#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 0.20 -0.03 2.53 1.01 -1.02 -5.02 120.40 118.07 2k33 s VAL 2 Ca 0.00 -0.27 -0.18 0.00 0.00 0.00 0.00 61.98 61.53 2k33 s VAL 2 Cb 0.00 -0.21 -0.05 0.00 0.00 0.00 0.00 36.38 36.12 2k33 s VAL 2 CO 0.00 -0.05 0.51 -0.63 0.00 0.00 0.00 175.10 174.93 2k33 s ILE 3 N -0.32 5.00 -0.52 2.22 1.01 -1.26 -0.04 121.20 127.28 2k33 s ILE 3 Ca -0.02 1.05 -0.22 0.00 0.00 0.00 0.00 60.65 61.46 2k33 s ILE 3 Cb -0.03 -3.84 0.04 0.00 0.01 0.00 0.00 42.46 38.65 2k33 s ILE 3 CO -0.00 0.45 0.82 -0.63 0.00 0.00 0.00 174.94 175.58 2k33 s ILE 4 N -0.31 4.58 0.12 2.92 1.01 -0.12 -4.91 121.20 124.51 2k33 s ILE 4 Ca 0.27 0.04 0.05 0.00 0.00 0.00 0.00 60.65 61.01 2k33 s ILE 4 Cb -0.17 -4.43 -0.04 0.00 0.01 0.00 0.00 42.46 37.83 2k33 s ILE 4 CO 0.14 -0.97 -0.13 -0.54 0.00 0.00 0.00 174.94 173.45 2k33 s LYS 5 N 3.44 1.00 0.32 2.79 1.02 -1.26 -4.15 119.74 122.90 2k33 s LYS 5 Ca 0.25 -1.27 -0.29 0.00 0.02 0.00 0.00 55.97 54.69 2k33 s LYS 5 Cb -0.15 -0.79 -0.10 0.00 -0.52 0.00 0.00 37.83 36.28 2k33 s LYS 5 CO 0.17 0.14 1.22 -1.25 -0.92 0.00 0.00 175.35 174.71 2k33 s PRO 6 N -2.90 4.42 0.00 -1.68 0.04 -1.26 -4.77 135.00 128.85 2k33 s PRO 6 Ca 0.10 2.04 0.32 0.00 0.04 0.00 0.00 61.00 63.49 2k33 s PRO 6 Cb -0.03 -3.07 1.84 0.00 0.04 0.00 0.00 34.50 33.28 2k33 s PRO 6 CO 0.02 -0.07 2.20 0.94 0.04 0.00 0.00 177.00 180.13 2k33 n GLN 7 N 0.85 0.97 -4.03 4.56 7.27 -1.26 0.20 117.38 125.94 2k33 n GLN 7 Ca 0.00 -0.03 -0.08 0.00 0.07 0.00 0.00 57.00 56.95 2k33 n GLN 7 Cb 0.43 -1.50 -0.09 0.00 2.41 0.00 0.00 30.24 31.49 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 -2.05 0.16 -0.14 1.69 -7.23 -1.26 -4.74 120.40 106.81 2k33 s VAL 8 Ca 0.46 -1.63 -0.08 0.00 -1.81 0.00 0.00 61.98 58.92 2k33 s VAL 8 Cb 0.22 -1.63 -0.04 0.00 0.56 0.00 0.00 36.38 35.48 2k33 s VAL 8 CO 0.38 -0.71 0.13 -0.55 -0.31 0.00 0.00 175.10 174.03 2k33 s SER 9 N -2.94 6.26 0.00 4.85 0.15 -1.26 -3.20 113.70 117.56 2k33 s SER 9 Ca 0.12 0.37 0.00 0.00 0.70 0.00 0.00 55.95 57.14 2k33 s SER 9 Cb 0.07 -2.05 0.00 0.00 -1.71 0.00 0.00 66.02 62.33 2k33 s SER 9 CO -0.06 0.33 0.00 0.61 1.20 0.00 0.00 173.24 175.32 2k33 n GLY 10 N 2.50 -0.45 3.23 9.45 0.00 -0.94 -4.51 105.19 114.47 2k33 n GLY 10 Ca -0.19 0.58 -0.13 0.00 0.00 0.00 0.00 46.02 46.28 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 0.00 0.05 0.41 1.61 1.01 -1.12 -1.31 120.40 121.06 2k33 s VAL 11 Ca 0.00 -0.45 -0.25 0.00 0.00 0.00 0.00 61.98 61.28 2k33 s VAL 11 Cb 0.00 -0.59 -0.08 0.00 0.00 0.00 0.00 36.38 35.70 2k33 s VAL 11 CO 0.00 -0.24 1.27 -0.63 0.00 0.00 0.00 175.10 175.49 2k33 s ILE 12 N -1.20 2.74 -0.10 2.22 -1.09 -0.96 -1.38 121.20 121.42 2k33 s ILE 12 Ca -0.13 0.64 0.03 0.00 -2.23 0.00 0.00 60.65 58.97 2k33 s ILE 12 Cb -0.05 -3.37 -0.09 0.00 -1.58 0.00 0.00 42.46 37.37 2k33 s ILE 12 CO 0.04 0.08 -0.05 0.52 -1.23 0.00 0.00 174.94 174.29 2k33 n VAL 13 N 0.04 0.63 -3.78 2.92 0.31 0.13 -2.42 118.33 116.16 2k33 n VAL 13 Ca 0.04 -0.29 -0.01 0.00 -0.01 0.00 0.00 64.34 64.08 2k33 n VAL 13 Cb 0.44 -0.85 0.00 0.00 -0.91 0.00 0.00 33.84 32.53 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 -4.73 -0.06 -0.32 4.52 2.47 -1.23 -4.87 114.94 110.72 2k33 s ASN 14 Ca -0.11 -0.35 -0.02 0.00 0.42 0.00 0.00 52.86 52.80 2k33 s ASN 14 Cb 0.03 0.32 0.11 0.00 -1.45 0.00 0.00 41.25 40.27 2k33 s ASN 14 CO 0.29 -0.62 0.15 -0.54 -3.72 0.00 0.00 177.10 172.66 2k33 s LYS 15 N -2.50 0.49 -1.20 0.43 1.02 -1.26 -1.96 119.74 114.76 2k33 s LYS 15 Ca 0.18 -0.97 -0.04 0.00 0.02 0.00 0.00 55.97 55.16 2k33 s LYS 15 Cb 0.01 -1.48 0.16 0.00 -0.52 0.00 0.00 37.83 35.99 2k33 s LYS 15 CO 0.01 -1.07 2.30 1.28 -0.92 0.00 0.00 175.35 176.95 2k33 n LEU 16 N 4.73 7.81 -3.99 3.17 4.32 0.14 -4.90 117.00 128.28 2k33 n LEU 16 Ca 0.00 -4.93 -0.11 0.00 -0.02 0.00 0.00 56.01 50.95 2k33 n LEU 16 Cb 0.40 -1.31 -0.03 0.00 -1.62 0.00 0.00 43.42 40.86 2k33 n LEU 16 CO 0.10 2.03 0.24 0.72 -1.22 0.00 0.00 177.39 179.26 2k33 s PHE 17 N -1.85 0.57 0.15 -1.77 -0.71 -1.18 -4.01 117.98 109.17 2k33 s PHE 17 Ca 0.52 -0.94 0.06 0.00 -1.04 0.00 0.00 56.93 55.52 2k33 s PHE 17 Cb 0.20 0.23 -0.04 0.00 -1.21 0.00 0.00 43.02 42.20 2k33 s PHE 17 CO -0.12 -1.17 -0.13 0.15 -1.34 0.00 0.00 175.22 172.61 2k33 s LYS 18 N -3.31 1.11 -0.54 1.99 -0.14 -1.26 -5.10 119.74 112.49 2k33 s LYS 18 Ca 0.24 -1.37 -0.25 0.00 -1.36 0.00 0.00 55.97 53.23 2k33 s LYS 18 Cb -0.02 -0.90 0.04 0.00 -1.68 0.00 0.00 37.83 35.27 2k33 s LYS 18 CO 0.14 0.16 0.96 0.00 -0.76 0.00 0.00 175.35 175.84 2k33 s ALA 19 N -2.59 3.16 0.00 5.17 0.00 -1.26 -3.48 121.76 122.76 2k33 s ALA 19 Ca 0.14 -1.14 0.00 0.00 0.00 0.00 0.00 51.96 50.96 2k33 s ALA 19 Cb -0.02 -3.74 0.00 0.00 0.00 0.00 0.00 23.12 19.35 2k33 s ALA 19 CO 0.03 -2.35 0.00 0.41 0.00 0.00 0.00 175.76 173.85 2k33 n GLY 20 N 5.09 0.92 2.89 0.00 0.00 -0.71 -4.90 105.19 108.48 2k33 n GLY 20 Ca 0.03 -0.03 -0.17 0.00 0.00 0.00 0.00 46.02 45.85 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 0.05 1.06 -4.86 1.61 9.92 -1.23 -4.81 116.55 118.30 2k33 n ASP 21 Ca 0.00 -1.88 -0.29 0.00 -0.53 0.00 0.00 54.79 52.09 2k33 n ASP 21 Cb 0.00 -0.46 -0.05 0.00 -0.64 0.00 0.00 41.12 39.97 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 -4.36 3.17 0.49 -1.24 1.02 -1.26 -1.49 119.74 116.07 2k33 s LYS 22 Ca 0.49 -0.62 0.03 0.00 0.02 0.00 0.00 55.97 55.88 2k33 s LYS 22 Cb -0.03 -2.86 -0.02 0.00 -0.52 0.00 0.00 37.83 34.40 2k33 s LYS 22 CO 0.32 0.56 0.03 0.14 -0.92 0.00 0.00 175.35 175.48 2k33 s VAL 23 N -1.55 1.37 0.40 3.17 -7.23 0.97 -4.91 120.40 112.63 2k33 s VAL 23 Ca 0.32 -1.96 0.05 0.00 -1.81 0.00 0.00 61.98 58.58 2k33 s VAL 23 Cb -0.12 -2.33 -0.02 0.00 0.56 0.00 0.00 36.38 34.47 2k33 s VAL 23 CO 0.25 0.00 0.18 0.29 -0.31 0.00 0.00 175.10 175.51 2k33 n LYS 24 N -1.24 0.53 -2.59 4.82 5.02 -1.26 -2.39 118.16 121.04 2k33 n LYS 24 Ca -0.15 -3.53 -0.41 0.00 -2.02 0.00 0.00 58.31 52.19 2k33 n LYS 24 Cb 0.67 2.12 -0.03 0.00 -0.02 0.00 0.00 35.03 37.77 2k33 n LYS 24 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2k33 s LYS 25 N -3.56 3.42 0.00 1.97 1.02 -1.26 -3.24 119.74 118.09 2k33 s LYS 25 Ca 0.25 -0.82 0.00 0.00 0.02 0.00 0.00 55.97 55.42 2k33 s LYS 25 Cb 0.01 -4.84 0.00 0.00 -0.52 0.00 0.00 37.83 32.48 2k33 s LYS 25 CO 0.18 -2.14 0.00 0.41 -0.92 0.00 0.00 175.35 172.88 2k33 n GLY 26 N 6.17 0.90 3.69 -3.33 0.00 0.76 -4.95 105.19 108.42 2k33 n GLY 26 Ca 0.20 -0.09 -0.42 0.00 0.00 0.00 0.00 46.02 45.70 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 -0.60 4.40 0.12 1.61 0.74 -1.20 -4.57 119.66 120.15 2k33 s GLN 27 Ca 0.00 1.57 -0.31 0.00 0.05 0.00 0.00 55.36 56.67 2k33 s GLN 27 Cb 0.00 -3.53 -0.10 0.00 1.10 0.00 0.00 33.01 30.48 2k33 s GLN 27 CO 0.00 -0.36 1.70 0.99 -0.55 0.00 0.00 175.29 177.07 2k33 s THR 28 N 1.98 2.71 0.00 -0.34 2.01 -1.26 -1.21 115.64 119.53 2k33 s THR 28 Ca 0.53 0.29 0.00 0.00 0.31 0.00 0.00 61.69 62.82 2k33 s THR 28 Cb -0.23 -3.19 0.00 0.00 0.01 0.00 0.00 72.50 69.10 2k33 s THR 28 CO 0.21 0.01 0.00 0.18 -0.69 0.00 0.00 174.62 174.33 2k33 n LEU 29 N 5.21 0.35 -4.12 4.42 4.77 -0.76 -4.65 117.00 122.22 2k33 n LEU 29 Ca 0.16 0.00 -0.10 0.00 -0.03 0.00 0.00 56.01 56.04 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 0.64 0.06 -0.17 -0.36 -1.33 0.00 0.00 177.39 176.23 2k33 s PHE 30 N -1.75 0.83 -0.06 -1.77 0.40 -1.02 0.25 117.98 114.86 2k33 s PHE 30 Ca 0.00 -1.14 -0.06 0.00 -0.60 0.00 0.00 56.93 55.13 2k33 s PHE 30 Cb 0.00 -0.35 0.02 0.00 0.51 0.00 0.00 43.02 43.19 2k33 s PHE 30 CO 0.00 -0.66 0.16 0.42 0.70 0.00 0.00 175.22 175.84 2k33 s ILE 31 