#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 1.09 -0.23 2.53 1.01 -1.11 -5.01 120.40 118.68 2k33 s VAL 2 Ca 0.00 -1.24 -0.06 0.00 0.00 0.00 0.00 61.98 60.68 2k33 s VAL 2 Cb 0.00 -1.04 -0.02 0.00 0.00 0.00 0.00 36.38 35.32 2k33 s VAL 2 CO 0.00 -0.19 0.01 -0.63 0.00 0.00 0.00 175.10 174.29 2k33 s ILE 3 N -1.20 3.89 0.14 2.22 1.01 -1.26 0.51 121.20 126.51 2k33 s ILE 3 Ca -0.02 -0.32 -0.31 0.00 0.00 0.00 0.00 60.65 60.00 2k33 s ILE 3 Cb -0.10 -2.79 -0.08 0.00 0.01 0.00 0.00 42.46 39.50 2k33 s ILE 3 CO 0.02 0.39 1.38 -0.63 0.00 0.00 0.00 174.94 176.11 2k33 s ILE 4 N 1.42 3.21 0.14 2.92 1.01 0.34 -4.94 121.20 125.30 2k33 s ILE 4 Ca 0.05 0.90 0.04 0.00 0.00 0.00 0.00 60.65 61.65 2k33 s ILE 4 Cb -0.15 -3.58 -0.04 0.00 0.01 0.00 0.00 42.46 38.70 2k33 s ILE 4 CO 0.01 0.09 -0.11 -0.54 0.00 0.00 0.00 174.94 174.39 2k33 s LYS 5 N 0.77 1.02 0.25 2.79 -0.14 -1.26 -3.78 119.74 119.39 2k33 s LYS 5 Ca 0.63 -1.38 -0.04 0.00 -1.36 0.00 0.00 55.97 53.82 2k33 s LYS 5 Cb -0.37 -0.64 0.06 0.00 -1.68 0.00 0.00 37.83 35.20 2k33 s LYS 5 CO 0.33 0.09 0.22 -0.35 -0.76 0.00 0.00 175.35 174.88 2k33 n PRO 6 N 0.01 -1.46 0.00 -1.68 -0.04 -1.26 -4.81 135.00 125.76 2k33 n PRO 6 Ca -0.12 -0.36 0.02 0.00 -0.04 0.00 0.00 63.50 63.01 2k33 n PRO 6 Cb 0.60 -0.34 0.00 0.00 -0.04 0.00 0.00 33.50 33.72 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 -2.20 1.93 -4.01 0.54 7.27 -1.26 -4.16 117.38 115.49 2k33 n GLN 7 Ca 0.03 -0.49 -0.10 0.00 0.07 0.00 0.00 57.00 56.51 2k33 n GLN 7 Cb 0.12 -0.94 -0.05 0.00 2.41 0.00 0.00 30.24 31.78 2k33 n GLN 7 CO 0.00 0.00 0.00 0.14 0.07 0.00 0.00 177.06 177.27 2k33 s VAL 8 N -0.78 0.00 -0.06 1.69 -7.23 -1.26 -4.90 120.40 107.86 2k33 s VAL 8 Ca 0.04 -1.44 -0.09 0.00 -1.81 0.00 0.00 61.98 58.68 2k33 s VAL 8 Cb 0.04 -2.32 -0.05 0.00 0.56 0.00 0.00 36.38 34.62 2k33 s VAL 8 CO 0.10 0.00 0.24 -0.94 -0.31 0.00 0.00 175.10 174.19 2k33 s SER 9 N -3.06 6.52 0.00 4.85 1.04 -1.26 -3.75 113.70 118.03 2k33 s SER 9 Ca 0.24 0.61 0.00 0.00 0.48 0.00 0.00 55.95 57.28 2k33 s SER 9 Cb -0.01 -2.12 0.00 0.00 0.10 0.00 0.00 66.02 64.00 2k33 s SER 9 CO 0.11 0.35 0.00 0.61 0.98 0.00 0.00 173.24 175.29 2k33 n GLY 10 N 1.71 -0.54 3.07 7.32 0.00 -1.07 -4.51 105.19 111.17 2k33 n GLY 10 Ca -0.16 0.16 -0.12 0.00 0.00 0.00 0.00 46.02 45.89 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 0.00 0.01 0.30 1.61 -7.23 -0.39 0.57 120.40 115.27 2k33 s VAL 11 Ca 0.00 -0.12 -0.29 0.00 -1.81 0.00 0.00 61.98 59.76 2k33 s VAL 11 Cb 0.00 -0.29 -0.13 0.00 0.56 0.00 0.00 36.38 36.52 2k33 s VAL 11 CO 0.00 -0.06 1.30 -0.38 -0.31 0.00 0.00 175.10 175.65 2k33 n ILE 12 N 2.71 1.60 -0.08 -0.62 2.08 0.71 0.03 119.36 125.79 2k33 n ILE 12 Ca -0.14 -0.40 -0.11 0.00 0.56 0.00 0.00 62.75 62.66 2k33 n ILE 12 Cb 0.58 -1.47 -0.07 0.00 -0.75 0.00 0.00 39.64 37.93 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 0.91 -3.61 1.39 0.31 0.15 -2.35 118.33 116.06 2k33 n VAL 13 Ca 0.08 -0.34 -0.03 0.00 -0.01 0.00 0.00 64.34 64.04 2k33 n VAL 13 Cb 0.34 -1.09 -0.01 0.00 -0.91 0.00 0.00 33.84 32.17 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 -5.57 -0.15 -0.05 4.52 2.47 -1.24 -4.78 114.94 110.15 2k33 s ASN 14 Ca -0.21 -0.09 0.05 0.00 0.42 0.00 0.00 52.86 53.03 2k33 s ASN 14 Cb 0.06 0.22 -0.02 0.00 -1.45 0.00 0.00 41.25 40.06 2k33 s ASN 14 CO 0.36 -0.39 -0.20 -1.59 -3.72 0.00 0.00 177.10 171.56 2k33 s LYS 15 N -2.62 2.43 -0.17 0.43 -2.85 -1.26 -1.30 119.74 114.41 2k33 s LYS 15 Ca 0.11 -0.82 0.16 0.00 -1.00 0.00 0.00 55.97 54.42 2k33 s LYS 15 Cb 0.01 -2.23 0.44 0.00 -2.06 0.00 0.00 37.83 33.98 2k33 s LYS 15 CO -0.04 0.53 1.19 1.28 0.10 0.00 0.00 175.35 178.40 2k33 n LEU 16 N 2.56 2.47 -3.94 2.77 4.32 0.27 -4.99 117.00 120.46 2k33 n LEU 16 Ca -0.17 -3.42 -0.09 0.00 -0.02 0.00 0.00 56.01 52.31 2k33 n LEU 16 Cb 