#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 1.14 -0.16 2.12 1.01 -1.04 -5.05 120.40 118.43 2k33 s VAL 2 Ca 0.00 -1.47 -0.04 0.00 0.00 0.00 0.00 61.98 60.48 2k33 s VAL 2 Cb 0.00 -1.24 -0.03 0.00 0.00 0.00 0.00 36.38 35.12 2k33 s VAL 2 CO 0.00 -0.33 -0.04 -0.63 0.00 0.00 0.00 175.10 174.10 2k33 s ILE 3 N -1.68 3.85 -0.40 2.22 1.01 -1.26 0.17 121.20 125.10 2k33 s ILE 3 Ca 0.02 -0.37 -0.25 0.00 0.00 0.00 0.00 60.65 60.05 2k33 s ILE 3 Cb -0.08 -2.68 0.02 0.00 0.01 0.00 0.00 42.46 39.73 2k33 s ILE 3 CO 0.02 0.49 0.86 -0.63 0.00 0.00 0.00 174.94 175.69 2k33 s ILE 4 N 0.39 4.61 0.12 2.92 1.01 0.17 -4.87 121.20 125.55 2k33 s ILE 4 Ca -0.04 0.90 0.05 0.00 0.00 0.00 0.00 60.65 61.56 2k33 s ILE 4 Cb -0.14 -4.32 -0.04 0.00 0.01 0.00 0.00 42.46 37.97 2k33 s ILE 4 CO 0.03 -0.59 -0.12 -0.54 0.00 0.00 0.00 174.94 173.72 2k33 s LYS 5 N 3.40 0.97 0.32 2.79 1.02 -1.26 -3.75 119.74 123.23 2k33 s LYS 5 Ca 0.35 -1.27 -0.29 0.00 0.02 0.00 0.00 55.97 54.78 2k33 s LYS 5 Cb -0.12 -0.69 -0.10 0.00 -0.52 0.00 0.00 37.83 36.40 2k33 s LYS 5 CO 0.20 0.11 1.23 -1.25 -0.92 0.00 0.00 175.35 174.72 2k33 s PRO 6 N -3.01 4.44 -0.05 -1.68 0.04 -1.26 -4.77 135.00 128.71 2k33 s PRO 6 Ca 0.10 2.05 0.09 0.00 0.04 0.00 0.00 61.00 63.28 2k33 s PRO 6 Cb -0.02 -3.09 0.33 0.00 0.04 0.00 0.00 34.50 31.75 2k33 s PRO 6 CO 0.01 -0.05 1.17 0.00 0.04 0.00 0.00 177.00 178.17 2k33 n GLN 7 N 0.90 2.20 -3.73 4.56 10.64 -1.26 0.66 117.38 131.35 2k33 n GLN 7 Ca -0.00 -1.30 -0.14 0.00 -1.83 0.00 0.00 57.00 53.73 2k33 n GLN 7 Cb 0.43 -1.51 -0.09 0.00 -0.86 0.00 0.00 30.24 28.21 2k33 n GLN 7 CO 0.00 0.00 0.00 0.14 -1.83 0.00 0.00 177.06 175.37 2k33 s VAL 8 N -1.66 0.04 0.16 -0.39 -7.23 -1.26 -4.83 120.40 105.23 2k33 s VAL 8 Ca 0.23 -0.35 -0.14 0.00 -1.81 0.00 0.00 61.98 59.91 2k33 s VAL 8 Cb 0.15 -0.64 -0.07 0.00 0.56 0.00 0.00 36.38 36.38 2k33 s VAL 8 CO 0.12 -0.19 0.55 -0.44 -0.31 0.00 0.00 175.10 174.82 2k33 s SER 9 N -1.08 6.80 0.00 4.85 0.01 -1.26 -3.71 113.70 119.31 2k33 s SER 9 Ca -0.11 1.06 0.00 0.00 1.31 0.00 0.00 55.95 58.21 2k33 s SER 9 Cb -0.04 -2.28 0.00 0.00 0.21 0.00 0.00 66.02 63.91 2k33 s SER 9 CO 0.04 0.08 0.00 0.61 0.41 0.00 0.00 173.24 174.39 2k33 n GLY 10 N 0.70 -0.43 3.12 3.44 0.00 -1.02 -4.41 105.19 106.59 2k33 n GLY 10 Ca -0.05 0.24 -0.12 0.00 0.00 0.00 0.00 46.02 46.09 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 -0.02 0.44 1.61 1.01 -1.02 -0.74 120.40 121.68 