N -4.07 0.00 -0.08 0.64 1.01 -0.83 0.01 121.20 117.88 2k33 s ILE 31 Ca 0.28 -0.02 -0.06 0.00 0.00 0.00 0.00 60.65 60.85 2k33 s ILE 31 Cb 0.06 -0.24 0.03 0.00 0.01 0.00 0.00 42.46 42.31 2k33 s ILE 31 CO 0.06 -0.01 0.20 -0.63 0.00 0.00 0.00 174.94 174.56 2k33 s ILE 32 N 0.03 -0.02 -0.12 2.92 1.01 -0.82 0.23 121.20 124.44 2k33 s ILE 32 Ca -0.01 0.06 -0.16 0.00 0.00 0.00 0.00 60.65 60.54 2k33 s ILE 32 Cb -0.01 -0.30 -0.05 0.00 0.01 0.00 0.00 42.46 42.12 2k33 s ILE 32 CO 0.00 0.02 0.40 -0.70 0.00 0.00 0.00 174.94 174.67 2k33 s GLU 33 N 0.51 4.25 0.00 2.79 -6.30 -0.48 -0.47 118.70 119.00 2k33 s GLU 33 Ca -0.03 0.32 0.00 0.00 -2.50 0.00 0.00 54.97 52.76 2k33 s GLU 33 Cb -0.05 -3.40 0.00 0.00 0.00 0.00 0.00 34.13 30.68 2k33 s GLU 33 CO -0.03 0.26 0.00 0.00 0.02 0.00 0.00 175.26 175.51 2k33 n GLN 34 N 3.38 2.66 -0.84 4.30 0.00 -1.26 -2.78 117.38 122.84 2k33 n GLN 34 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 57.00 56.90 2k33 n GLN 34 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.76 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 0.00 0.00 -3.94 2.61 -0.08 -1.26 -4.17 116.55 109.71 2k33 n ASP 35 Ca 0.00 0.00 -0.34 0.00 -1.51 0.00 0.00 54.79 52.94 2k33 n ASP 35 Cb 0.00 0.00 0.00 0.00 2.34 0.00 0.00 41.12 43.46 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 -2.00 -1.41 -0.91 -0.67 1.13 -1.26 -4.84 117.38 107.42 2k33 n GLN 36 Ca 0.00 0.29 -0.18 0.00 -1.94 0.00 0.00 57.00 55.16 2k33 n GLN 36 Cb 0.00 -3.69 0.12 0.00 0.11 0.00 0.00 30.24 26.78 2k33 n GLN 36 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2k33 n ALA 37 N -4.54 4.86 -1.30 -1.58 0.00 -1.26 -5.03 120.51 111.66 2k33 n ALA 37 Ca -0.18 -2.15 0.17 0.00 0.00 0.00 0.00 53.44 51.29 2k33 n ALA 37 Cb 0.62 -1.35 -0.05 0.00 0.00 0.00 0.00 19.45 18.66 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 -0.64 -7.76 -0.09 0.00 7.64 -1.26 -4.36 113.62 107.15 2k33 n SER 38 Ca 0.44 0.73 -0.19 0.00 1.01 0.00 0.00 58.87 60.86 2k33 n SER 38 Cb 1.27 -4.07 -0.06 0.00 -1.01 0.00 0.00 64.21 60.33 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 -4.03 0.38 -1.24 1.43 4.01 -1.26 -4.62 118.16 112.83 2k33 n LYS 39 Ca -0.01 0.17 -0.28 0.00 -0.51 0.00 0.00 58.31 57.67 2k33 n LYS 39 Cb 0.60 -1.13 0.13 0.00 -0.51 0.00 0.00 35.03 34.12 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 -3.80 5.53 -0.19 4.39 -0.08 -1.26 -4.93 116.55 116.21 2k33 n ASP 40 Ca -0.35 -3.64 0.00 0.00 -1.51 0.00 0.00 54.79 49.29 2k33 n ASP 40 Cb 0.75 -0.90 0.00 0.00 2.34 0.00 0.00 41.12 43.31 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 -0.98 0.00 -0.85 -0.67 7.35 -1.26 -4.87 117.46 116.18 2k33 n PHE 41 Ca 0.59 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 57.28 2k33 n PHE 41 Cb 1.19 0.00 0.00 0.00 0.35 0.00 0.00 39.48 41.02 2k33 n PHE 41 CO 0.00 0.00 0.00 0.27 -0.76 0.00 0.00 176.76 176.27 2k33 n ASN 42 N -0.27 -0.45 0.00 -2.13 6.94 -1.26 -4.52 115.26 113.57 2k33 n ASN 42 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 54.58 54.56 2k33 n ASN 42 Cb 0.00 -0.08 0.00 0.00 -2.36 0.00 0.00 39.78 37.34 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 -2.15 0.00 -1.67 -3.83 0.63 -1.26 -4.79 116.66 103.59 2k33 n ARG 43 Ca 0.00 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 56.93 2k33 n ARG 43 Cb 0.00 0.00 0.00 0.00 0.45 0.00 0.00 32.46 32.91 2k33 n ARG 43 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 2k33 n SER 44 N 1.98 -7.35 0.01 6.15 2.88 -1.26 -4.86 113.62 111.16 2k33 n SER 44 Ca 0.00 1.05 -0.06 0.00 -1.33 0.00 0.00 58.87 58.53 2k33 n SER 44 Cb 0.00 -4.05 -0.04 0.00 -0.75 0.00 0.00 64.21 59.37 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 3.19 -0.23 -1.36 -1.46 6.56 -1.95 -3.46 116.57 117.86 2k33 h LYS 45 Ca 0.00 0.02 0.14 0.00 -1.06 0.00 0.00 