0.52 -0.25 -0.10 0.00 -1.62 0.00 0.00 43.42 41.97 2k33 n LEU 16 CO 0.25 1.23 -0.24 0.12 -1.22 0.00 0.00 177.39 177.53 2k33 s PHE 17 N -2.44 0.22 -0.06 -1.77 5.36 -1.23 -4.76 117.98 113.30 2k33 s PHE 17 Ca 0.38 -0.52 0.00 0.00 -0.96 0.00 0.00 56.93 55.83 2k33 s PHE 17 Cb 0.38 -0.16 0.02 0.00 -0.34 0.00 0.00 43.02 42.92 2k33 s PHE 17 CO -0.08 -0.34 -0.05 0.15 -1.46 0.00 0.00 175.22 173.45 2k33 s LYS 18 N -2.45 0.99 -0.36 10.12 1.02 -1.26 -5.06 119.74 122.74 2k33 s LYS 18 Ca -0.06 -0.12 -0.41 0.00 0.02 0.00 0.00 55.97 55.40 2k33 s LYS 18 Cb -0.02 -1.04 -0.16 0.00 -0.52 0.00 0.00 37.83 36.09 2k33 s LYS 18 CO -0.04 -0.14 1.88 0.00 -0.92 0.00 0.00 175.35 176.13 2k33 n ALA 19 N 4.38 -0.01 0.00 5.17 0.00 -1.25 -2.04 120.51 126.76 2k33 n ALA 19 Ca -0.19 0.28 0.00 0.00 0.00 0.00 0.00 53.44 53.53 2k33 n ALA 19 Cb 0.51 -2.23 0.00 0.00 0.00 0.00 0.00 19.45 17.72 2k33 n ALA 19 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2k33 n GLY 20 N 5.14 1.59 3.76 0.00 0.00 -0.90 -4.92 105.19 109.87 2k33 n GLY 20 Ca 0.34 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 46.07 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 4.23 0.04 1.61 -1.08 -0.87 -4.98 116.67 113.62 2k33 s ASP 21 Ca 0.00 -1.44 -0.06 0.00 -0.52 0.00 0.00 52.55 50.53 2k33 s ASP 21 Cb 0.00 0.18 -0.05 0.00 -1.46 0.00 0.00 42.92 41.59 2k33 s ASP 21 CO 0.00 -0.78 0.29 -1.59 0.52 0.00 0.00 175.17 173.61 2k33 s LYS 22 N -3.93 3.59 0.05 4.34 -2.85 -1.26 -2.69 119.74 116.99 2k33 s LYS 22 Ca 0.22 -0.09 0.07 0.00 -1.00 0.00 0.00 55.97 55.16 2k33 s LYS 22 Cb 0.03 -3.03 -0.03 0.00 -2.06 0.00 0.00 37.83 32.74 2k33 s LYS 22 CO 0.12 0.60 -0.20 0.54 0.10 0.00 0.00 175.35 176.52 2k33 s VAL 23 N -1.39 1.60 0.12 1.79 0.11 -1.03 -4.96 120.40 116.63 2k33 s VAL 23 Ca 0.31 -1.23 0.05 0.00 -2.93 0.00 0.00 61.98 58.18 2k33 s VAL 23 Cb -0.13 -1.41 -0.04 0.00 -1.53 0.00 0.00 36.38 33.27 2k33 s VAL 23 CO 0.19 0.14 0.05 -0.75 -3.33 0.00 0.00 175.10 171.39 2k33 s LYS 24 N -1.29 2.69 -0.90 1.54 2.47 -1.26 -2.42 119.74 120.56 2k33 s LYS 24 Ca 0.06 -0.85 -0.25 0.00 -1.56 0.00 0.00 55.97 53.38 2k33 s LYS 24 Cb -0.09 -2.58 -0.08 0.00 -1.46 0.00 0.00 37.83 33.62 2k33 s LYS 24 CO 0.02 0.52 2.07 0.15 0.16 0.00 0.00 175.35 178.27 2k33 s LYS 25 N -2.60 2.26 0.00 4.03 1.02 -1.26 -1.64 119.74 121.55 2k33 s LYS 25 Ca 0.28 -0.17 0.00 0.00 0.02 0.00 0.00 55.97 56.10 2k33 s LYS 25 Cb -0.11 -5.00 0.00 0.00 -0.52 0.00 0.00 37.83 32.19 2k33 s LYS 25 CO 0.20 -3.77 0.00 0.41 -0.92 0.00 0.00 175.35 171.27 2k33 n GLY 26 N 6.74 1.64 3.91 -3.33 0.00 -0.71 -4.91 105.19 108.53 2k33 n GLY 26 Ca 0.42 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 46.15 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 -0.02 3.60 0.42 1.61 -2.07 -0.65 -4.73 119.66 117.80 2k33 s GLN 27 Ca 0.00 -0.13 -0.23 0.00 -1.82 0.00 0.00 55.36 53.18 2k33 s GLN 27 Cb 0.00 -2.77 -0.09 0.00 -1.09 0.00 0.00 33.01 29.06 2k33 s GLN 27 CO 0.00 0.35 1.05 0.99 -1.32 0.00 0.00 175.29 176.36 2k33 s THR 28 N -1.89 3.74 0.18 3.63 2.01 -1.26 0.14 115.64 122.20 2k33 s THR 28 Ca 0.41 1.27 0.00 0.00 0.31 0.00 0.00 61.69 63.68 2k33 s THR 28 Cb -0.11 -3.62 0.00 0.00 0.01 0.00 0.00 72.50 68.78 2k33 s THR 28 CO 0.28 -0.06 0.00 0.18 -0.69 0.00 0.00 174.62 174.33 2k33 n LEU 29 N -0.29 0.07 0.00 4.42 4.77 0.06 -4.85 117.00 121.17 2k33 n LEU 29 Ca 0.06 0.31 -0.25 0.00 -0.03 0.00 0.00 56.01 56.10 2k33 n LEU 29 Cb 0.50 0.19 -0.05 0.00 -2.33 0.00 0.00 43.42 41.73 2k33 n LEU 29 CO 0.44 -0.71 -0.16 0.49 -1.33 0.00 0.00 177.39 176.12 2k33 n PHE 30 N -3.21 0.71 -3.91 -1.77 3.01 -1.03 0.97 117.46 112.22 2k33 n PHE 30 Ca 0.00 -1.91 -0.10 0.00 1.01 0.00 0.00 57.45 56.44 2k33 n PHE 30 Cb 0.00 -0.27 -0.11 0.00 -0.01 0.00 0.00 39.48 39.09 2k33 n PHE 30 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 2k33 s