#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 0.25 -0.07 2.12 1.01 -1.03 -5.03 120.40 117.65 2k33 s VAL 2 Ca 0.00 -0.74 0.04 0.00 0.00 0.00 0.00 61.98 61.28 2k33 s VAL 2 Cb 0.00 -0.33 -0.02 0.00 0.00 0.00 0.00 36.38 36.04 2k33 s VAL 2 CO 0.00 -0.32 -0.19 -0.63 0.00 0.00 0.00 175.10 173.95 2k33 s ILE 3 N -1.06 2.55 -0.14 2.22 1.01 -1.26 0.34 121.20 124.86 2k33 s ILE 3 Ca -0.10 -0.88 -0.29 0.00 0.00 0.00 0.00 60.65 59.38 2k33 s ILE 3 Cb -0.08 -1.98 -0.02 0.00 0.01 0.00 0.00 42.46 40.39 2k33 s ILE 3 CO -0.00 0.57 1.31 -0.63 0.00 0.00 0.00 174.94 176.18 2k33 s ILE 4 N -0.19 4.17 0.02 2.92 1.01 -0.58 -4.85 121.20 123.71 2k33 s ILE 4 Ca -0.02 1.43 0.04 0.00 0.00 0.00 0.00 60.65 62.11 2k33 s ILE 4 Cb -0.13 -3.92 -0.02 0.00 0.01 0.00 0.00 42.46 38.39 2k33 s ILE 4 CO 0.03 -0.11 -0.13 -0.54 0.00 0.00 0.00 174.94 174.19 2k33 s LYS 5 N 3.42 0.92 0.00 2.79 -0.14 -1.26 -4.39 119.74 121.09 2k33 s LYS 5 Ca 0.57 -0.63 0.00 0.00 -1.36 0.00 0.00 55.97 54.55 2k33 s LYS 5 Cb -0.24 -0.91 0.00 0.00 -1.68 0.00 0.00 37.83 35.01 2k33 s LYS 5 CO 0.17 0.23 0.00 -0.35 -0.76 0.00 0.00 175.35 174.65 2k33 n PRO 6 N 2.21 -0.44 0.00 -1.68 -0.04 -1.26 -4.93 135.00 128.86 2k33 n PRO 6 Ca -0.17 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.30 2k33 n PRO 6 Cb 0.55 0.00 -0.00 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 -1.07 2.61 -3.42 0.54 7.27 -1.26 -4.20 117.38 117.84 2k33 n GLN 7 Ca 0.00 -0.29 -0.10 0.00 0.07 0.00 0.00 57.00 56.68 2k33 n GLN 7 Cb 0.00 -0.79 -0.01 0.00 2.41 0.00 0.00 30.24 31.85 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 -0.44 0.00 -4.64 1.69 0.24 -1.26 -4.87 118.33 109.05 2k33 n VAL 8 Ca 0.00 -1.20 -0.33 0.00 -2.04 0.00 0.00 64.34 60.78 2k33 n VAL 8 Cb 0.01 0.86 -0.16 0.00 -1.47 0.00 0.00 33.84 33.09 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 -2.74 3.45 0.00 -1.34 1.04 -1.26 -3.86 113.70 108.99 2k33 s SER 9 Ca 0.19 -0.51 0.00 0.00 0.48 0.00 0.00 55.95 56.11 2k33 s SER 9 Cb -0.02 -1.51 0.00 0.00 0.10 0.00 0.00 66.02 64.58 2k33 s SER 9 CO 0.14 0.09 0.00 0.61 0.98 0.00 0.00 173.24 175.06 2k33 n GLY 10 N 3.99 1.84 2.95 7.32 0.00 -0.53 -4.76 105.19 115.99 2k33 n GLY 10 Ca -0.19 0.28 -0.13 0.00 0.00 0.00 0.00 46.02 45.98 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 1.99 -0.02 0.31 1.61 1.01 -0.94 -0.27 120.40 124.10 2k33 s VAL 11 Ca 0.00 0.06 -0.29 0.00 0.00 0.00 0.00 61.98 61.74 2k33 s VAL 11 Cb 0.00 -0.16 -0.12 0.00 0.00 0.00 0.00 36.38 36.10 2k33 s VAL 11 CO 0.00 0.02 1.36 -0.38 0.00 0.00 0.00 175.10 176.11 2k33 n ILE 12 N 3.37 1.63 -0.05 2.22 2.08 -0.88 -0.99 119.36 126.73 2k33 n ILE 12 Ca -0.16 -0.41 -0.07 0.00 0.56 0.00 0.00 62.75 62.67 2k33 n ILE 12 Cb 0.57 -1.61 -0.05 0.00 -0.75 0.00 0.00 39.64 37.79 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 0.93 0.60 -3.82 1.39 0.31 0.12 -2.26 118.33 115.60 2k33 n VAL 13 Ca 0.07 -0.26 -0.02 0.00 -0.01 0.00 0.00 64.34 64.11 2k33 n VAL 13 Cb 0.35 -0.85 0.01 0.00 -0.91 0.00 0.00 33.84 32.43 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 -4.79 -0.06 -0.20 4.52 2.47 -1.24 -4.80 114.94 110.84 2k33 s ASN 14 Ca -0.12 -0.50 -0.04 0.00 0.42 0.00 0.00 52.86 52.62 2k33 s ASN 14 Cb 0.03 0.44 0.09 0.00 -1.45 0.00 0.00 41.25 40.37 2k33 s ASN 14 CO 0.27 -0.85 0.22 -1.59 -3.72 0.00 0.00 177.10 171.43 2k33 s LYS 15 N -2.54 0.19 -0.95 0.43 -2.85 -1.26 -1.50 119.74 111.26 2k33 s LYS 15 Ca 0.18 0.18 -0.01 0.00 -1.00 0.00 0.00 55.97 55.32 2k33 s LYS 15 Cb -0.01 -1.22 0.33 0.00 -2.06 0.00 0.00 37.83 34.87 2k33 s LYS 15 CO 0.03 -0.67 1.89 1.28 0.10 0.00 0.00 175.35 177.98 2k33 n LEU 16 N 5.32 7.38 -4.11 2.77 4.77 0.12 -4.94 117.00 128.30 2k33 n LEU 16 Ca -0.05 -5.19 -0.12 0.00 -0.03 0.00 0.00 56.01 50.62 2k33 n LEU 16 Cb 0.49 -1.12 -0.07 0.00 -2.33 0.00 0.00 43.42 40.39 2k33 n