60.65 59.75 2k33 h LYS 45 Cb 0.00 0.05 -0.25 0.00 -0.57 0.00 0.00 32.23 31.46 2k33 h LYS 45 CO 0.00 -0.15 0.70 0.00 -2.06 0.00 0.00 179.45 177.94 2k33 s ALA 46 N -4.39 -2.01 1.07 3.86 0.00 -1.26 -5.18 121.76 113.86 2k33 s ALA 46 Ca -0.06 1.71 -0.17 0.00 0.00 0.00 0.00 51.96 53.44 2k33 s ALA 46 Cb 0.03 -1.04 0.23 0.00 0.00 0.00 0.00 23.12 22.34 2k33 s ALA 46 CO 0.24 -0.28 1.21 -0.51 0.00 0.00 0.00 175.76 176.41 2k33 s LEU 47 N -1.05 1.70 0.12 0.00 1.02 -1.26 -5.03 118.68 114.18 2k33 s LEU 47 Ca 0.02 0.50 -0.19 0.00 0.02 0.00 0.00 54.13 54.49 2k33 s LEU 47 Cb -0.01 -2.43 -0.07 0.00 0.02 0.00 0.00 46.19 43.71 2k33 s LEU 47 CO -0.02 -3.37 0.60 -0.36 0.02 0.00 0.00 176.35 173.22 2k33 s PHE 48 N -3.42 3.74 0.00 0.29 0.40 -1.26 -4.93 117.98 112.80 2k33 s PHE 48 Ca 0.72 1.26 0.18 0.00 -0.60 0.00 0.00 56.93 58.49 2k33 s PHE 48 Cb -0.08 -2.50 0.30 0.00 0.51 0.00 0.00 43.02 41.25 2k33 s PHE 48 CO 0.54 0.51 1.11 0.45 0.70 0.00 0.00 175.22 178.53 2k33 n SER 49 N 1.33 0.45 -2.36 1.36 2.88 -1.26 -5.06 113.62 110.96 2k33 n SER 49 Ca -0.08 -1.98 -0.04 0.00 -1.33 0.00 0.00 58.87 55.44 2k33 n SER 49 Cb 0.51 -0.15 -0.03 0.00 -0.75 0.00 0.00 64.21 63.79 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 0.35 -4.01 -3.86 -1.46 7.27 -1.26 -4.37 117.38 110.04 2k33 n GLN 50 Ca -0.03 3.07 -0.26 0.00 0.07 0.00 0.00 57.00 59.85 2k33 n GLN 50 Cb 1.01 -4.37 0.01 0.00 2.41 0.00 0.00 30.24 29.30 2k33 n GLN 50 CO 0.00 0.00 0.00 0.45 0.07 0.00 0.00 177.06 177.58 2k33 n SER 51 N 1.46 -2.22 -0.01 1.69 2.88 -1.26 -4.87 113.62 111.29 2k33 n SER 51 Ca -0.29 -0.86 0.09 0.00 -1.33 0.00 0.00 58.87 56.47 2k33 n SER 51 Cb 0.45 -3.69 -0.13 0.00 -0.75 0.00 0.00 64.21 60.09 2k33 n SER 51 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2k33 n ALA 52 N -4.43 2.63 -0.58 -1.46 0.00 -1.26 -4.55 120.51 110.85 2k33 n ALA 52 Ca -0.17 -0.42 0.00 0.00 0.00 0.00 0.00 53.44 52.85 2k33 n ALA 52 Cb 0.62 -0.59 0.00 0.00 0.00 0.00 0.00 19.45 19.48 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 -2.11 0.20 -1.23 0.00 -5.35 -1.26 -5.02 119.36 104.59 2k33 n ILE 53 Ca -0.03 -0.31 0.12 0.00 -0.27 0.00 0.00 62.75 62.26 2k33 n ILE 53 Cb 0.46 1.21 -0.07 0.00 -1.74 0.00 0.00 39.64 39.50 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 -0.10 -6.67 -0.04 7.28 7.64 -1.26 -4.45 113.62 116.02 2k33 n SER 54 Ca 0.00 1.30 -0.00 0.00 1.01 0.00 0.00 58.87 61.17 2k33 n SER 54 Cb 0.26 -4.17 -0.15 0.00 -1.01 0.00 0.00 64.21 59.14 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 -3.71 0.67 -0.89 1.43 6.02 -1.26 -4.20 117.38 115.43 2k33 n GLN 55 Ca -0.07 -0.04 -0.12 0.00 -0.01 0.00 0.00 57.00 56.77 2k33 n GLN 55 Cb 0.55 -1.57 0.19 0.00 1.02 0.00 0.00 30.24 30.43 2k33 n GLN 55 CO 0.00 0.00 0.00 0.36 -1.01 0.00 0.00 177.06 176.41 2k33 n LYS 56 N -2.59 2.61 -0.62 -1.09 2.85 -1.26 -3.93 118.16 114.12 2k33 n LYS 56 Ca -0.18 -2.40 -0.00 0.00 -1.05 0.00 0.00 58.31 54.68 2k33 n LYS 56 Cb 0.88 -1.98 -0.01 0.00 -0.65 0.00 0.00 35.03 33.27 2k33 n LYS 56 CO 0.00 0.00 0.00 0.39 -0.05 0.00 0.00 177.40 177.74 2k33 n GLU 57 N -0.41 0.00 -3.17 -1.58 1.02 -1.26 -4.96 120.64 110.28 2k33 n GLU 57 Ca 0.40 -0.58 -0.20 0.00 -0.02 0.00 0.00 57.16 56.76 2k33 n GLU 57 Cb 1.30 -0.12 -0.03 0.00 -0.02 0.00 0.00 31.44 32.56 2k33 n GLU 57 CO 0.00 0.00 0.00 0.98 1.18 0.00 0.00 177.13 179.29 2k33 n TYR 58 N 0.04 0.58 -0.36 -0.32 9.36 -1.25 -4.95 117.16 120.25 2k33 n TYR 58 Ca -0.02 -3.82 -0.01 0.00 3.32 0.00 0.00 57.90 57.37 2k33 n TYR 58 Cb 0.63 -0.42 0.01 0.00 -0.63 0.00 0.00 39.34 38.93 2k33 n TYR 58 CO 0.00 0.00 0.00 -0.25 0.22 0.00 0.00 176.86 176.83 2k33 n ASP 59 N 0.32 -1.36 0.04 2.98 9.92 -1.26 -4.96 116.55 122.23 2k33 n ASP 59 Ca 0.25 -0.37 0.05 0.00 -0.53 0.00 0.00 54.79 54.20 2k33 n ASP 59 Cb 0.62 -0.03 -0.07 0.00 -0.64 0.00 0.00 41.12 40.99 2k33 n ASP 59 CO 0.00 0.00 0.00 -1.20 0.13 0.00 0.00 177.20 176.13 2k33 n SER 60 N -3.07 0.67 0.18 -2.24 7.64 -1.26 -3.80 113.62 111.73 2k33 n SER 60 Ca 0.00 0.28 0.15 0.00 1.01 0.00 0.00 58.87 60.31 2k33 n SER 60 Cb 0.02 0.60 0.75 0.00 -1.01 0.00 0.00 64.21 64.56 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 0.00 0.48 6.43 4.64 -2.04 -0.48 113.55 122.59 2k33 h SER 61 Ca -0.11 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.16 2k33 h SER 61 Cb 1.33 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.42 2k33 h SER 61 CO 0.02 0.00 -1.56 0.00 -0.87 0.00 0.00 176.83 174.42 2k33 n LEU 62 N -4.18 0.45 -4.70 5.97 -0.00 -1.26 -4.89 117.00 108.40 2k33 n LEU 62 Ca 0.02 0.18 -0.42 0.00 -0.00 0.00 0.00 56.01 55.79 2k33 n LEU 62 Cb 0.30 0.02 -0.03 0.00 -0.00 0.00 0.00 43.42 43.72 2k33 n LEU 62 CO 0.32 -0.01 0.79 0.00 -0.00 0.00 0.00 177.39 178.48 2k33 s ALA 63 N -3.30 3.33 -0.62 1.47 0.00 -0.19 -5.00 121.76 117.45 2k33 s ALA 63 Ca -0.05 0.52 0.01 0.00 0.00 0.00 0.00 51.96 52.44 2k33 s ALA 63 Cb 0.11 -3.42 0.16 0.00 0.00 0.00 0.00 23.12 19.97 2k33 s ALA 63 CO 0.84 -0.48 0.41 0.99 0.00 0.00 0.00 175.76 177.52 2k33 s THR 64 N 1.60 3.27 -0.28 0.00 2.01 -1.26 -4.93 115.64 116.06 2k33 s THR 64 Ca 0.52 -3.32 -0.04 0.00 0.31 0.00 0.00 61.69 59.15 2k33 s THR 64 Cb -0.21 -3.16 0.15 0.00 0.01 0.00 0.00 72.50 69.29 2k33 s THR 64 CO 0.23 -0.88 0.56 -0.76 -0.69 0.00 0.00 174.62 173.08 2k33 s LEU 65 N -0.42 -1.12 -0.53 4.42 1.43 -1.26 -5.02 118.68 116.17 2k33 s LEU 65 Ca 0.19 0.96 -0.17 0.00 -1.03 0.00 0.00 54.13 54.08 2k33 s LEU 65 Cb -0.20 1.94 0.10 0.00 0.03 0.00 0.00 46.19 48.07 2k33 s LEU 65 CO -0.04 -0.25 0.52 -1.81 0.23 0.00 0.00 176.35 174.99 2k33 s ASP 66 N 2.79 6.18 0.07 2.29 1.01 -1.26 -5.05 116.67 122.70 2k33 s ASP 66 Ca 0.10 -1.51 0.04 0.00 0.71 0.00 0.00 52.55 51.89 2k33 s ASP 66 Cb -0.14 -2.23 -0.04 0.00 1.01 0.00 0.00 42.92 41.52 2k33 s ASP 66 CO -0.19 -0.85 -0.01 -1.00 0.21 0.00 0.00 175.17 173.33 2k33 s HIS 67 N 1.90 2.97 -0.44 4.23 3.76 -1.26 -4.08 115.29 122.37 2k33 s HIS 67 Ca 0.06 -0.02 -0.17 0.00 -0.15 0.00 0.00 55.06 54.77 2k33 s HIS 67 Cb -0.26 -1.55 0.03 0.00 1.11 0.00 0.00 32.58 31.91 2k33 s HIS 67 CO 0.05 0.46 0.45 0.99 -0.85 0.00 0.00 174.74 175.85 2k33 s THR 68 N -1.25 5.09 -0.41 1.30 2.01 0.38 -4.98 115.64 117.77 2k33 s THR 68 Ca 0.24 -0.47 -0.29 0.00 0.31 0.00 0.00 61.69 61.47 2k33 s THR 68 Cb -0.12 -4.08 0.02 0.00 0.01 0.00 0.00 72.50 68.33 2k33 s THR 68 CO 0.16 -0.49 1.23 -1.61 -0.69 0.00 0.00 174.62 173.22 2k33 s GLU 69 N 2.12 3.75 -0.93 4.92 2.02 -1.26 -1.95 118.70 127.37 2k33 s GLU 69 Ca 0.11 0.83 -0.24 0.00 0.02 0.00 0.00 54.97 55.69 2k33 s GLU 69 Cb -0.18 -3.92 -0.01 0.00 0.10 0.00 0.00 34.13 30.12 2k33 s GLU 69 CO 0.12 -1.34 1.74 0.42 0.02 0.00 0.00 175.26 176.22 2k33 s ILE 70 N 4.63 3.63 -0.03 -1.63 1.09 0.10 -4.96 121.20 124.02 2k33 s ILE 70 Ca 0.53 -0.48 -0.13 0.00 -1.10 0.00 0.00 60.65 59.46 2k33 s ILE 70 Cb -0.11 -4.42 -0.05 0.00 -1.06 0.00 0.00 42.46 36.82 2k33 s ILE 70 CO 0.29 -1.34 0.35 -1.59 -0.10 0.00 0.00 174.94 172.55 2k33 s LYS 71 N 6.22 3.85 0.58 2.79 0.00 -1.26 -1.82 119.74 130.10 2k33 s LYS 71 Ca 0.60 0.29 -0.20 0.00 0.00 0.00 0.00 55.97 56.67 2k33 s LYS 71 Cb -0.04 -3.23 -0.04 0.00 0.00 0.00 0.00 37.83 34.52 2k33 s LYS 71 CO -0.03 0.67 1.27 0.00 0.00 0.00 0.00 175.35 177.27 2k33 s ALA 72 N -0.95 2.61 0.01 0.59 0.00 -0.35 -4.79 121.76 118.88 2k33 s ALA 72 Ca 0.22 1.16 -0.23 0.00 0.00 0.00 0.00 51.96 53.10 2k33 s ALA 72 Cb -0.16 -3.51 -0.18 0.00 0.00 0.00 0.00 23.12 19.28 2k33 s ALA 72 CO 0.11 -1.31 1.30 -1.00 0.00 0.00 0.00 175.76 174.87 2k33 h PRO 73 N 1.06 0.17 -3.24 0.00 0.13 -1.92 0.22 132.00 128.41 2k33 h PRO 73 Ca -0.51 -0.09 -0.07 0.00 -0.87 0.00 0.00 