ILE 31 N -2.37 0.08 -0.06 4.37 1.01 -0.42 0.25 121.20 124.06 2k33 s ILE 31 Ca 0.03 -0.63 -0.05 0.00 0.00 0.00 0.00 60.65 59.99 2k33 s ILE 31 Cb -0.00 -0.28 0.02 0.00 0.01 0.00 0.00 42.46 42.20 2k33 s ILE 31 CO 0.02 -0.35 0.15 -0.63 0.00 0.00 0.00 174.94 174.13 2k33 s ILE 32 N -1.10 -0.01 -0.12 2.92 1.01 0.39 0.31 121.20 124.61 2k33 s ILE 32 Ca -0.12 0.02 -0.04 0.00 0.00 0.00 0.00 60.65 60.51 2k33 s ILE 32 Cb -0.07 -0.22 -0.04 0.00 0.01 0.00 0.00 42.46 42.14 2k33 s ILE 32 CO 0.00 0.01 0.05 -0.70 0.00 0.00 0.00 174.94 174.30 2k33 s GLU 33 N 0.23 3.33 0.12 2.79 -6.30 0.10 0.01 118.70 118.99 2k33 s GLU 33 Ca -0.01 -0.32 0.02 0.00 -2.50 0.00 0.00 54.97 52.16 2k33 s GLU 33 Cb -0.02 -2.99 -0.01 0.00 0.00 0.00 0.00 34.13 31.11 2k33 s GLU 33 CO -0.01 0.63 0.07 0.00 0.02 0.00 0.00 175.26 175.97 2k33 n GLN 34 N 2.41 0.50 0.00 4.30 0.00 -1.05 -1.26 117.38 122.28 2k33 n GLN 34 Ca -0.19 -1.14 0.00 0.00 0.00 0.00 0.00 57.00 55.68 2k33 n GLN 34 Cb 0.54 0.76 0.00 0.00 0.00 0.00 0.00 30.24 31.54 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 -2.20 0.00 0.00 2.61 2.03 -1.26 -4.28 116.55 113.46 2k33 n ASP 35 Ca 0.00 0.02 0.00 0.00 0.52 0.00 0.00 54.79 55.33 2k33 n ASP 35 Cb 0.20 -0.21 0.00 0.00 -0.72 0.00 0.00 41.12 40.39 2k33 n ASP 35 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2k33 n GLN 36 N -1.87 -1.21 -0.03 -0.67 6.02 -1.26 -4.51 117.38 113.84 2k33 n GLN 36 Ca 0.00 0.30 0.03 0.00 -0.01 0.00 0.00 57.00 57.32 2k33 n GLN 36 Cb 0.00 -4.23 0.12 0.00 1.02 0.00 0.00 30.24 27.16 2k33 n GLN 36 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 2k33 n ALA 37 N 1.00 2.51 -1.00 -1.58 0.00 -1.26 0.31 120.51 120.49 2k33 n ALA 37 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.30 2k33 n ALA 37 Cb 0.30 -1.04 0.00 0.00 0.00 0.00 0.00 19.45 18.71 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 -0.33 0.00 -0.22 0.00 3.41 -1.26 -4.85 113.62 110.36 2k33 n SER 38 Ca 0.05 0.00 -0.11 0.00 -0.26 0.00 0.00 58.87 58.54 2k33 n SER 38 Cb 0.07 0.00 -0.09 0.00 -0.26 0.00 0.00 64.21 63.93 2k33 n SER 38 CO 0.00 0.00 0.00 0.07 -0.16 0.00 0.00 175.04 174.95 2k33 h LYS 39 N 0.00 -0.21 -0.51 4.33 5.09 -2.05 -3.38 116.57 119.84 2k33 h LYS 39 Ca 0.00 0.01 -0.21 0.00 0.09 0.00 0.00 60.65 60.54 2k33 h LYS 39 Cb 0.00 0.05 -0.16 0.00 0.10 0.00 0.00 32.23 32.22 2k33 h LYS 39 CO 0.00 -0.14 -0.52 -0.40 -2.09 0.00 0.00 179.45 176.30 2k33 n ASP 40 N -5.06 -2.97 -0.00 7.07 5.68 -1.26 -4.96 116.55 115.05 2k33 n ASP 40 Ca -0.01 -3.12 0.01 0.00 -0.50 0.00 0.00 54.79 51.17 2k33 n ASP 40 Cb 0.28 1.67 -0.02 0.00 -1.14 0.00 0.00 41.12 41.91 2k33 n ASP 40 CO 0.00 0.00 0.00 0.49 -1.33 0.00 0.00 177.20 176.36 2k33 n PHE 41 N 2.17 0.00 -0.04 2.11 3.01 -1.14 -4.81 117.46 118.76 2k33 n PHE 41 Ca 0.13 0.00 -0.08 0.00 1.01 0.00 0.00 57.45 58.51 2k33 n PHE 41 Cb 0.60 -0.03 -0.03 0.00 -0.01 0.00 0.00 39.48 40.00 2k33 n PHE 41 CO 0.00 0.00 0.00 0.27 1.01 0.00 0.00 176.76 178.04 2k33 n ASN 42 N -1.37 1.34 0.00 4.37 6.94 0.15 -4.82 115.26 121.87 2k33 n ASN 42 Ca -0.00 0.06 0.00 0.00 -0.02 0.00 0.00 54.58 54.62 2k33 n ASN 42 Cb 0.05 -0.22 0.00 0.00 -2.36 0.00 0.00 39.78 37.25 2k33 n ASN 42 CO 0.00 0.00 0.00 -1.14 -1.03 0.00 0.00 177.26 175.09 2k33 n ARG 43 N -3.21 -0.14 -1.48 -3.83 3.00 -1.26 -4.74 116.66 104.99 2k33 n ARG 43 Ca -0.16 0.04 0.19 0.00 -0.00 0.00 0.00 57.85 57.91 2k33 n ARG 43 Cb 0.63 -3.77 -0.08 0.00 0.00 0.00 0.00 32.46 29.24 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 -0.07 -8.66 0.48 6.15 2.88 -1.26 -4.60 113.62 108.54 2k33 n SER 44 Ca 0.00 1.19 -0.19 0.00 -1.33 0.00 0.00 58.87 58.54 2k33 n SER 44 Cb 0.04 -4.88 -0.09 0.00 -0.75 0.00 0.00 64.21 58.53 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 -1.43 -1.17 0.00 -1.46 6.56 -1.93 -3.49 116.57 113.65 2k33 h LYS 45 Ca -0.12 0.08 