LEU 16 CO 0.08 1.95 -0.01 0.72 -1.33 0.00 0.00 177.39 178.80 2k33 s PHE 17 N -4.23 0.90 0.17 -1.77 -0.71 -1.22 -4.22 117.98 106.91 2k33 s PHE 17 Ca 0.44 -1.15 0.07 0.00 -1.04 0.00 0.00 56.93 55.24 2k33 s PHE 17 Cb 0.29 -0.22 -0.04 0.00 -1.21 0.00 0.00 43.02 41.83 2k33 s PHE 17 CO -0.24 -0.87 -0.13 0.15 -1.34 0.00 0.00 175.22 172.78 2k33 s LYS 18 N -3.85 1.21 -0.49 1.99 -0.14 -1.26 -5.11 119.74 112.08 2k33 s LYS 18 Ca 0.32 -1.49 -0.23 0.00 -1.36 0.00 0.00 55.97 53.20 2k33 s LYS 18 Cb 0.03 -0.96 0.03 0.00 -1.68 0.00 0.00 37.83 35.25 2k33 s LYS 18 CO 0.14 0.16 0.85 0.00 -0.76 0.00 0.00 175.35 175.73 2k33 s ALA 19 N -2.91 3.24 0.00 5.17 0.00 -1.26 -3.59 121.76 122.42 2k33 s ALA 19 Ca 0.19 -1.12 0.00 0.00 0.00 0.00 0.00 51.96 51.03 2k33 s ALA 19 Cb -0.01 -3.58 0.00 0.00 0.00 0.00 0.00 23.12 19.54 2k33 s ALA 19 CO 0.04 -2.11 0.00 0.41 0.00 0.00 0.00 175.76 174.10 2k33 n GLY 20 N 5.04 1.00 4.03 0.00 0.00 -0.85 -4.93 105.19 109.48 2k33 n GLY 20 Ca 0.02 -0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.83 2k33 n GLY 20 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2k33 s ASP 21 N -2.00 4.93 0.33 1.61 2.15 -1.23 -4.86 116.67 117.60 2k33 s ASP 21 Ca 0.00 -0.79 0.04 0.00 0.43 0.00 0.00 52.55 52.23 2k33 s ASP 21 Cb 0.00 0.30 -0.02 0.00 -0.30 0.00 0.00 42.92 42.90 2k33 s ASP 21 CO 0.00 -1.47 0.49 -0.54 -0.17 0.00 0.00 175.17 173.48 2k33 s LYS 22 N -4.77 3.25 0.45 4.34 1.02 -1.26 -0.38 119.74 122.40 2k33 s LYS 22 Ca 0.63 -0.74 0.03 0.00 0.02 0.00 0.00 55.97 55.91 2k33 s LYS 22 Cb -0.05 -2.77 -0.03 0.00 -0.52 0.00 0.00 37.83 34.46 2k33 s LYS 22 CO 0.40 0.12 0.03 0.14 -0.92 0.00 0.00 175.35 175.12 2k33 s VAL 23 N -2.21 1.22 0.02 3.17 -7.23 -0.25 -4.78 120.40 110.34 2k33 s VAL 23 Ca 0.42 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.59 2k33 s VAL 23 Cb -0.09 -2.43 -0.01 0.00 0.56 0.00 0.00 36.38 34.40 2k33 s VAL 23 CO 0.33 0.00 -0.04 -0.75 -0.31 0.00 0.00 175.10 174.33 2k33 s LYS 24 N -3.81 0.29 -0.62 4.82 2.47 -1.26 -2.35 119.74 119.28 2k33 s LYS 24 Ca 0.18 -0.44 -0.26 0.00 -1.56 0.00 0.00 55.97 53.89 2k33 s LYS 24 Cb 0.04 -0.06 -0.11 0.00 -1.46 0.00 0.00 37.83 36.24 2k33 s LYS 24 CO 0.10 0.00 2.44 1.17 0.16 0.00 0.00 175.35 179.22 2k33 n LYS 25 N 2.09 0.80 0.00 4.03 4.81 -1.26 -0.00 118.16 128.62 2k33 n LYS 25 Ca -0.20 -0.19 0.00 0.00 -0.87 0.00 0.00 58.31 57.05 2k33 n LYS 25 Cb 0.57 -3.24 0.00 0.00 0.02 0.00 0.00 35.03 32.37 2k33 n LYS 25 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2k33 n GLY 26 N 6.22 1.02 3.70 3.14 0.00 -0.93 -4.92 105.19 113.41 2k33 n GLY 26 Ca 0.43 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 46.05 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 -0.48 4.34 0.33 1.61 0.74 1.00 -4.77 119.66 122.42 2k33 s GLN 27 Ca 0.00 0.72 -0.29 0.00 0.05 0.00 0.00 55.36 55.85 2k33 s GLN 27 Cb 0.00 -3.49 -0.11 0.00 1.10 0.00 0.00 33.01 30.51 2k33 s GLN 27 CO 0.00 -0.04 1.48 0.99 -0.55 0.00 0.00 175.29 177.17 2k33 s THR 28 N 1.20 2.24 0.00 -0.34 2.01 -1.26 -0.77 115.64 118.72 2k33 s THR 28 Ca 0.33 0.23 0.00 0.00 0.31 0.00 0.00 61.69 62.55 2k33 s THR 28 Cb -0.17 -3.14 0.00 0.00 0.01 0.00 0.00 72.50 69.20 2k33 s THR 28 CO 0.14 0.05 0.00 0.18 -0.69 0.00 0.00 174.62 174.30 2k33 n LEU 29 N 1.18 0.41 -4.35 4.42 4.77 -0.68 -4.60 117.00 118.15 2k33 n LEU 29 Ca 0.03 0.00 -0.19 0.00 -0.03 0.00 0.00 56.01 55.82 2k33 n LEU 29 Cb 0.39 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.39 2k33 n LEU 29 CO 0.63 0.07 -0.20 -0.36 -1.33 0.00 0.00 177.39 176.19 2k33 s PHE 30 N -1.17 1.62 -0.16 -1.77 0.40 -1.01 0.12 117.98 116.01 2k33 s PHE 30 Ca 0.00 -1.34 -0.14 0.00 -0.60 0.00 0.00 56.93 54.86 2k33 s PHE 30 Cb 0.00 -0.89 0.04 0.00 0.51 0.00 0.00 43.02 42.68 2k33 s PHE 30 CO 0.00 -0.48 0.41 0.42 0.70 0.00 0.00 175.22 176.27 2k33 s