66.00 64.46 2k33 h PRO 73 Cb 1.31 0.00 -0.15 0.00 0.13 0.00 0.00 31.00 32.28 2k33 h PRO 73 CO 0.56 0.60 -0.15 -0.59 -0.23 0.00 0.00 178.00 178.19 2k33 s PHE 74 N -4.28 -0.18 0.71 1.56 -0.12 -1.26 -4.19 117.98 110.22 2k33 s PHE 74 Ca -0.15 0.02 -0.16 0.00 -0.05 0.00 0.00 56.93 56.59 2k33 s PHE 74 Cb 0.03 0.18 -0.01 0.00 -0.63 0.00 0.00 43.02 42.59 2k33 s PHE 74 CO 0.71 -0.59 0.84 -0.40 -0.05 0.00 0.00 175.22 175.73 2k33 n ASP 75 N 0.29 0.01 0.00 1.98 5.75 -1.22 -4.47 116.55 118.89 2k33 n ASP 75 Ca -0.18 0.66 0.00 0.00 -0.01 0.00 0.00 54.79 55.26 2k33 n ASP 75 Cb 0.61 -1.35 0.00 0.00 -1.03 0.00 0.00 41.12 39.35 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 1.27 -0.37 3.85 6.12 0.00 -1.01 -4.74 105.19 110.31 2k33 n GLY 76 Ca 0.12 -0.99 -0.33 0.00 0.00 0.00 0.00 46.02 44.82 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 -3.59 5.12 -0.01 2.61 2.01 -0.30 -0.02 115.64 121.47 2k33 s THR 77 Ca 0.00 -0.28 0.07 0.00 0.31 0.00 0.00 61.69 61.79 2k33 s THR 77 Cb 0.00 -3.38 -0.02 0.00 0.01 0.00 0.00 72.50 69.10 2k33 s THR 77 CO 0.00 0.32 -0.23 -0.51 -0.69 0.00 0.00 174.62 173.51 2k33 s ILE 78 N -1.28 2.31 0.00 1.82 2.07 -0.56 -1.03 121.20 124.53 2k33 s ILE 78 Ca 0.26 -1.09 0.00 0.00 -1.41 0.00 0.00 60.65 58.40 2k33 s ILE 78 Cb -0.12 -1.85 0.00 0.00 0.13 0.00 0.00 42.46 40.62 2k33 s ILE 78 CO 0.17 0.53 0.00 0.61 -1.91 0.00 0.00 174.94 174.34 2k33 n GLY 79 N 2.23 -1.04 3.88 1.50 0.00 -1.02 -1.73 105.19 109.00 2k33 n GLY 79 Ca -0.16 -1.60 -0.36 0.00 0.00 0.00 0.00 46.02 43.90 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 -1.08 6.53 0.05 1.61 -1.08 -1.26 -3.38 116.67 118.05 2k33 s ASP 80 Ca 0.00 0.61 -0.34 0.00 -0.52 0.00 0.00 52.55 52.30 2k33 s ASP 80 Cb 0.00 -2.11 -0.13 0.00 -1.46 0.00 0.00 42.92 39.22 2k33 s ASP 80 CO 0.00 0.29 1.70 0.00 0.52 0.00 0.00 175.17 177.68 2k33 n ALA 81 N 1.38 1.07 0.02 3.66 0.00 -1.26 -4.71 120.51 120.66 2k33 n ALA 81 Ca -0.13 0.38 -0.22 0.00 0.00 0.00 0.00 53.44 53.47 2k33 n ALA 81 Cb 0.53 -2.40 -0.14 0.00 0.00 0.00 0.00 19.45 17.44 2k33 n ALA 81 CO 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 177.50 177.43 2k33 h LEU 82 N 7.25 0.41 0.00 0.00 3.38 -1.67 -3.48 115.31 121.20 2k33 h LEU 82 Ca -0.46 -0.87 -0.36 0.00 0.09 0.00 0.00 57.88 56.28 2k33 h LEU 82 Cb 1.26 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 41.84 2k33 h LEU 82 CO 0.91 1.63 -0.20 1.33 0.09 0.00 0.00 178.44 182.20 2k33 n VAL 83 N -3.90 0.00 -3.86 1.22 0.24 -1.26 -5.10 118.33 105.67 2k33 n VAL 83 Ca -0.25 -1.37 0.00 0.00 -2.04 0.00 0.00 64.34 60.69 2k33 n VAL 83 Cb 0.91 -0.10 0.00 0.00 -1.47 0.00 0.00 33.84 33.18 2k33 n VAL 83 CO 0.00 0.00 0.00 0.59 -2.14 0.00 0.00 176.83 175.28 2k33 n ASN 84 N -1.75 1.79 -4.84 -1.34 3.02 -1.26 -5.12 115.26 105.77 2k33 n ASN 84 Ca -0.04 -0.86 -0.32 0.00 -0.03 0.00 0.00 54.58 53.34 2k33 n ASN 84 Cb 0.39 0.00 0.01 0.00 -0.61 0.00 0.00 39.78 39.57 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 -0.84 4.32 -0.68 2.41 -1.09 -1.26 -3.65 121.20 120.41 2k33 s ILE 85 Ca 0.00 0.90 0.00 0.00 -2.23 0.00 0.00 60.65 59.32 2k33 s ILE 85 Cb 0.00 -3.62 0.00 0.00 -1.58 0.00 0.00 42.46 37.26 2k33 s ILE 85 CO 0.00 -0.85 0.00 0.61 -1.23 0.00 0.00 174.94 173.47 2k33 n GLY 86 N -1.95 0.80 3.63 6.18 0.00 -1.02 -4.93 105.19 107.91 2k33 n GLY 86 Ca 0.07 -0.25 -0.39 0.00 0.00 0.00 0.00 46.02 45.45 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 -2.47 6.39 0.18 1.61 1.11 -1.24 -4.75 116.67 117.51 2k33 s ASP 87 Ca 0.00 0.47 -0.32 0.00 0.18 0.00 0.00 52.55 52.88 2k33 s ASP 87 Cb 0.00 -2.25 -0.11 0.00 1.07 0.00 0.00 42.92 41.63 2k33 s ASP 87 CO 0.00 -0.19 1.77 -0.47 1.18 0.00 0.00 175.17 177.46 2k33 s TYR 88 N 1.91 2.62 0.28 4.23 5.04 -1.26 -2.26 117.35 127.90 2k33 s TYR 88 Ca 0.19 0.19 0.10 0.00 -2.44 