0.06 0.00 -1.06 0.00 0.00 60.65 59.61 2k33 h LYS 45 Cb 1.40 0.27 -0.01 0.00 -0.57 0.00 0.00 32.23 33.32 2k33 h LYS 45 CO 0.06 -0.78 0.17 0.00 -2.06 0.00 0.00 179.45 176.84 2k33 n ALA 46 N -2.65 -0.69 -2.40 3.86 0.00 -1.26 -5.05 120.51 112.32 2k33 n ALA 46 Ca -0.15 -0.17 -0.24 0.00 0.00 0.00 0.00 53.44 52.87 2k33 n ALA 46 Cb 0.48 0.05 0.01 0.00 0.00 0.00 0.00 19.45 19.99 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 4.44 -3.55 0.00 4.32 -1.26 -4.96 117.00 116.00 2k33 n LEU 47 Ca 0.01 -4.95 -0.24 0.00 -0.02 0.00 0.00 56.01 50.81 2k33 n LEU 47 Cb 0.12 -0.35 0.03 0.00 -1.62 0.00 0.00 43.42 41.61 2k33 n LEU 47 CO 0.03 2.13 -0.01 0.49 -1.22 0.00 0.00 177.39 178.81 2k33 n PHE 48 N -0.50 -2.17 0.03 -1.77 3.72 -1.26 -4.91 117.46 110.60 2k33 n PHE 48 Ca 0.37 0.66 -0.04 0.00 -0.05 0.00 0.00 57.45 58.40 2k33 n PHE 48 Cb 0.74 -3.52 -0.02 0.00 -0.94 0.00 0.00 39.48 35.74 2k33 n PHE 48 CO 0.00 0.00 0.00 1.03 -0.05 0.00 0.00 176.76 177.74 2k33 h SER 49 N -1.18 -0.34 0.00 4.37 0.87 -1.99 -3.44 113.55 111.84 2k33 h SER 49 Ca -0.54 0.03 0.00 0.00 -1.23 0.00 0.00 61.79 60.05 2k33 h SER 49 Cb 1.30 0.12 0.00 0.00 -0.44 0.00 0.00 62.40 63.38 2k33 h SER 49 CO 0.43 -0.13 -0.55 0.00 -0.53 0.00 0.00 176.83 176.05 2k33 n GLN 50 N -3.07 0.00 -2.65 2.24 10.64 -1.26 -5.04 117.38 118.23 2k33 n GLN 50 Ca -0.02 0.00 -0.04 0.00 -1.83 0.00 0.00 57.00 55.11 2k33 n GLN 50 Cb 0.09 -0.31 0.07 0.00 -0.86 0.00 0.00 30.24 29.23 2k33 n GLN 50 CO 0.00 0.00 0.00 -1.13 -1.83 0.00 0.00 177.06 174.10 2k33 n SER 51 N -2.72 -1.10 -0.05 2.61 3.41 -1.26 -5.02 113.62 109.49 2k33 n SER 51 Ca 0.00 -1.45 0.01 0.00 -0.26 0.00 0.00 58.87 57.17 2k33 n SER 51 Cb 0.28 0.56 -0.14 0.00 -0.26 0.00 0.00 64.21 64.65 2k33 n SER 51 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2k33 n ALA 52 N 1.66 2.14 -3.63 7.33 0.00 -1.26 -4.96 120.51 121.79 2k33 n ALA 52 Ca 0.02 -0.80 -0.13 0.00 0.00 0.00 0.00 53.44 52.52 2k33 n ALA 52 Cb 0.71 -0.39 -0.14 0.00 0.00 0.00 0.00 19.45 19.63 2k33 n ALA 52 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 2k33 s ILE 53 N -2.87 -0.04 -1.10 0.00 1.01 -1.26 -5.06 121.20 111.87 2k33 s ILE 53 Ca -0.08 0.15 -0.18 0.00 0.00 0.00 0.00 60.65 60.54 2k33 s ILE 53 Cb 0.09 -0.22 -0.06 0.00 0.01 0.00 0.00 42.46 42.27 2k33 s ILE 53 CO 0.75 0.06 2.07 -1.54 0.00 0.00 0.00 174.94 176.29 2k33 n SER 54 N 4.02 3.16 0.06 3.58 3.41 -1.26 -4.70 113.62 121.90 2k33 n SER 54 Ca -0.24 -2.76 0.21 0.00 -0.26 0.00 0.00 58.87 55.82 2k33 n SER 54 Cb 0.53 -1.37 0.67 0.00 -0.26 0.00 0.00 64.21 63.77 2k33 n SER 54 CO 0.00 0.00 0.00 0.06 -0.16 0.00 0.00 175.04 174.94 2k33 h GLN 55 N 6.99 0.00 -1.02 4.33 -0.00 -1.97 0.39 115.11 123.83 2k33 h GLN 55 Ca 0.49 0.00 0.33 0.00 -0.00 0.00 0.00 58.65 59.47 2k33 h GLN 55 Cb 0.66 0.00 -0.15 0.00 -0.00 0.00 0.00 27.48 27.99 2k33 h GLN 55 CO 1.93 0.00 0.59 1.57 -0.00 0.00 0.00 178.83 182.92 2k33 h LYS 56 N 0.00 0.30 0.00 0.06 2.10 -2.07 -3.18 116.57 113.78 2k33 h LYS 56 Ca 0.23 -0.02 -0.02 0.00 -2.00 0.00 0.00 60.65 58.84 2k33 h LYS 56 Cb 1.45 -0.07 -0.02 0.00 -0.90 0.00 0.00 32.23 32.69 2k33 h LYS 56 CO -0.00 0.20 -0.22 0.39 -2.00 0.00 0.00 179.45 177.81 2k33 n GLU 57 N -5.02 0.00 -0.24 0.07 1.02 -0.37 -5.13 120.64 110.96 2k33 n GLU 57 Ca 0.32 -0.47 -0.21 0.00 -0.02 0.00 0.00 57.16 56.78 2k33 n GLU 57 Cb 1.02 -0.12 0.20 0.00 -0.02 0.00 0.00 31.44 32.51 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 0.02 -3.08 -4.08 -0.32 4.11 0.12 -5.00 117.16 108.93 2k33 n TYR 58 Ca -0.02 -0.47 -0.34 0.00 -0.00 0.00 0.00 57.90 57.08 2k33 n TYR 58 Cb 0.60 -1.02 -0.15 0.00 -0.00 0.00 0.00 39.34 38.77 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 -2.58 3.49 0.59 9.48 1.01 -1.26 -4.98 116.67 122.41 2k33 s ASP 59 Ca 0.46 -0.57 0.29 0.00 0.71 0.00 0.00 52.55 53.43 2k33 s ASP 59 Cb -0.08 -1.56 1.56 0.00 1.01 0.00 0.00 42.92 43.85 2k33 s ASP 59 CO 0.38 -0.00 1.99 0.28 0.21 0.00 0.00 175.17 178.03 2k33 h SER 60 N 7.96 0.00 -0.08 0.27 0.02 -1.95 0.12 113.55 119.88 2k33 h SER 60 Ca -0.44 0.00 0.02 0.00 -0.84 0.00 0.00 61.79 60.53 2k33 h SER 60 Cb 1.15 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 63.69 2k33 h SER 60 CO 0.63 0.00 0.09 0.77 -1.14 0.00 0.00 176.83 177.17 2k33 h SER 61 N 0.00 0.00 -0.52 3.07 4.64 -1.94 0.25 113.55 119.04 2k33 h SER 61 Ca 0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.47 2k33 h SER 61 Cb 0.85 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.94 2k33 h SER 61 CO -0.00 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.96 2k33 n LEU 62 N -3.84 3.61 -0.54 5.97 -0.00 0.40 -4.14 117.00 118.46 2k33 n LEU 62 Ca -0.01 -1.66 0.06 0.00 -0.00 0.00 0.00 56.01 54.40 2k33 n LEU 62 Cb 0.19 -0.34 0.12 0.00 -0.00 0.00 0.00 43.42 43.38 2k33 n LEU 62 CO 0.27 0.83 0.37 0.00 -0.00 0.00 0.00 177.39 178.86 2k33 n ALA 63 N 1.53 2.67 -2.58 1.47 0.00 0.85 -4.76 120.51 119.69 2k33 n ALA 63 Ca 0.21 -2.51 -0.02 0.00 0.00 0.00 0.00 53.44 51.13 2k33 n ALA 63 Cb 0.61 -0.45 0.08 0.00 0.00 0.00 0.00 19.45 19.69 2k33 n ALA 63 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 2k33 n THR 64 N -0.78 0.00 -3.39 0.00 -1.04 -1.02 -4.96 114.28 103.08 2k33 n THR 64 Ca 0.13 -0.67 -0.10 0.00 -2.04 0.00 0.00 64.05 61.37 2k33 n THR 64 Cb 0.75 0.83 -0.09 0.00 -1.82 0.00 0.00 70.33 69.99 2k33 n THR 64 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 2k33 s LEU 65 N -2.75 -0.57 -0.28 -4.42 1.43 -1.26 -5.00 118.68 105.82 2k33 s LEU 65 Ca 0.06 0.24 -0.10 0.00 -1.03 0.00 0.00 54.13 53.30 2k33 s LEU 65 Cb 0.30 1.05 -0.04 0.00 0.03 0.00 0.00 46.19 47.53 2k33 s LEU 65 CO -0.09 -0.30 0.16 -1.81 0.23 0.00 0.00 176.35 174.54 2k33 s ASP 66 N 2.52 5.73 0.08 2.29 1.01 -1.26 -5.00 116.67 122.04 2k33 s ASP 66 Ca 0.11 -0.14 0.08 0.00 0.71 0.00 0.00 52.55 53.31 2k33 s ASP 66 Cb -0.15 -2.05 -0.04 0.00 1.01 0.00 0.00 42.92 41.69 2k33 s ASP 66 CO -0.15 -0.07 -0.20 -1.00 0.21 0.00 0.00 175.17 173.96 2k33 s HIS 67 N 1.70 2.51 -0.11 4.23 3.76 -1.26 -2.52 115.29 123.59 2k33 s HIS 67 Ca 0.07 -0.28 0.01 0.00 -0.15 0.00 0.00 55.06 54.71 2k33 s HIS 67 Cb -0.16 -1.39 0.02 0.00 1.11 0.00 0.00 32.58 32.15 2k33 s HIS 67 CO 0.08 0.30 -0.15 0.99 -0.85 0.00 0.00 174.74 175.11 2k33 s THR 68 N -1.01 1.49 0.32 1.30 2.01 0.10 -4.96 115.64 114.89 2k33 s THR 68 Ca 0.16 -0.63 -0.18 0.00 0.31 0.00 0.00 61.69 61.34 2k33 s THR 68 Cb -0.10 -1.37 -0.09 0.00 0.01 0.00 0.00 72.50 70.94 2k33 s THR 68 CO 0.07 0.44 0.79 -1.61 -0.69 0.00 0.00 174.62 173.62 2k33 s GLU 69 N 1.07 4.15 -0.52 4.92 2.02 -1.26 -0.46 118.70 128.61 2k33 s GLU 69 Ca -0.05 0.85 -0.17 0.00 0.02 0.00 0.00 54.97 55.62 2k33 s GLU 69 Cb -0.15 -2.52 0.09 0.00 0.10 0.00 0.00 34.13 31.65 2k33 s GLU 69 CO -0.03 0.19 0.54 0.42 0.02 0.00 0.00 175.26 176.40 2k33 s ILE 70 N -1.88 5.05 0.32 -1.63 1.09 0.14 -4.74 121.20 119.54 2k33 s ILE 70 Ca 0.53 -0.98 -0.04 0.00 -1.10 0.00 0.00 60.65 59.06 2k33 s ILE 70 Cb -0.12 -4.29 -0.05 0.00 -1.06 0.00 0.00 42.46 36.94 2k33 s ILE 70 CO 0.18 -0.81 0.57 -1.59 -0.10 0.00 0.00 174.94 173.19 2k33 s LYS 71 N 2.12 3.59 0.24 2.79 -2.85 -1.26 -0.76 119.74 123.62 2k33 s LYS 71 Ca 0.08 -0.06 -0.22 0.00 -1.00 0.00 0.00 55.97 54.78 2k33 s LYS 71 Cb -0.24 -2.63 -0.09 0.00 -2.06 0.00 0.00 37.83 32.82 2k33 s LYS 71 CO 0.07 0.16 0.79 0.00 0.10 0.00 0.00 175.35 176.48 2k33 s ALA 72 N -2.19 3.36 0.11 0.59 0.00 0.12 -4.84 121.76 118.91 2k33 s ALA 72 Ca 0.43 0.28 -0.14 0.00 0.00 0.00 0.00 51.96 52.53 2k33 s ALA 72 Cb -0.10 -2.93 -0.07 0.00 0.00 0.00 0.00 23.12 20.01 2k33 s ALA 72 CO 0.33 0.28 1.43 -1.00 0.00 0.00 0.00 175.76 176.80 2k33 h PRO 73 N 3.43 0.77 -3.81 0.00 0.13 -1.90 -1.88 132.00 128.73 2k33 