 2k33 n HIS 115 Cb 0.73 -0.22 0.00 0.00 -0.00 0.00 0.00 29.99 30.49 2k33 n HIS 115 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 176.34 177.92