0.00 0.00 57.07 55.11 2k33 s TYR 88 Cb -0.15 -4.17 -0.05 0.00 0.35 0.00 0.00 41.96 37.94 2k33 s TYR 88 CO 0.09 -4.57 -0.05 0.14 -1.34 0.00 0.00 175.55 169.82 2k33 s VAL 89 N 1.74 3.08 -0.43 3.14 -7.23 -0.42 -4.95 120.40 115.33 2k33 s VAL 89 Ca 0.77 -2.05 0.02 0.00 -1.81 0.00 0.00 61.98 58.91 2k33 s VAL 89 Cb -0.49 -2.69 0.13 0.00 0.56 0.00 0.00 36.38 33.89 2k33 s VAL 89 CO 0.34 -0.36 0.21 -0.44 -0.31 0.00 0.00 175.10 174.54 2k33 s SER 90 N -3.64 3.87 0.22 4.85 0.01 -1.26 -2.21 113.70 115.54 2k33 s SER 90 Ca 0.32 -2.55 0.00 0.00 1.31 0.00 0.00 55.95 55.03 2k33 s SER 90 Cb -0.05 -1.15 0.00 0.00 0.21 0.00 0.00 66.02 65.03 2k33 s SER 90 CO 0.19 -0.28 0.00 0.00 0.41 0.00 0.00 173.24 173.55 2k33 n ALA 91 N 3.66 0.00 0.33 1.44 0.00 -1.19 -1.64 120.51 123.10 2k33 n ALA 91 Ca 0.06 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.57 2k33 n ALA 91 Cb 0.35 0.00 0.27 0.00 0.00 0.00 0.00 19.45 20.07 2k33 n ALA 91 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2k33 n SER 92 N -3.78 0.13 0.20 0.00 2.88 0.13 -2.36 113.62 110.82 2k33 n SER 92 Ca 0.00 0.54 0.05 0.00 -1.33 0.00 0.00 58.87 58.13 2k33 n SER 92 Cb 0.00 -0.57 0.50 0.00 -0.75 0.00 0.00 64.21 63.40 2k33 n SER 92 CO 0.00 0.00 0.00 0.74 -1.23 0.00 0.00 175.04 174.55 2k33 h THR 93 N 0.00 1.11 -2.56 2.46 2.02 -1.58 -3.39 112.91 110.98 2k33 h THR 93 Ca 0.00 -0.52 -0.56 0.00 0.77 0.00 0.00 66.41 66.10 2k33 h THR 93 Cb 0.18 1.21 -0.09 0.00 -1.74 0.00 0.00 68.15 67.71 2k33 h THR 93 CO 0.00 0.16 0.93 -0.89 0.37 0.00 0.00 175.52 176.09 2k33 s THR 94 N -4.77 3.90 -0.33 3.16 2.01 -0.90 -4.98 115.64 113.72 2k33 s THR 94 Ca -0.05 0.33 -0.16 0.00 0.31 0.00 0.00 61.69 62.13 2k33 s THR 94 Cb 0.16 -4.84 -0.01 0.00 0.01 0.00 0.00 72.50 67.82 2k33 s THR 94 CO 0.70 -1.69 0.39 -1.83 -0.69 0.00 0.00 174.62 171.50 2k33 s GLU 95 N 5.26 3.63 -0.14 4.92 -1.05 -1.26 -4.42 118.70 125.64 2k33 s GLU 95 Ca 0.33 -0.31 0.11 0.00 -0.15 0.00 0.00 54.97 54.95 2k33 s GLU 95 Cb -0.10 -3.79 -0.16 0.00 -0.44 0.00 0.00 34.13 29.65 2k33 s GLU 95 CO 0.16 -0.51 0.03 1.47 0.95 0.00 0.00 175.26 177.35 2k33 n LEU 96 N 5.44 0.29 -3.65 1.83 -0.00 -1.26 -4.94 117.00 114.71 2k33 n LEU 96 Ca -0.08 -0.01 -0.14 0.00 -0.00 0.00 0.00 56.01 55.78 2k33 n LEU 96 Cb 0.49 0.24 -0.08 0.00 -0.00 0.00 0.00 43.42 44.08 2k33 n LEU 96 CO 0.41 0.37 0.35 -0.69 -0.00 0.00 0.00 177.39 177.83 2k33 s VAL 97 N -2.32 -0.00 0.21 1.47 1.01 -1.26 -1.60 120.40 117.91 2k33 s VAL 97 Ca -0.08 0.00 0.09 0.00 0.00 0.00 0.00 61.98 61.99 2k33 s VAL 97 Cb 0.04 -0.92 -0.04 0.00 0.00 0.00 0.00 36.38 35.46 2k33 s VAL 97 CO 0.53 0.00 -0.09 0.00 0.00 0.00 0.00 175.10 175.54 2k33 s ARG 98 N 0.39 2.05 -0.19 2.72 1.70 -1.26 -0.94 118.95 123.41 2k33 s ARG 98 Ca -0.00 -1.37 -0.07 0.00 -0.47 0.00 0.00 55.73 53.82 2k33 s ARG 98 Cb -0.05 -2.10 -0.03 0.00 -0.57 0.00 0.00 34.95 32.20 2k33 s ARG 98 CO 0.00 0.40 0.04 0.08 -1.08 0.00 0.00 175.30 174.75 2k33 s VAL 99 N -1.94 4.48 0.42 4.99 1.01 0.95 -2.44 120.40 127.86 2k33 s VAL 99 Ca 0.27 -0.14 0.07 0.00 0.00 0.00 0.00 61.98 62.18 2k33 s VAL 99 Cb -0.08 -3.03 -0.05 0.00 0.00 0.00 0.00 36.38 33.23 2k33 s VAL 99 CO 0.16 0.43 0.19 0.28 0.00 0.00 0.00 175.10 176.16 2k33 s THR 100 N 0.69 2.29 0.29 3.92 -1.32 -0.19 -1.68 115.64 119.64 2k33 s THR 100 Ca 0.02 -1.69 0.00 0.00 -1.21 0.00 0.00 61.69 58.81 2k33 s THR 100 Cb -0.14 -2.97 0.00 0.00 -1.51 0.00 0.00 72.50 67.88 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 -1.25 -5.63 -1.32 8.08 5.15 -1.26 -1.15 115.26 117.88 2k33 n ASN 101 Ca -0.01 0.60 0.16 0.00 -0.60 0.00 0.00 54.58 54.73 2k33 n ASN 101 Cb 0.65 -2.99 -0.08 0.00 -0.53 0.00 0.00 39.78 36.83 2k33 n ASN 101 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 2k33 n LEU 102 N -3.53 -0.89 -4.69 1.20 7.99 -1.26 -4.22 117.00 