ILE 31 N -3.59 -0.00 -0.02 0.64 1.01 -0.56 0.15 121.20 118.83 2k33 s ILE 31 Ca 0.35 0.01 0.00 0.00 0.00 0.00 0.00 60.65 61.01 2k33 s ILE 31 Cb 0.05 -0.58 0.02 0.00 0.01 0.00 0.00 42.46 41.97 2k33 s ILE 31 CO 0.17 0.00 0.02 -0.63 0.00 0.00 0.00 174.94 174.50 2k33 s ILE 32 N 0.36 -0.01 -0.13 2.92 1.01 -0.60 0.12 121.20 124.87 2k33 s ILE 32 Ca -0.01 0.15 -0.11 0.00 0.00 0.00 0.00 60.65 60.68 2k33 s ILE 32 Cb -0.04 -0.09 -0.05 0.00 0.01 0.00 0.00 42.46 42.29 2k33 s ILE 32 CO -0.01 0.08 0.23 -0.70 0.00 0.00 0.00 174.94 174.54 2k33 s GLU 33 N 0.84 3.94 0.19 2.79 -6.30 -0.16 0.17 118.70 120.17 2k33 s GLU 33 Ca -0.07 0.01 -0.09 0.00 -2.50 0.00 0.00 54.97 52.32 2k33 s GLU 33 Cb -0.10 -3.32 -0.01 0.00 0.00 0.00 0.00 34.13 30.69 2k33 s GLU 33 CO -0.02 0.49 0.31 1.14 0.02 0.00 0.00 175.26 177.19 2k33 s GLN 34 N -0.25 1.24 -0.44 4.30 0.00 -1.17 -2.21 119.66 121.13 2k33 s GLN 34 Ca 0.15 -1.25 -0.03 0.00 -0.00 0.00 0.00 55.36 54.24 2k33 s GLN 34 Cb -0.13 0.38 0.14 0.00 0.00 0.00 0.00 33.01 33.41 2k33 s GLN 34 CO 0.04 -0.46 2.47 -0.25 0.00 0.00 0.00 175.29 177.08 2k33 n ASP 35 N -0.26 6.59 -2.98 12.60 8.00 -1.26 -4.00 116.55 135.25 2k33 n ASP 35 Ca -0.05 -3.23 0.03 0.00 0.71 0.00 0.00 54.79 52.26 2k33 n ASP 35 Cb 0.63 -1.16 0.00 0.00 -0.02 0.00 0.00 41.12 40.58 2k33 n ASP 35 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2k33 s GLN 36 N -1.98 0.24 -0.59 -1.24 0.00 -1.26 -5.03 119.66 109.81 2k33 s GLN 36 Ca 0.51 0.04 0.00 0.00 -0.00 0.00 0.00 55.36 55.91 2k33 s GLN 36 Cb 0.35 0.06 0.52 0.00 0.00 0.00 0.00 33.01 33.94 2k33 s GLN 36 CO -0.15 -0.39 1.98 0.00 0.00 0.00 0.00 175.29 176.73 2k33 n ALA 37 N 4.42 6.05 -0.94 2.60 0.00 -1.26 -5.03 120.51 126.36 2k33 n ALA 37 Ca 0.08 -3.29 0.12 0.00 0.00 0.00 0.00 53.44 50.35 2k33 n ALA 37 Cb 0.60 -1.63 -0.05 0.00 0.00 0.00 0.00 19.45 18.36 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 -1.00 -5.35 -0.90 0.00 7.64 -1.26 -2.52 113.62 110.23 2k33 n SER 38 Ca 0.61 0.81 0.10 0.00 1.01 0.00 0.00 58.87 61.40 2k33 n SER 38 Cb 1.01 -3.13 0.15 0.00 -1.01 0.00 0.00 64.21 61.23 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 -3.60 2.09 -2.64 1.43 4.01 -1.26 -4.51 118.16 113.68 2k33 n LYS 39 Ca -0.04 -1.95 -0.02 0.00 -0.51 0.00 0.00 58.31 55.79 2k33 n LYS 39 Cb 0.44 -1.41 0.12 0.00 -0.51 0.00 0.00 35.03 33.68 2k33 n LYS 39 CO 0.00 0.00 0.00 -3.47 -1.11 0.00 0.00 177.40 172.82 2k33 n ASP 40 N 1.15 -1.38 0.06 4.39 -0.08 -1.26 -5.00 116.55 114.42 2k33 n ASP 40 Ca 0.15 -2.21 0.00 0.00 -1.51 0.00 0.00 54.79 51.22 2k33 n ASP 40 Cb 0.51 0.65 0.00 0.00 2.34 0.00 0.00 41.12 44.62 2k33 n ASP 40 CO 0.00 0.00 0.00 0.33 0.12 0.00 0.00 177.20 177.65 2k33 n PHE 41 N -1.50 -0.86 -1.95 -0.67 7.35 -1.26 -5.09 117.46 113.48 2k33 n PHE 41 Ca -0.18 0.15 -0.40 0.00 -0.76 0.00 0.00 57.45 56.27 2k33 n PHE 41 Cb 0.87 0.36 -0.00 0.00 0.35 0.00 0.00 39.48 41.07 2k33 n PHE 41 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 2k33 s ASN 42 N -4.82 6.31 0.00 -2.13 4.22 -1.05 -4.92 114.94 112.55 2k33 s ASN 42 Ca 0.00 2.81 0.20 0.00 -2.14 0.00 0.00 52.86 53.74 2k33 s ASN 42 Cb 0.00 -2.65 0.15 0.00 1.28 0.00 0.00 41.25 40.03 2k33 s ASN 42 CO 0.00 -0.86 1.14 -2.11 -2.04 0.00 0.00 177.10 173.23 2k33 n ARG 43 N 0.27 1.82 -1.33 3.55 1.85 -1.26 -5.03 116.66 116.54 2k33 n ARG 43 Ca 0.03 -1.68 0.16 0.00 -1.00 0.00 0.00 57.85 55.36 2k33 n ARG 43 Cb 0.42 -1.39 -0.09 0.00 -1.05 0.00 0.00 32.46 30.35 2k33 n ARG 43 CO 0.00 0.00 0.00 0.45 -0.01 0.00 0.00 177.63 178.07 2k33 n SER 44 N 1.09 -7.22 0.09 2.89 2.88 -1.26 -4.55 113.62 107.54 2k33 n SER 44 Ca 0.12 1.34 -0.14 0.00 -1.33 0.00 0.00 58.87 58.85 2k33 n SER 44 Cb 0.51 -4.56 -0.07 0.00 -0.75 0.00 0.00 64.21 59.33 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 -1.31 -0.59 0.00 -1.46 6.56 -1.99 -3.46 116.57 