h PRO 73 Ca -0.47 -0.40 -0.16 0.00 -0.87 0.00 0.00 66.00 64.09 2k33 h PRO 73 Cb 1.19 0.01 -0.07 0.00 0.13 0.00 0.00 31.00 32.27 2k33 h PRO 73 CO 0.65 1.03 -0.11 -0.59 -0.23 0.00 0.00 178.00 178.75 2k33 s PHE 74 N -4.37 0.69 0.46 1.56 -0.12 -1.26 -4.42 117.98 110.52 2k33 s PHE 74 Ca -0.12 -1.03 -0.07 0.00 -0.05 0.00 0.00 56.93 55.66 2k33 s PHE 74 Cb 0.09 0.13 -0.04 0.00 -0.63 0.00 0.00 43.02 42.57 2k33 s PHE 74 CO 0.84 -1.14 0.78 0.34 -0.05 0.00 0.00 175.22 175.99 2k33 s ASP 75 N -3.14 6.34 0.00 1.98 -1.08 -1.26 -4.20 116.67 115.31 2k33 s ASP 75 Ca 0.26 1.00 0.00 0.00 -0.52 0.00 0.00 52.55 53.28 2k33 s ASP 75 Cb -0.01 -2.27 0.00 0.00 -1.46 0.00 0.00 42.92 39.18 2k33 s ASP 75 CO 0.15 -0.53 0.00 0.61 0.52 0.00 0.00 175.17 175.93 2k33 n GLY 76 N -1.96 -0.18 3.67 2.66 0.00 -1.02 -4.72 105.19 103.64 2k33 n GLY 76 Ca 0.01 -1.32 -0.37 0.00 0.00 0.00 0.00 46.02 44.34 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 -2.98 5.26 0.13 2.61 2.01 0.47 -2.45 115.64 120.68 2k33 s THR 77 Ca 0.00 0.52 -0.11 0.00 0.31 0.00 0.00 61.69 62.41 2k33 s THR 77 Cb 0.00 -3.64 -0.06 0.00 0.01 0.00 0.00 72.50 68.80 2k33 s THR 77 CO 0.00 0.29 0.47 -0.51 -0.69 0.00 0.00 174.62 174.19 2k33 s ILE 78 N 1.17 4.99 0.00 1.82 2.07 -1.10 0.22 121.20 130.38 2k33 s ILE 78 Ca 0.15 0.57 0.00 0.00 -1.41 0.00 0.00 60.65 59.96 2k33 s ILE 78 Cb -0.14 -3.67 0.00 0.00 0.13 0.00 0.00 42.46 38.77 2k33 s ILE 78 CO 0.06 0.21 0.00 0.61 -1.91 0.00 0.00 174.94 173.91 2k33 n GLY 79 N 0.68 3.94 3.80 1.50 0.00 -0.99 -2.12 105.19 112.00 2k33 n GLY 79 Ca -0.05 -1.96 -0.33 0.00 0.00 0.00 0.00 46.02 43.68 2k33 n GLY 79 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2k33 s ASP 80 N -0.13 6.00 0.82 1.61 2.15 -1.26 -3.79 116.67 122.07 2k33 s ASP 80 Ca 0.00 1.88 0.00 0.00 0.43 0.00 0.00 52.55 54.86 2k33 s ASP 80 Cb 0.00 -2.55 0.00 0.00 -0.30 0.00 0.00 42.92 40.07 2k33 s ASP 80 CO 0.00 -1.01 0.00 0.00 -0.17 0.00 0.00 175.17 173.99 2k33 n ALA 81 N -1.58 0.00 0.01 3.66 0.00 -1.26 -4.33 120.51 117.01 2k33 n ALA 81 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.53 2k33 n ALA 81 Cb 0.53 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.98 2k33 n ALA 81 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2k33 n LEU 82 N 0.00 -0.03 -4.99 0.00 4.77 0.33 -4.83 117.00 112.25 2k33 n LEU 82 Ca 0.00 0.04 -0.20 0.00 -0.03 0.00 0.00 56.01 55.82 2k33 n LEU 82 Cb 0.00 0.06 0.03 0.00 -2.33 0.00 0.00 43.42 41.17 2k33 n LEU 82 CO 0.00 -0.52 0.21 0.68 -1.33 0.00 0.00 177.39 176.43 2k33 s VAL 83 N -2.00 2.38 0.24 4.08 -7.23 -1.26 -5.03 120.40 111.59 2k33 s VAL 83 Ca 0.00 -1.11 0.02 0.00 -1.81 0.00 0.00 61.98 59.07 2k33 s VAL 83 Cb 0.00 -2.49 -0.01 0.00 0.56 0.00 0.00 36.38 34.44 2k33 s VAL 83 CO 0.00 0.00 0.06 0.59 -0.31 0.00 0.00 175.10 175.44 2k33 n ASN 84 N -1.98 1.53 -4.83 4.85 3.02 -1.26 -5.04 115.26 111.55 2k33 n ASN 84 Ca 0.10 -2.22 -0.31 0.00 -0.03 0.00 0.00 54.58 52.12 2k33 n ASN 84 Cb 0.61 0.48 0.03 0.00 -0.61 0.00 0.00 39.78 40.29 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 -2.30 4.17 -0.98 2.41 -1.09 -1.26 -3.70 121.20 118.46 2k33 s ILE 85 Ca 0.09 0.79 0.00 0.00 -2.23 0.00 0.00 60.65 59.30 2k33 s ILE 85 Cb 0.00 -3.52 0.00 0.00 -1.58 0.00 0.00 42.46 37.36 2k33 s ILE 85 CO 0.06 -0.84 0.00 0.61 -1.23 0.00 0.00 174.94 173.54 2k33 n GLY 86 N -1.93 1.06 3.63 6.18 0.00 -0.99 -4.97 105.19 108.17 2k33 n GLY 86 Ca 0.07 -0.44 -0.31 0.00 0.00 0.00 0.00 46.02 45.34 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 -2.74 4.77 -0.15 1.61 1.01 -1.24 -4.92 116.67 115.01 2k33 s ASP 87 Ca 0.00 -0.16 -0.23 0.00 0.71 0.00 0.00 52.55 52.86 2k33 s ASP 87 Cb 0.00 -1.12 -0.02 0.00 1.01 0.00 0.00 42.92 42.79 2k33 s ASP 87 CO 0.00 0.24 0.72 -0.47 0.21 0.00 0.00 175.17 175.87 2k33 s TYR 88 N -1.12 3.45 0.16 4.23 5.04 -1.26 -0.21 