111.59 2k33 n LEU 102 Ca -0.02 2.06 -0.29 0.00 -0.01 0.00 0.00 56.01 57.76 2k33 n LEU 102 Cb 0.44 -3.39 -0.08 0.00 -0.11 0.00 0.00 43.42 40.28 2k33 n LEU 102 CO 0.02 -2.27 -0.32 0.54 -1.51 0.00 0.00 177.39 173.84 2k33 s ASN 103 N -7.01 5.01 -0.20 -1.43 2.20 -1.26 -4.53 114.94 107.72 2k33 s ASN 103 Ca 0.00 -0.23 -0.29 0.00 -0.94 0.00 0.00 52.86 51.40 2k33 s ASN 103 Cb 0.00 -1.18 -0.03 0.00 -2.00 0.00 0.00 41.25 38.05 2k33 s ASN 103 CO 0.00 0.14 1.60 -2.16 -2.94 0.00 0.00 177.10 173.74 2k33 s PRO 104 N -2.57 3.85 0.22 3.55 0.04 -1.26 -4.91 135.00 133.92 2k33 s PRO 104 Ca 0.27 1.70 0.06 0.00 0.04 0.00 0.00 61.00 63.07 2k33 s PRO 104 Cb -0.11 -4.02 -0.04 0.00 0.04 0.00 0.00 34.50 30.38 2k33 s PRO 104 CO 0.19 -1.23 0.17 0.42 0.04 0.00 0.00 177.00 176.59 2k33 s ILE 105 N 5.03 4.46 0.00 0.56 1.09 -1.26 -5.01 121.20 126.07 2k33 s ILE 105 Ca 0.71 -1.28 0.00 0.00 -1.10 0.00 0.00 60.65 58.98 2k33 s ILE 105 Cb -0.25 -3.36 0.00 0.00 -1.06 0.00 0.00 42.46 37.79 2k33 s ILE 105 CO 0.29 -0.26 0.00 -1.22 -0.10 0.00 0.00 174.94 173.65 2k33 n TYR 106 N -0.86 -0.16 -0.79 3.97 4.02 -1.26 -4.93 117.16 117.16 2k33 n TYR 106 Ca -0.08 0.00 -0.33 0.00 -0.01 0.00 0.00 57.90 57.48 2k33 n TYR 106 Cb 0.57 0.10 0.12 0.00 -0.02 0.00 0.00 39.34 40.11 2k33 n TYR 106 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 2k33 n ALA 107 N -1.71 -3.52 -2.22 -0.72 0.00 -1.26 -4.97 120.51 106.12 2k33 n ALA 107 Ca 0.00 -0.86 -0.30 0.00 0.00 0.00 0.00 53.44 52.28 2k33 n ALA 107 Cb 0.00 -1.60 -0.03 0.00 0.00 0.00 0.00 19.45 17.82 2k33 n ALA 107 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2k33 s ASP 108 N -1.82 6.49 0.21 0.00 2.15 -1.26 -5.10 116.67 117.36 2k33 s ASP 108 Ca 0.54 1.08 -0.07 0.00 0.43 0.00 0.00 52.55 54.52 2k33 s ASP 108 Cb -0.16 -2.30 -0.02 0.00 -0.30 0.00 0.00 42.92 40.14 2k33 s ASP 108 CO 0.69 -0.40 0.31 -0.83 -0.17 0.00 0.00 175.17 174.77 2k33 s GLY 109 N -3.24 0.88 0.08 2.66 0.00 -1.26 -5.06 107.32 101.38 2k33 s GLY 109 Ca 0.50 -1.20 -0.22 0.00 0.00 0.00 0.00 44.72 43.80 2k33 s GLY 109 CO 0.32 -0.97 1.66 0.23 0.00 0.00 0.00 173.10 174.34 2k33 h SER 110 N 2.45 0.11 -3.63 1.64 0.87 -2.07 -3.49 113.55 109.44 2k33 h SER 110 Ca -0.31 -0.11 0.32 0.00 -1.23 0.00 0.00 61.79 60.46 2k33 h SER 110 Cb 1.25 -0.03 -0.16 0.00 -0.44 0.00 0.00 62.40 63.02 2k33 h SER 110 CO 0.44 0.19 -1.03 1.57 -0.53 0.00 0.00 176.83 177.47 2k33 n HIS 111 N -4.97 -3.41 -4.14 2.24 -0.00 -1.26 -4.94 115.22 98.75 2k33 n HIS 111 Ca -0.06 1.85 -0.28 0.00 -0.00 0.00 0.00 57.72 59.24 2k33 n HIS 111 Cb 0.08 -3.10 -0.07 0.00 -0.00 0.00 0.00 29.99 26.90 2k33 n HIS 111 CO 0.00 0.00 0.00 -1.01 -0.00 0.00 0.00 176.34 175.33 2k33 s HIS 112 N -3.81 2.99 0.25 1.57 3.76 -1.26 -5.14 115.29 113.66 2k33 s HIS 112 Ca 0.00 -0.05 0.04 0.00 -0.15 0.00 0.00 55.06 54.90 2k33 s HIS 112 Cb 0.00 -1.48 -0.05 0.00 1.11 0.00 0.00 32.58 32.15 2k33 s HIS 112 CO 0.00 0.50 -0.00 -3.38 -0.85 0.00 0.00 174.74 171.01 2k33 s HIS 113 N -1.56 1.69 0.18 1.40 -3.43 -1.26 -5.17 115.29 107.14 2k33 s HIS 113 Ca 0.28 -0.90 -0.24 0.00 -0.80 0.00 0.00 55.06 53.40 2k33 s HIS 113 Cb -0.11 -1.00 0.07 0.00 -1.43 0.00 0.00 32.58 30.12 2k33 s HIS 113 CO 0.20 0.01 0.97 -1.58 -2.00 0.00 0.00 174.74 172.35 2k33 s HIS 114 N -3.34 -0.05 0.23 0.38 2.46 -1.26 -5.09 115.29 108.61 2k33 s HIS 114 Ca 0.30 -0.30 0.00 0.00 0.47 0.00 0.00 55.06 55.53 2k33 s HIS 114 Cb 0.06 0.67 0.00 0.00 -0.13 0.00 0.00 32.58 33.18 2k33 s HIS 114 CO 0.10 -0.90 0.00 1.58 -2.47 0.00 0.00 174.74 173.05 2k33 n HIS 115 N -0.54 -3.37 -0.40 3.88 -0.00 -1.26 -5.37 115.22 108.16 2k33 n HIS 115 Ca -0.05 0.79 0.00 0.00 0.46 0.00 0.00 57.72 58.92 2k33 n HIS 115 Cb 0.60 2.18 0.00 0.00 -0.12 0.00 0.00 29.99 32.65 2k33 n HIS 115 CO 0.00 0.00 0.00 1.58 0.46 0.00 0.00 176.34 178.38