114.33 2k33 h LYS 45 Ca -0.18 0.04 -0.41 0.00 -1.06 0.00 0.00 60.65 59.04 2k33 h LYS 45 Cb 1.27 0.13 -0.11 0.00 -0.57 0.00 0.00 32.23 32.96 2k33 h LYS 45 CO 0.07 -0.39 -0.35 0.00 -2.06 0.00 0.00 179.45 176.71 2k33 n ALA 46 N -2.86 0.35 -3.95 3.86 0.00 -1.26 -5.19 120.51 111.46 2k33 n ALA 46 Ca -0.06 -1.82 -0.00 0.00 0.00 0.00 0.00 53.44 51.55 2k33 n ALA 46 Cb 0.37 1.47 -0.00 0.00 0.00 0.00 0.00 19.45 21.29 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 0.00 0.00 -3.22 0.00 4.32 -1.26 -5.09 117.00 111.75 2k33 n LEU 47 Ca 0.05 -0.04 -0.26 0.00 -0.02 0.00 0.00 56.01 55.73 2k33 n LEU 47 Cb 0.59 0.01 -0.06 0.00 -1.62 0.00 0.00 43.42 42.34 2k33 n LEU 47 CO 0.30 -0.01 0.07 2.22 -1.22 0.00 0.00 177.39 178.76 2k33 n PHE 48 N -0.02 3.47 0.29 -1.77 -1.74 -1.26 -4.88 117.46 111.56 2k33 n PHE 48 Ca -0.00 -4.05 0.19 0.00 -0.56 0.00 0.00 57.45 53.02 2k33 n PHE 48 Cb 0.01 -0.52 0.97 0.00 1.52 0.00 0.00 39.48 41.46 2k33 n PHE 48 CO 0.00 0.00 0.00 0.77 -0.56 0.00 0.00 176.76 176.97 2k33 h SER 49 N 3.66 0.00 -0.04 5.98 0.02 -2.02 -3.46 113.55 117.69 2k33 h SER 49 Ca 0.16 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.11 2k33 h SER 49 Cb 0.62 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.16 2k33 h SER 49 CO 0.80 0.00 0.00 1.67 -1.14 0.00 0.00 176.83 178.16 2k33 n GLN 50 N -3.27 0.00 -0.96 3.45 7.27 -1.26 -5.02 117.38 117.58 2k33 n GLN 50 Ca -0.01 0.00 -0.29 0.00 0.07 0.00 0.00 57.00 56.77 2k33 n GLN 50 Cb 0.25 0.00 -0.02 0.00 2.41 0.00 0.00 30.24 32.88 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 -0.04 5.82 -0.03 1.69 7.64 -1.26 -4.13 113.62 123.32 2k33 n SER 51 Ca 0.00 -2.43 0.04 0.00 1.01 0.00 0.00 58.87 57.49 2k33 n SER 51 Cb 0.00 -1.25 -0.14 0.00 -1.01 0.00 0.00 64.21 61.82 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 4.32 2.36 -0.13 -0.43 0.00 -1.26 -4.55 120.51 120.82 2k33 n ALA 52 Ca 0.55 -0.61 0.00 0.00 0.00 0.00 0.00 53.44 53.38 2k33 n ALA 52 Cb 0.19 -0.46 0.00 0.00 0.00 0.00 0.00 19.45 19.17 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 -2.25 0.00 -3.47 0.00 -5.35 -1.26 -5.05 119.36 101.98 2k33 n ILE 53 Ca -0.10 -0.40 -0.17 0.00 -0.27 0.00 0.00 62.75 61.82 2k33 n ILE 53 Cb 0.62 1.13 0.01 0.00 -1.74 0.00 0.00 39.64 39.66 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 -0.30 -6.16 0.28 7.28 7.64 -1.26 -4.26 113.62 116.84 2k33 n SER 54 Ca 0.00 -0.63 0.18 0.00 1.01 0.00 0.00 58.87 59.43 2k33 n SER 54 Cb 0.03 -3.57 0.90 0.00 -1.01 0.00 0.00 64.21 60.56 2k33 n SER 54 CO 0.00 0.00 0.00 -0.61 -3.01 0.00 0.00 175.04 171.42 2k33 h GLN 55 N -0.40 0.00 -1.09 1.43 4.15 -1.94 0.35 115.11 117.61 2k33 h GLN 55 Ca -0.40 0.00 0.29 0.00 0.77 0.00 0.00 58.65 59.32 2k33 h GLN 55 Cb 1.23 0.00 -0.09 0.00 0.21 0.00 0.00 27.48 28.84 2k33 h GLN 55 CO 0.37 0.00 0.72 1.57 -1.93 0.00 0.00 178.83 179.56 2k33 h LYS 56 N 0.00 0.27 0.00 1.69 2.10 -2.02 -3.15 116.57 115.47 2k33 h LYS 56 Ca 0.04 -0.02 0.00 0.00 -2.00 0.00 0.00 60.65 58.67 2k33 h LYS 56 Cb 0.54 -0.06 0.00 0.00 -0.90 0.00 0.00 32.23 31.81 2k33 h LYS 56 CO -0.00 0.18 -0.19 0.39 -2.00 0.00 0.00 179.45 177.83 2k33 n GLU 57 N -4.53 0.00 -0.42 0.07 1.02 -0.62 -5.13 120.64 111.02 2k33 n GLU 57 Ca 0.26 -0.39 -0.26 0.00 -0.02 0.00 0.00 57.16 56.75 2k33 n GLU 57 Cb 1.00 -0.20 0.22 0.00 -0.02 0.00 0.00 31.44 32.44 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 0.00 -2.69 -2.92 -0.32 4.11 0.11 -4.97 117.16 110.49 2k33 n TYR 58 Ca 0.00 -0.33 -0.32 0.00 -0.00 0.00 0.00 57.90 57.25 2k33 n TYR 58 Cb 0.58 -1.42 -0.05 0.00 -0.00 0.00 0.00 39.34 38.44 2k33 n TYR 58 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.86 176.35 2k33 s ASP 59 N -2.44 6.75 -0.02 9.48 1.11 -1.26 -4.99 116.67 125.30 2k33 s ASP 59 Ca 0.54 1.39 0.18 0.00 0.18 0.00 0.00 52.55 54.84 2k33 s ASP 59 Cb -0.11 -2.42 -0.20 0.00 1.07 0.00 0.00 42.92 41.25 2k33 s ASP 59 CO 0.50 -0.33 0.57 -1.54 1.18 0.00 0.00 175.17 175.55 2k33 n SER 60 N -0.75 0.49 0.27 0.27 3.41 -1.26 -4.09 113.62 111.95 2k33 n SER 60 Ca 0.05 0.21 0.16 0.00 -0.26 0.00 0.00 58.87 59.03 2k33 n SER 60 Cb 0.54 0.71 0.92 0.00 -0.26 0.00 0.00 64.21 66.11 2k33 n SER 60 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 2k33 h SER 61 N 0.00 0.00 -0.23 4.04 0.02 -1.96 0.28 113.55 115.69 2k33 h SER 61 Ca -0.23 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.72 2k33 h SER 61 Cb 1.65 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.19 2k33 h SER 61 CO 0.03 0.00 0.00 0.00 -1.14 0.00 0.00 176.83 175.72 2k33 n LEU 62 N -3.73 1.46 -3.10 5.07 -0.00 -1.26 -4.16 117.00 111.28 2k33 n LEU 62 Ca -0.01 -0.69 -0.17 0.00 -0.00 0.00 0.00 56.01 55.14 2k33 n LEU 62 Cb 0.17 -0.15 -0.01 0.00 -0.00 0.00 0.00 43.42 43.43 2k33 n LEU 62 CO 0.26 0.34 -0.13 0.00 -0.00 0.00 0.00 177.39 177.87 2k33 n ALA 63 N 0.25 1.48 -3.48 1.47 0.00 0.97 -4.76 120.51 116.43 2k33 n ALA 63 Ca 0.12 -3.02 0.10 0.00 0.00 0.00 0.00 53.44 50.64 2k33 n ALA 63 Cb 0.26 -0.97 0.00 0.00 0.00 0.00 0.00 19.45 18.74 2k33 n ALA 63 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 2k33 n THR 64 N 0.43 0.00 -2.84 0.00 -2.24 -1.24 -4.98 114.28 103.41 2k33 n THR 64 Ca 0.21 -0.00 -0.15 0.00 -2.27 0.00 0.00 64.05 61.84 2k33 n THR 64 Cb 0.65 0.23 -0.01 0.00 -2.10 0.00 0.00 70.33 69.11 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 -1.05 -4.28 3.22 4.32 -1.26 -4.88 117.00 113.07 2k33 n LEU 65 Ca 0.03 0.01 -0.33 0.00 -0.02 0.00 0.00 56.01 55.70 2k33 n LEU 65 Cb 0.27 -1.89 0.15 0.00 -1.62 0.00 0.00 43.42 40.32 2k33 n LEU 65 CO 0.06 0.00 -0.58 -0.67 -1.22 0.00 0.00 177.39 174.98 2k33 n ASP 66 N -1.93 -2.47 -4.26 -1.43 -0.08 -1.26 -4.76 116.55 100.36 2k33 n ASP 66 Ca -0.06 -0.00 -0.24 0.00 -1.51 0.00 0.00 54.79 52.97 2k33 n ASP 66 Cb 0.56 -0.97 -0.13 0.00 2.34 0.00 0.00 41.12 42.91 2k33 n ASP 66 CO 0.00 0.00 0.00 -1.00 0.12 0.00 0.00 177.20 176.32 2k33 s HIS 67 N -2.25 1.75 -0.30 -0.67 3.76 -1.26 -3.05 115.29 113.27 2k33 s HIS 67 Ca 0.54 -0.39 0.03 0.00 -0.15 0.00 0.00 55.06 55.08 2k33 s HIS 67 Cb -0.12 -1.00 0.07 0.00 1.11 0.00 0.00 32.58 32.64 2k33 s HIS 67 CO 0.67 0.14 -0.03 0.99 -0.85 0.00 0.00 174.74 175.66 2k33 s THR 68 N -0.98 2.35 0.12 1.30 2.01 0.13 -4.97 115.64 115.59 2k33 s THR 68 Ca 0.06 -1.87 -0.30 0.00 0.31 0.00 0.00 61.69 59.89 2k33 s THR 68 Cb -0.09 -2.51 -0.07 0.00 0.01 0.00 0.00 72.50 69.84 2k33 s THR 68 CO 0.03 -0.26 1.21 -1.61 -0.69 0.00 0.00 174.62 173.30 2k33 s GLU 69 N 1.05 4.45 -0.55 4.92 2.02 -1.26 -1.56 118.70 127.77 2k33 s GLU 69 Ca -0.01 1.84 -0.17 0.00 0.02 0.00 0.00 54.97 56.64 2k33 s GLU 69 Cb -0.20 -3.29 0.11 0.00 0.10 0.00 0.00 34.13 30.85 2k33 s GLU 69 CO -0.06 -0.19 0.58 0.42 0.02 0.00 0.00 175.26 176.03 2k33 s ILE 70 N 0.58 5.03 0.08 -1.63 1.09 0.12 -4.96 121.20 121.51 2k33 s ILE 70 Ca 0.57 -1.18 -0.14 0.00 -1.10 0.00 0.00 60.65 58.79 2k33 s ILE 70 Cb -0.31 -4.38 -0.06 0.00 -1.06 0.00 0.00 42.46 36.64 2k33 s ILE 70 CO 0.32 -0.95 0.48 -1.59 -0.10 0.00 0.00 174.94 173.11 2k33 s LYS 71 N 2.13 3.96 0.61 2.79 -2.85 -1.26 -1.68 119.74 123.43 2k33 s LYS 71 Ca 0.07 0.45 -0.18 0.00 -1.00 0.00 0.00 55.97 55.31 2k33 s LYS 71 Cb -0.26 -3.08 -0.04 0.00 -2.06 0.00 0.00 37.83 32.38 2k33 s LYS 71 CO 0.05 0.58 1.00 0.00 0.10 0.00 0.00 175.35 177.08 2k33 n ALA 72 N 1.27 0.27 0.00 0.59 0.00 0.05 -4.79 120.51 117.91 2k33 n ALA 72 Ca -0.09 0.00 -0.07 0.00 0.00 0.00 0.00 53.44 53.28 2k33 n ALA 72 Cb 0.52 -2.13 0.10 0.00 0.00 0.00 0.00 19.45 17.94 2k33 n ALA 72 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2k33 h PRO 73 N 0.48 0.54 -1.80 0.00 0.13 -1.92 -2.46 132.00 126.97 2k33 h PRO 73 Ca -0.49 -0.28 0.06 0.00 -0.87 0.00 0.00 