117.35 127.63 2k33 s TYR 88 Ca 0.20 1.14 0.07 0.00 -2.44 0.00 0.00 57.07 56.04 2k33 s TYR 88 Cb -0.11 -2.88 -0.04 0.00 0.35 0.00 0.00 41.96 39.28 2k33 s TYR 88 CO 0.11 -0.12 0.02 0.14 -1.34 0.00 0.00 175.55 174.36 2k33 s VAL 89 N 1.67 3.87 -0.72 3.14 -7.23 0.19 -4.94 120.40 116.38 2k33 s VAL 89 Ca 0.35 -1.29 -0.03 0.00 -1.81 0.00 0.00 61.98 59.19 2k33 s VAL 89 Cb -0.17 -2.93 0.18 0.00 0.56 0.00 0.00 36.38 34.03 2k33 s VAL 89 CO 0.13 -0.06 0.56 -0.44 -0.31 0.00 0.00 175.10 174.98 2k33 s SER 90 N -2.83 5.56 0.25 4.85 0.01 -1.26 -2.60 113.70 117.67 2k33 s SER 90 Ca 0.27 -3.09 0.00 0.00 1.31 0.00 0.00 55.95 54.44 2k33 s SER 90 Cb -0.10 -1.90 0.00 0.00 0.21 0.00 0.00 66.02 64.23 2k33 s SER 90 CO 0.19 -0.33 0.00 0.00 0.41 0.00 0.00 173.24 173.51 2k33 n ALA 91 N 3.19 0.00 0.20 1.44 0.00 -1.25 -1.07 120.51 123.03 2k33 n ALA 91 Ca 0.12 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.68 2k33 n ALA 91 Cb 0.38 0.00 0.62 0.00 0.00 0.00 0.00 19.45 20.45 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 1.43 0.00 -0.08 0.00 0.02 -1.80 -1.99 113.55 111.13 2k33 h SER 92 Ca 0.00 0.00 0.01 0.00 -0.84 0.00 0.00 61.79 60.96 2k33 h SER 92 Cb 0.00 0.00 -0.00 0.00 0.14 0.00 0.00 62.40 62.54 2k33 h SER 92 CO 0.00 0.00 0.05 0.74 -1.14 0.00 0.00 176.83 176.48 2k33 h THR 93 N 0.00 1.00 -2.90 -2.27 2.02 -1.46 -3.42 112.91 105.87 2k33 h THR 93 Ca 0.00 -0.03 -0.54 0.00 0.77 0.00 0.00 66.41 66.62 2k33 h THR 93 Cb 0.05 0.92 0.01 0.00 -1.74 0.00 0.00 68.15 67.39 2k33 h THR 93 CO 0.00 0.01 0.82 0.28 0.37 0.00 0.00 175.52 177.00 2k33 s THR 94 N -5.12 3.43 -0.38 3.16 -1.32 -0.75 -4.94 115.64 109.72 2k33 s THR 94 Ca -0.05 0.92 -0.11 0.00 -1.21 0.00 0.00 61.69 61.24 2k33 s THR 94 Cb 0.17 -3.59 0.03 0.00 -1.51 0.00 0.00 72.50 67.60 2k33 s THR 94 CO 0.68 0.03 0.22 -1.83 -2.21 0.00 0.00 174.62 171.50 2k33 s GLU 95 N 1.94 2.81 -0.07 7.08 -1.05 -1.26 -4.60 118.70 123.56 2k33 s GLU 95 Ca 0.66 -1.10 -0.07 0.00 -0.15 0.00 0.00 54.97 54.30 2k33 s GLU 95 Cb -0.35 -3.76 -0.02 0.00 -0.44 0.00 0.00 34.13 29.56 2k33 s GLU 95 CO 0.29 -0.72 -0.14 1.28 0.95 0.00 0.00 175.26 176.92 2k33 n LEU 96 N 5.01 0.82 -4.29 1.83 7.99 -1.25 -4.24 117.00 122.87 2k33 n LEU 96 Ca -0.12 0.14 -0.17 0.00 -0.01 0.00 0.00 56.01 55.85 2k33 n LEU 96 Cb 0.46 -0.57 -0.10 0.00 -0.11 0.00 0.00 43.42 43.10 2k33 n LEU 96 CO 0.37 -0.42 -0.44 0.54 -1.51 0.00 0.00 177.39 175.93 2k33 s VAL 97 N -1.80 1.50 0.12 4.08 0.11 -1.26 0.12 120.40 123.27 2k33 s VAL 97 Ca -0.12 -2.04 0.09 0.00 -2.93 0.00 0.00 61.98 56.99 2k33 s VAL 97 Cb 0.02 -1.86 -0.04 0.00 -1.53 0.00 0.00 36.38 32.97 2k33 s VAL 97 CO 0.17 -0.58 -0.22 0.00 -3.33 0.00 0.00 175.10 171.14 2k33 s ARG 98 N -3.38 1.23 0.01 1.54 1.70 -1.26 0.13 118.95 118.91 2k33 s ARG 98 Ca 0.17 -1.25 0.01 0.00 -0.47 0.00 0.00 55.73 54.20 2k33 s ARG 98 Cb -0.01 -1.54 -0.04 0.00 -0.57 0.00 0.00 34.95 32.79 2k33 s ARG 98 CO 0.04 0.36 0.04 0.08 -1.08 0.00 0.00 175.30 174.73 2k33 s VAL 99 N -1.23 4.39 0.10 4.99 1.01 0.18 -2.35 120.40 127.49 2k33 s VAL 99 Ca 0.10 -0.57 0.02 0.00 0.00 0.00 0.00 61.98 61.53 2k33 s VAL 99 Cb -0.10 -3.00 -0.04 0.00 0.00 0.00 0.00 36.38 33.25 2k33 s VAL 99 CO 0.05 0.33 -0.07 -0.89 0.00 0.00 0.00 175.10 174.52 2k33 s THR 100 N -1.16 0.73 -0.21 3.92 2.01 0.13 -2.74 115.64 118.32 2k33 s THR 100 Ca 0.22 -1.87 -0.05 0.00 0.31 0.00 0.00 61.69 60.29 2k33 s THR 100 Cb -0.12 -1.60 0.02 0.00 0.01 0.00 0.00 72.50 70.81 2k33 s THR 100 CO 0.13 -0.81 0.11 -3.20 -0.69 0.00 0.00 174.62 170.16 2k33 n ASN 101 N 0.08 -4.59 0.10 3.53 5.15 -1.26 -0.40 115.26 117.87 2k33 n ASN 101 Ca -0.13 1.29 0.00 0.00 -0.60 0.00 0.00 54.58 55.14 2k33 n ASN 101 Cb 0.60 -4.73 0.00 0.00 -0.53 0.00 0.00 39.78 35.12 2k33 n ASN 101 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2k33 n LEU 102 N 1.33 -0.42 -4.73 