66.00 64.42 2k33 h PRO 73 Cb 1.36 0.01 -0.21 0.00 0.13 0.00 0.00 31.00 32.30 2k33 h PRO 73 CO 0.51 0.87 0.46 -0.59 -0.23 0.00 0.00 178.00 179.02 2k33 s PHE 74 N -4.19 -0.43 0.52 1.56 -0.12 -1.26 -4.62 117.98 109.44 2k33 s PHE 74 Ca -0.07 0.66 -0.20 0.00 -0.05 0.00 0.00 56.93 57.27 2k33 s PHE 74 Cb 0.12 0.46 -0.09 0.00 -0.63 0.00 0.00 43.02 42.88 2k33 s PHE 74 CO 0.82 -0.44 0.74 -3.47 -0.05 0.00 0.00 175.22 172.82 2k33 n ASP 75 N 0.58 -0.09 0.00 1.98 -0.08 -1.26 -4.48 116.55 113.20 2k33 n ASP 75 Ca -0.12 0.84 0.00 0.00 -1.51 0.00 0.00 54.79 54.01 2k33 n ASP 75 Cb 0.58 -1.25 0.00 0.00 2.34 0.00 0.00 41.12 42.79 2k33 n ASP 75 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 2k33 n GLY 76 N 1.54 -0.56 3.19 0.27 0.00 -0.99 -4.81 105.19 103.83 2k33 n GLY 76 Ca 0.12 -0.19 -0.25 0.00 0.00 0.00 0.00 46.02 45.70 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 -1.85 1.46 0.02 2.61 2.01 -0.82 -1.09 115.64 117.99 2k33 s THR 77 Ca 0.00 -0.88 0.07 0.00 0.31 0.00 0.00 61.69 61.18 2k33 s THR 77 Cb 0.00 -1.24 -0.03 0.00 0.01 0.00 0.00 72.50 71.24 2k33 s THR 77 CO 0.00 0.34 -0.18 -0.51 -0.69 0.00 0.00 174.62 173.58 2k33 s ILE 78 N -0.54 2.77 0.00 1.82 2.07 0.49 -0.56 121.20 127.25 2k33 s ILE 78 Ca 0.07 -1.10 0.00 0.00 -1.41 0.00 0.00 60.65 58.20 2k33 s ILE 78 Cb -0.07 -2.13 0.00 0.00 0.13 0.00 0.00 42.46 40.38 2k33 s ILE 78 CO -0.00 0.40 0.00 0.61 -1.91 0.00 0.00 174.94 174.04 2k33 n GLY 79 N 1.76 1.28 2.47 1.50 0.00 -1.00 -2.01 105.19 109.19 2k33 n GLY 79 Ca -0.16 -1.61 -0.15 0.00 0.00 0.00 0.00 46.02 44.10 2k33 n GLY 79 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2k33 n ASP 80 N 0.00 0.86 -4.58 1.61 5.75 -1.26 -3.53 116.55 115.40 2k33 n ASP 80 Ca 0.00 -1.72 -0.35 0.00 -0.01 0.00 0.00 54.79 52.71 2k33 n ASP 80 Cb 0.00 -0.41 -0.11 0.00 -1.03 0.00 0.00 41.12 39.57 2k33 n ASP 80 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2k33 s ALA 81 N -3.03 3.30 -0.07 2.12 0.00 -1.26 -4.51 121.76 118.31 2k33 s ALA 81 Ca 0.42 -0.84 -0.24 0.00 0.00 0.00 0.00 51.96 51.30 2k33 s ALA 81 Cb -0.02 -1.90 -0.28 0.00 0.00 0.00 0.00 23.12 20.92 2k33 s ALA 81 CO 0.28 0.04 0.91 -0.07 0.00 0.00 0.00 175.76 176.92 2k33 h LEU 82 N 7.02 0.30 0.00 0.00 4.07 -1.76 -3.47 115.31 121.47 2k33 h LEU 82 Ca -0.36 -0.91 -0.32 0.00 0.08 0.00 0.00 57.88 56.37 2k33 h LEU 82 Cb 1.17 -0.10 -0.00 0.00 1.08 0.00 0.00 40.66 42.82 2k33 h LEU 82 CO 0.66 1.19 -0.09 1.33 -1.08 0.00 0.00 178.44 180.45 2k33 n VAL 83 N -4.34 0.00 -4.51 1.22 0.24 -1.26 -5.10 118.33 104.58 2k33 n VAL 83 Ca -0.12 -1.25 -0.25 0.00 -2.04 0.00 0.00 64.34 60.69 2k33 n VAL 83 Cb 0.65 -0.50 -0.09 0.00 -1.47 0.00 0.00 33.84 32.43 2k33 n VAL 83 CO 0.00 0.00 0.00 0.20 -2.14 0.00 0.00 176.83 174.89 2k33 s ASN 84 N -3.12 2.74 0.56 -1.34 0.01 -1.26 -5.10 114.94 107.42 2k33 s ASN 84 Ca 0.30 -1.57 -0.18 0.00 -0.71 0.00 0.00 52.86 50.70 2k33 s ASN 84 Cb -0.02 0.30 -0.05 0.00 0.41 0.00 0.00 41.25 41.89 2k33 s ASN 84 CO 0.19 -0.81 1.11 -0.63 -1.51 0.00 0.00 177.10 175.45 2k33 s ILE 85 N -3.22 3.31 -0.24 0.60 -1.09 -1.26 -3.32 121.20 115.98 2k33 s ILE 85 Ca 0.27 0.76 0.00 0.00 -2.23 0.00 0.00 60.65 59.45 2k33 s ILE 85 Cb 0.05 -3.28 0.00 0.00 -1.58 0.00 0.00 42.46 37.64 2k33 s ILE 85 CO 0.14 -0.23 0.00 0.61 -1.23 0.00 0.00 174.94 174.23 2k33 n GLY 86 N -0.10 0.56 3.37 6.18 0.00 -0.96 -4.99 105.19 109.25 2k33 n GLY 86 Ca 0.11 -0.46 -0.34 0.00 0.00 0.00 0.00 46.02 45.33 2k33 n GLY 86 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2k33 s ASP 87 N -2.50 4.30 0.33 1.61 -1.08 -1.21 -4.88 116.67 113.24 2k33 s ASP 87 Ca 0.00 -0.31 -0.29 0.00 -0.52 0.00 0.00 52.55 51.43 2k33 s ASP 87 Cb 0.00 -1.70 -0.11 0.00 -1.46 0.00 0.00 42.92 39.65 2k33 s ASP 87 CO 0.00 0.09 1.50 -0.47 0.52 0.00 0.00 175.17 176.81 2k33 s TYR 88 N 0.82 2.74 0.06 -5.34 6.14 -1.26 -2.08 117.35 118.43 2k33 s TYR 88 Ca -0.02 1.05 0.02 0.00 0.64 0.00 0.00 57.07 58.76 2k33 s TYR 88 Cb -0.15 -3.98 -0.03 0.00 0.42 0.00 0.00 41.96 38.22 2k33 s TYR 88 CO 0.01 -3.03 -0.08 0.14 0.64 0.00 0.00 175.55 173.24 2k33 s VAL 89 N -0.62 0.62 0.25 3.14 -7.23 0.62 -4.91 120.40 112.26 2k33 s VAL 89 Ca 0.57 -1.39 -0.03 0.00 -1.81 0.00 0.00 61.98 59.32 2k33 s VAL 89 Cb -0.46 -1.00 0.05 0.00 0.56 0.00 0.00 36.38 35.54 2k33 s VAL 89 CO 0.55 -0.55 0.34 -1.20 -0.31 0.00 0.00 175.10 173.93 2k33 n SER 90 N 0.93 0.15 -4.00 4.85 7.64 -1.26 -1.46 113.62 120.47 2k33 n SER 90 Ca -0.19 -1.20 0.00 0.00 1.01 0.00 0.00 58.87 58.49 2k33 n SER 90 Cb 0.57 -0.25 0.00 0.00 -1.01 0.00 0.00 64.21 63.52 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 -3.15 0.00 -0.09 -0.43 0.00 -1.25 -4.28 120.51 111.31 2k33 n ALA 91 Ca -0.06 0.00 0.26 0.00 0.00 0.00 0.00 53.44 53.65 2k33 n ALA 91 Cb 0.16 0.00 0.67 0.00 0.00 0.00 0.00 19.45 20.29 2k33 n ALA 91 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 2k33 h SER 92 N 0.00 0.00 -1.14 0.00 0.02 -1.78 0.49 113.55 111.15 2k33 h SER 92 Ca 0.00 0.00 0.32 0.00 -0.84 0.00 0.00 61.79 61.27 2k33 h SER 92 Cb 0.00 0.00 -0.09 0.00 0.14 0.00 0.00 62.40 62.45 2k33 h SER 92 CO 0.00 0.00 0.75 0.74 -1.14 0.00 0.00 176.83 177.18 2k33 h THR 93 N 0.00 0.41 -2.24 -2.27 2.02 -1.93 -3.38 112.91 105.52 2k33 h THR 93 Ca 0.36 -0.08 -0.56 0.00 0.77 0.00 0.00 66.41 66.90 2k33 h THR 93 Cb 1.85 0.15 -0.01 0.00 -1.74 0.00 0.00 68.15 68.39 2k33 h THR 93 CO -0.00 0.04 1.40 0.28 0.37 0.00 0.00 175.52 177.61 2k33 s THR 94 N -5.33 3.25 -0.87 3.16 -1.32 0.16 -4.87 115.64 109.83 2k33 s THR 94 Ca -0.08 0.24 -0.01 0.00 -1.21 0.00 0.00 61.69 60.63 2k33 s THR 94 Cb 0.26 -3.39 0.35 0.00 -1.51 0.00 0.00 72.50 68.21 2k33 s THR 94 CO 0.81 -0.28 1.95 -1.84 -2.21 0.00 0.00 174.62 173.04 2k33 n GLU 95 N 8.69 3.31 -0.09 7.08 0.28 -1.26 -4.58 120.64 134.07 2k33 n GLU 95 Ca 0.27 -3.79 -0.14 0.00 -0.16 0.00 0.00 57.16 53.33 2k33 n GLU 95 Cb 0.48 -2.31 -0.10 0.00 1.43 0.00 0.00 31.44 30.94 2k33 n GLU 95 CO 0.00 0.00 0.00 1.37 -0.16 0.00 0.00 177.13 178.34 2k33 h LEU 96 N 3.22 -1.79 -8.93 -1.84 -0.00 -1.90 -3.43 115.31 100.65 2k33 h LEU 96 Ca 0.55 0.23 -0.55 0.00 -0.00 0.00 0.00 57.88 58.11 2k33 h LEU 96 Cb 0.12 0.72 -0.17 0.00 -0.00 0.00 0.00 40.66 41.33 2k33 h LEU 96 CO 1.36 -0.43 -0.78 0.54 -0.00 0.00 0.00 178.44 179.14 2k33 s VAL 97 N -5.61 1.99 0.14 0.15 0.11 -1.26 -2.12 120.40 113.79 2k33 s VAL 97 Ca -0.14 -2.05 0.07 0.00 -2.93 0.00 0.00 61.98 56.92 2k33 s VAL 97 Cb 0.08 -1.99 -0.04 0.00 -1.53 0.00 0.00 36.38 32.90 2k33 s VAL 97 CO 0.60 -0.34 -0.15 0.00 -3.33 0.00 0.00 175.10 171.88 2k33 s ARG 98 N -3.01 1.11 -0.08 1.54 3.03 -1.26 -1.52 118.95 118.75 2k33 s ARG 98 Ca 0.20 -1.31 0.01 0.00 2.03 0.00 0.00 55.73 56.65 2k33 s ARG 98 Cb -0.05 -1.02 -0.03 0.00 -1.03 0.00 0.00 34.95 32.82 2k33 s ARG 98 CO 0.08 0.20 -0.10 0.08 -1.13 0.00 0.00 175.30 174.43 2k33 s VAL 99 N -2.20 3.42 0.40 4.99 1.01 0.15 -2.37 120.40 125.81 2k33 s VAL 99 Ca 0.12 -0.57 0.06 0.00 0.00 0.00 0.00 61.98 61.59 2k33 s VAL 99 Cb -0.05 -2.40 -0.08 0.00 0.00 0.00 0.00 36.38 33.85 2k33 s VAL 99 CO 0.04 0.57 0.02 0.28 0.00 0.00 0.00 175.10 176.01 2k33 s THR 100 N -0.43 1.87 0.30 3.92 -1.32 0.27 -2.46 115.64 117.80 2k33 s THR 100 Ca 0.06 -2.00 0.00 0.00 -1.21 0.00 0.00 61.69 58.54 2k33 s THR 100 Cb -0.12 -2.95 0.00 0.00 -1.51 0.00 0.00 72.50 67.92 2k33 s THR 100 CO 0.02 0.00 0.00 -3.20 -2.21 0.00 0.00 174.62 169.23 2k33 n ASN 101 N -0.94 -4.59 -1.17 8.08 2.85 -1.26 -1.94 115.26 116.28 2k33 n ASN 101 Ca -0.05 0.68 0.15 0.00 -0.11 0.00 0.00 54.58 55.24 2k33 n ASN 101 Cb 0.67 -2.66 -0.07 0.00 1.24 0.00 0.00 39.78 38.96 2k33 n ASN 101 CO 0.00 0.00 0.00 0.18 -2.11 0.00 0.00 177.26 175.33 2k33 n LEU 102 N -3.41 -0.78 -4.89 1.20 4.32 -1.26 -4.66 117.00 107.52 2k33 n LEU 102 Ca -0.04 1.80 -0.29 0.00 -0.02 0.00 0.00 56.01 57.47 2k33 n LEU 102 Cb 0.38 -3.13 -0.02 0.00 -1.62 0.00 0.00 43.42 39.02 2k33 n LEU 102 CO 0.02 -2.09 0.38 0.20 -1.22 0.00 0.00 177.39 174.68 2k33 s ASN 103 N -6.73 6.41 -0.72 -1.43 0.01 -1.26 -4.69 114.94 106.52 2k33 s ASN 103 Ca 0.00 0.96 -0.26 0.00 -0.71 0.00 0.00 52.86 52.85 2k33 s ASN 103 Cb 0.00 -2.25 -0.03 0.00 0.41 0.00 0.00 41.25 39.38 2k33 s ASN 103 CO 0.00 -0.41 1.89 -2.16 -1.51 0.00 0.00 177.10 174.91 2k33 s PRO 104 N -4.10 2.60 0.28 -0.60 0.04 -1.26 -4.97 135.00 126.99 2k33 s PRO 104 Ca 0.48 0.26 -0.10 0.00 0.04 0.00 0.00 61.00 61.68 2k33 s PRO 104 Cb -0.10 -4.65 -0.07 0.00 0.04 0.00 0.00 34.50 29.72 2k33 s PRO 104 CO 0.36 -2.98 0.62 0.42 0.04 0.00 0.00 177.00 175.45 2k33 s ILE 105 N 9.47 4.88 -0.28 0.56 -1.09 -1.26 -5.09 121.20 128.38 2k33 s ILE 105 Ca 0.68 0.50 -0.16 0.00 -2.23 0.00 0.00 60.65 59.45 2k33 s ILE 105 Cb -0.10 -3.65 0.09 0.00 -1.58 0.00 0.00 42.46 37.21 2k33 s ILE 105 CO 0.12 -0.20 0.71 -0.72 -1.23 0.00 0.00 174.94 173.62 2k33 s TYR 106 N -1.97 -1.05 -0.35 3.97 1.13 -1.26 -4.83 117.35 112.98 2k33 s TYR 106 Ca 0.49 2.09 -0.03 0.00 -1.41 0.00 0.00 57.07 58.20 2k33 s TYR 106 Cb -0.11 0.63 0.25 0.00 -1.10 0.00 0.00 41.96 41.63 2k33 s TYR 106 CO 0.23 -0.52 1.16 0.00 -2.51 0.00 0.00 175.55 173.91 2k33 n ALA 107 N 4.31 -3.43 -3.56 9.51 0.00 -1.26 -5.17 120.51 120.92 2k33 n ALA 107 Ca -0.20 -0.30 0.00 0.00 0.00 0.00 0.00 53.44 52.94 2k33 n ALA 107 Cb 0.59 -3.06 0.00 0.00 0.00 0.00 0.00 19.45 16.97 2k33 n ALA 107 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 2k33 n ASP 108 N 1.88 1.15 -2.65 0.00 5.75 -1.26 -5.10 116.55 116.31 2k33 n ASP 108 Ca 0.05 -0.98 -0.03 0.00 -0.01 0.00 0.00 54.79 53.82 2k33 n ASP 108 Cb 0.68 0.00 0.02 0.00 -1.03 0.00 0.00 41.12 40.79 2k33 n ASP 108 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2k33 n GLY 109 N 5.00 -1.20 0.06 6.12 0.00 -1.26 -5.06 105.19 108.84 2k33 n GLY 109 Ca 0.00 0.30 -0.05 0.00 0.00 0.00 0.00 46.02 46.28 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 -0.18 1.31 -2.25 1.61 7.64 -1.26 -5.12 113.62 115.37 2k33 n SER 110 Ca -0.23 0.38 -0.01 0.00 1.01 0.00 0.00 58.87 60.03 2k33 n SER 110 Cb 0.67 -0.72 0.01 0.00 -1.01 0.00 0.00 64.21 63.16 2k33 n SER 110 CO 0.00 0.00 0.00 1.41 -3.01 0.00 0.00 175.04 173.44 2k33 n HIS 111 N -3.89 -0.73 -3.26 1.43 8.25 -1.26 -5.05 115.22 110.70 2k33 n HIS 111 Ca -0.07 -0.55 -0.12 0.00 -0.26 0.00 0.00 57.72 56.72 2k33 n HIS 111 Cb 0.27 0.26 0.04 0.00 1.12 0.00 0.00 29.99 31.68 2k33 n HIS 111 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2k33 n HIS 112 N -0.40 -2.57 -4.72 4.41 -0.00 -1.26 -5.03 115.22 105.66 2k33 n HIS 112 Ca 0.00 0.91 -0.24 0.00 -0.00 0.00 0.00 57.72 58.39 2k33 n HIS 112 Cb 0.29 -3.98 -0.15 0.00 -0.00 0.00 0.00 29.99 26.16 2k33 n HIS 112 CO 0.00 0.00 0.00 -3.38 -0.00 0.00 0.00 176.34 172.96 2k33 s HIS 113 N -3.24 1.53 -0.13 4.41 -0.00 -1.26 -5.03 115.29 111.57 2k33 s HIS 113 Ca 0.27 -0.31 0.16 0.00 -0.00 0.00 0.00 55.06 55.18 2k33 s HIS 113 Cb -0.05 -0.96 0.39 0.00 -0.00 0.00 0.00 32.58 31.96 2k33 s HIS 113 CO 0.77 0.00 1.19 1.58 -0.00 0.00 0.00 174.74 178.27 2k33 n HIS 114 N 2.42 0.00 -3.69 0.38 -0.00 -1.26 -4.94 115.22 108.14 2k33 n HIS 114 Ca -0.15 -1.07 -0.36 0.00 0.46 0.00 0.00 57.72 56.60 2k33 n HIS 114 Cb 0.54 -0.20 -0.08 0.00 -0.12 0.00 0.00 29.99 30.13 2k33 n HIS 114 CO 0.00 0.00 0.00 -1.58 0.46 0.00 0.00 176.34 175.22 2k33 s HIS 115 N -2.06 3.68 0.00 1.57 5.04 -1.26 -5.36 115.29 116.90 2k33 s HIS 115 Ca 0.34 -2.94 0.00 0.00 -1.54 0.00 0.00 55.06 50.92 2k33 s HIS 115 Cb 0.35 -3.18 0.00 0.00 0.04 0.00 0.00 32.58 29.78 2k33 s HIS 115 CO -0.09 -0.76 0.14 0.72 -2.34 0.00 0.00 174.74 172.41