1.20 -0.00 -1.26 -3.64 117.00 109.49 2k33 n LEU 102 Ca -0.18 0.36 -0.33 0.00 -0.00 0.00 0.00 56.01 55.86 2k33 n LEU 102 Cb 0.33 0.55 0.09 0.00 -0.00 0.00 0.00 43.42 44.39 2k33 n LEU 102 CO 0.36 -0.61 0.75 0.20 -0.00 0.00 0.00 177.39 178.09 2k33 s ASN 103 N -4.68 4.24 -0.68 1.45 0.01 -1.26 -4.89 114.94 109.14 2k33 s ASN 103 Ca 0.00 2.16 -0.26 0.00 -0.71 0.00 0.00 52.86 54.05 2k33 s ASN 103 Cb 0.00 -2.57 -0.03 0.00 0.41 0.00 0.00 41.25 39.07 2k33 s ASN 103 CO 0.00 -2.22 1.88 -2.16 -1.51 0.00 0.00 177.10 173.09 2k33 s PRO 104 N -4.23 2.61 0.44 -0.60 0.04 -1.26 -4.98 135.00 127.03 2k33 s PRO 104 Ca 0.69 0.41 -0.15 0.00 0.04 0.00 0.00 61.00 62.00 2k33 s PRO 104 Cb -0.24 -4.54 -0.08 0.00 0.04 0.00 0.00 34.50 29.68 2k33 s PRO 104 CO 0.48 -2.88 0.87 0.42 0.04 0.00 0.00 177.00 175.93 2k33 s ILE 105 N 9.32 4.62 0.00 0.56 -1.09 -1.26 -4.99 121.20 128.36 2k33 s ILE 105 Ca 0.68 1.00 0.00 0.00 -2.23 0.00 0.00 60.65 60.10 2k33 s ILE 105 Cb -0.11 -3.70 0.00 0.00 -1.58 0.00 0.00 42.46 37.07 2k33 s ILE 105 CO 0.16 -0.53 0.00 -1.22 -1.23 0.00 0.00 174.94 172.12 2k33 n TYR 106 N -1.23 0.00 -1.77 3.97 4.02 -1.26 -5.04 117.16 115.85 2k33 n TYR 106 Ca 0.05 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.52 2k33 n TYR 106 Cb 0.54 0.08 -0.03 0.00 -0.02 0.00 0.00 39.34 39.91 2k33 n TYR 106 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2k33 s ALA 107 N -1.79 3.67 0.82 -0.72 0.00 -1.26 -4.96 121.76 117.52 2k33 s ALA 107 Ca 0.00 1.30 -0.10 0.00 0.00 0.00 0.00 51.96 53.16 2k33 s ALA 107 Cb 0.00 -3.78 0.09 0.00 0.00 0.00 0.00 23.12 19.43 2k33 s ALA 107 CO 0.00 -1.35 1.11 0.16 0.00 0.00 0.00 175.76 175.68 2k33 s ASP 108 N 3.37 3.94 0.00 0.00 1.47 -1.26 -5.06 116.67 119.13 2k33 s ASP 108 Ca 0.82 1.96 0.00 0.00 1.18 0.00 0.00 52.55 56.50 2k33 s ASP 108 Cb -0.42 -2.54 0.00 0.00 -0.34 0.00 0.00 42.92 39.62 2k33 s ASP 108 CO 0.37 -2.42 0.00 0.61 0.68 0.00 0.00 175.17 174.41 2k33 n GLY 109 N -0.70 1.01 0.23 2.12 0.00 -1.26 -4.90 105.19 101.69 2k33 n GLY 109 Ca 0.10 -1.11 -0.01 0.00 0.00 0.00 0.00 46.02 45.00 2k33 n GLY 109 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2k33 h SER 110 N 0.00 0.35 -3.26 1.61 0.87 -2.06 -3.42 113.55 107.64 2k33 h SER 110 Ca 0.00 -0.10 -0.59 0.00 -1.23 0.00 0.00 61.79 59.87 2k33 h SER 110 Cb 0.00 -0.09 -0.08 0.00 -0.44 0.00 0.00 62.40 61.78 2k33 h SER 110 CO 0.00 0.58 -0.23 -1.00 -0.53 0.00 0.00 176.83 175.66 2k33 s HIS 111 N -4.52 3.52 -0.91 2.24 3.76 -1.26 -4.99 115.29 113.13 2k33 s HIS 111 Ca -0.06 0.78 -0.03 0.00 -0.15 0.00 0.00 55.06 55.61 2k33 s HIS 111 Cb 0.14 -2.42 0.25 0.00 1.11 0.00 0.00 32.58 31.66 2k33 s HIS 111 CO 0.77 0.27 2.16 0.72 -0.85 0.00 0.00 174.74 177.81 2k33 n HIS 112 N 3.34 2.60 -0.91 1.40 -0.00 -1.26 -4.88 115.22 115.50 2k33 n HIS 112 Ca -0.10 -2.41 -0.33 0.00 -0.00 0.00 0.00 57.72 54.89 2k33 n HIS 112 Cb 0.52 -1.33 0.14 0.00 -0.00 0.00 0.00 29.99 29.32 2k33 n HIS 112 CO 0.00 0.00 0.00 -2.39 -0.00 0.00 0.00 176.34 173.95 2k33 n HIS 113 N 0.23 0.69 -1.59 4.41 1.44 -1.26 -4.95 115.22 114.20 2k33 n HIS 113 Ca 0.52 0.38 -0.02 0.00 -2.01 0.00 0.00 57.72 56.59 2k33 n HIS 113 Cb 0.30 -2.02 0.18 0.00 0.12 0.00 0.00 29.99 28.57 2k33 n HIS 113 CO 0.00 0.00 0.00 1.58 -2.81 0.00 0.00 176.34 175.11 2k33 n HIS 114 N -3.65 0.78 -2.55 -1.40 -0.00 -1.26 -5.01 115.22 102.13 2k33 n HIS 114 Ca 0.12 -1.65 -0.00 0.00 0.46 0.00 0.00 57.72 56.64 2k33 n HIS 114 Cb 0.51 -0.38 -0.00 0.00 -0.12 0.00 0.00 29.99 30.00 2k33 n HIS 114 CO 0.00 0.00 0.00 0.72 0.46 0.00 0.00 176.34 177.52 2k33 n HIS 115 N -1.08 -3.47 0.02 1.57 8.25 -1.26 -5.34 115.22 113.91 2k33 n HIS 115 Ca 0.28 1.54 0.00 0.00 -0.26 0.00 0.00 57.72 59.29 2k33 n HIS 115 Cb 0.85 -3.68 0.01 0.00 1.12 0.00 0.00 29.99 28.30 2k33 n HIS 115 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59