2k33 s VAL 11 Ca 0.00 0.06 -0.25 0.00 0.00 0.00 0.00 61.98 61.79 2k33 s VAL 11 Cb 0.00 -0.39 -0.09 0.00 0.00 0.00 0.00 36.38 35.90 2k33 s VAL 11 CO 0.00 0.02 1.24 -0.38 0.00 0.00 0.00 175.10 175.98 2k33 n ILE 12 N 3.46 2.72 -0.02 2.22 2.08 -0.99 -1.67 119.36 127.15 2k33 n ILE 12 Ca -0.18 -0.50 -0.02 0.00 0.56 0.00 0.00 62.75 62.61 2k33 n ILE 12 Cb 0.56 -1.51 -0.02 0.00 -0.75 0.00 0.00 39.64 37.92 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 -0.39 0.22 -3.82 1.39 0.31 0.14 -2.03 118.33 114.15 2k33 n VAL 13 Ca 0.08 -0.10 -0.03 0.00 -0.01 0.00 0.00 64.34 64.28 2k33 n VAL 13 Cb 0.40 -0.71 0.01 0.00 -0.91 0.00 0.00 33.84 32.63 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 -4.11 -0.06 -0.29 4.52 2.47 -1.23 -4.85 114.94 111.38 2k33 s ASN 14 Ca -0.04 -0.52 -0.03 0.00 0.42 0.00 0.00 52.86 52.69 2k33 s ASN 14 Cb 0.01 0.45 0.11 0.00 -1.45 0.00 0.00 41.25 40.37 2k33 s ASN 14 CO 0.10 -0.87 0.17 -0.54 -3.72 0.00 0.00 177.10 172.24 2k33 s LYS 15 N -2.54 0.24 -1.24 0.43 1.02 -1.26 -1.50 119.74 114.89 2k33 s LYS 15 Ca 0.18 -0.49 -0.04 0.00 0.02 0.00 0.00 55.97 55.64 2k33 s LYS 15 Cb -0.01 -1.05 0.18 0.00 -0.52 0.00 0.00 37.83 36.42 2k33 s LYS 15 CO 0.03 -1.03 2.21 1.28 -0.92 0.00 0.00 175.35 176.92 2k33 n LEU 16 N 5.20 7.81 -3.83 3.17 4.77 0.15 -4.91 117.00 129.35 2k33 n LEU 16 Ca -0.04 -5.01 -0.09 0.00 -0.03 0.00 0.00 56.01 50.83 2k33 n LEU 16 Cb 0.43 -1.32 -0.06 0.00 -2.33 0.00 0.00 43.42 40.14 2k33 n LEU 16 CO 0.04 2.03 0.04 0.72 -1.33 0.00 0.00 177.39 178.88 2k33 s PHE 17 N -1.93 0.13 0.24 -1.77 -0.71 -1.20 -3.69 117.98 109.04 2k33 s PHE 17 Ca 0.49 -0.50 0.05 0.00 -1.04 0.00 0.00 56.93 55.94 2k33 s PHE 17 Cb 0.18 0.07 -0.05 0.00 -1.21 0.00 0.00 43.02 42.01 2k33 s PHE 17 CO -0.10 -0.70 -0.05 0.15 -1.34 0.00 0.00 175.22 173.19 2k33 s LYS 18 N -3.89 1.40 -0.24 1.99 3.01 -1.26 -5.07 119.74 115.68 2k33 s LYS 18 Ca 0.10 -1.69 -0.21 0.00 -1.01 0.00 0.00 55.97 53.15 2k33 s LYS 18 Cb 0.03 -0.90 -0.02 0.00 -1.01 0.00 0.00 37.83 35.93 2k33 s LYS 18 CO -0.06 0.00 0.67 0.00 0.51 0.00 0.00 175.35 176.47 2k33 s ALA 19 N -3.19 3.60 -0.27 5.17 0.00 -1.26 -3.81 121.76 122.01 2k33 s ALA 19 Ca 0.27 -0.33 0.00 0.00 0.00 0.00 0.00 51.96 51.90 2k33 s ALA 19 Cb 0.04 -3.06 0.00 0.00 0.00 0.00 0.00 23.12 20.10 2k33 s ALA 19 CO 0.09 -0.76 0.00 0.41 0.00 0.00 0.00 175.76 175.50 2k33 n GLY 20 N 3.98 0.48 4.03 0.00 0.00 -0.39 -5.00 105.19 108.29 2k33 n GLY 20 Ca 0.00 -0.90 -0.21 0.00 0.00 0.00 0.00 46.02 44.92 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 -2.94 4.83 -0.24 1.61 -1.08 -1.25 -4.87 116.67 112.72 2k33 s ASP 21 Ca 0.00 -0.79 -0.10 0.00 -0.52 0.00 0.00 52.55 51.14 2k33 s ASP 21 Cb 0.00 0.35 -0.05 0.00 -1.46 0.00 0.00 42.92 41.77 2k33 s ASP 21 CO 0.00 -1.55 0.14 -0.54 0.52 0.00 0.00 175.17 173.74 2k33 s LYS 22 N -4.83 3.96 0.31 4.34 1.02 -1.26 -2.42 119.74 120.86 2k33 s LYS 22 Ca 0.64 -0.32 0.07 0.00 0.02 0.00 0.00 55.97 56.37 2k33 s LYS 22 Cb -0.05 -3.49 -0.02 0.00 -0.52 0.00 0.00 37.83 33.74 2k33 s LYS 22 CO 0.41 -0.01 0.34 0.54 -0.92 0.00 0.00 175.35 175.71 2k33 s VAL 23 N 1.22 4.10 0.13 3.17 0.11 -0.46 -4.95 120.40 123.73 2k33 s VAL 23 Ca 0.07 -1.21 0.09 0.00 -2.93 0.00 0.00 61.98 58.00 2k33 s VAL 23 Cb -0.14 -3.39 -0.04 0.00 -1.53 0.00 0.00 36.38 31.28 2k33 s VAL 23 CO 0.05 -0.22 -0.21 -0.75 -3.33 0.00 0.00 175.10 170.64 2k33 s LYS 24 N -4.02 1.25 -0.72 1.54 2.47 -1.26 -2.40 119.74 116.59 2k33 s LYS 24 Ca 0.40 -1.29 -0.25 0.00 -1.56 0.00 0.00 55.97 53.27 2k33 s LYS 24 Cb -0.08 -1.50 -0.14 0.00 -1.46 0.00 0.00 37.83 34.65 2k33 s LYS 24 CO 0.28 0.34 2.41 1.63 0.16 0.00 0.00 175.35 180.17 2k33 n LYS 25 N 0.76 0.63 0.00 4.03 5.02 -1.26 0.21 118.16 127.55 2k33 n LYS 25 Ca -0.17 -0.40 0.00 0.00 -2.02 0.00 0.00 58.31 55.72 2k33 n LYS 25 Cb 0.55 -3.17 0.00 0.00 -0.02 0.00 0.00 35.03 32.39 2k33 n LYS 25 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2k33 n GLY 26 N 6.37 1.16 3.80 0.72 0.00 -0.72 -4.95 105.19 111.57 2k33 n GLY 26 Ca 0.47 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 46.14 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 -0.35 4.30 0.23 1.61 0.74 0.13 -4.64 119.66 121.68 2k33 s GLN 27 Ca 0.00 1.30 -0.30 0.00 0.05 0.00 0.00 55.36 56.41 2k33 s GLN 27 Cb 0.00 -2.46 -0.09 0.00 1.10 0.00 0.00 33.01 31.56 2k33 s GLN 27 CO 0.00 0.01 1.12 0.99 -0.55 0.00 0.00 175.29 176.87 2k33 s THR 28 N -1.86 3.60 0.00 -0.34 2.01 -1.26 -0.47 115.64 117.32 2k33 s THR 28 Ca 0.58 1.48 0.00 0.00 0.31 0.00 0.00 61.69 64.06 2k33 s THR 28 Cb -0.16 -3.95 0.00 0.00 0.01 0.00 0.00 72.50 68.41 2k33 s THR 28 CO 0.20 0.30 0.00 0.18 -0.69 0.00 0.00 174.62 174.62 2k33 n LEU 29 N 1.81 0.30 -4.38 4.42 4.77 -0.88 -4.45 117.00 118.59 2k33 n LEU 29 Ca 0.01 0.00 -0.20 0.00 -0.03 0.00 0.00 56.01 55.80 2k33 n LEU 29 Cb 0.45 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.44 2k33 n LEU 29 CO 0.54 -0.04 -0.23 -0.36 -1.33 0.00 0.00 177.39 175.97 2k33 s PHE 30 N -1.30 1.69 -0.16 -1.77 0.08 -0.74 0.31 117.98 116.09 2k33 s PHE 30 Ca 0.00 -1.19 -0.13 0.00 0.12 0.00 0.00 56.93 55.73 2k33 s PHE 30 Cb 0.00 -1.01 0.04 0.00 -0.57 0.00 0.00 43.02 41.48 2k33 s PHE 30 CO 0.00 -0.30 0.40 0.42 -0.10 0.00 0.00 175.22 175.64 2k33 s ILE 31 N -3.53 -0.01 -0.08 0.64 1.01 -0.56 0.42 121.20 119.09 2k33 s ILE 31 Ca 0.35 0.03 -0.06 0.00 0.00 0.00 0.00 60.65 60.96 2k33 s ILE 31 Cb 0.07 -0.58 0.02 0.00 0.01 0.00 0.00 42.46 41.98 2k33 s ILE 31 CO 0.15 0.01 0.20 -0.63 0.00 0.00 0.00 174.94 174.67 2k33 s ILE 32 N 0.55 -0.01 -0.15 2.92 1.01 -0.84 0.28 121.20 124.97 2k33 s ILE 32 Ca -0.03 0.03 -0.07 0.00 0.00 0.00 0.00 60.65 60.58 2k33 s ILE 32 Cb -0.04 -0.29 -0.04 0.00 0.01 0.00 0.00 42.46 42.09 2k33 s ILE 32 CO -0.03 0.01 0.11 -1.83 0.00 0.00 0.00 174.94 173.21 2k33 s GLU 33 N 0.35 3.67 0.00 2.79 -1.05 -0.67 -0.07 118.70 123.71 2k33 s GLU 33 Ca -0.02 -0.21 0.00 0.00 -0.15 0.00 0.00 54.97 54.59 2k33 s GLU 33 Cb -0.03 -3.22 0.00 0.00 -0.44 0.00 0.00 34.13 30.44 2k33 s GLU 33 CO -0.01 0.58 0.00 0.00 0.95 0.00 0.00 175.26 176.77 2k33 n GLN 34 N 2.62 0.27 0.00 -4.83 0.00 -1.25 -2.44 117.38 111.74 2k33 n GLN 34 Ca -0.18 0.00 0.00 0.00 0.00 0.00 0.00 57.00 56.82 2k33 n GLN 34 Cb 0.54 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.78 2k33 n GLN 34 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.06 176.81 2k33 n ASP 35 N -2.31 0.00 -1.06 2.61 8.00 -1.26 -4.45 116.55 118.07 2k33 n ASP 35 Ca 0.00 0.00 -0.12 0.00 0.71 0.00 0.00 54.79 55.38 2k33 n ASP 35 Cb 0.00 0.00 -0.04 0.00 -0.02 0.00 0.00 41.12 41.06 2k33 n ASP 35 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2k33 n GLN 36 N 0.00 -0.88 -0.83 -1.24 1.13 -1.26 -4.88 117.38 109.41 2k33 n GLN 36 Ca 0.00 0.83 0.08 0.00 -1.94 0.00 0.00 57.00 55.97 2k33 n GLN 36 Cb 0.00 -4.89 0.40 0.00 0.11 0.00 0.00 30.24 25.85 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 0.41 3.70 -2.49 -1.58 0.00 -1.26 -4.99 120.51 114.30 2k33 n ALA 37 Ca -0.13 -1.86 -0.00 0.00 0.00 0.00 0.00 53.44 51.45 2k33 n ALA 37 Cb 0.46 -1.09 0.00 0.00 0.00 0.00 0.00 19.45 18.82 2k33 n ALA 37 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2k33 n SER 38 N 0.73 -6.93 0.19 0.00 2.88 -1.26 -4.43 113.62 104.80 2k33 n SER 38 Ca 0.27 1.18 0.18 0.00 -1.33 0.00 0.00 58.87 59.17 2k33 n SER 38 Cb 1.13 -4.55 0.82 0.00 -0.75 0.00 0.00 64.21 60.86 2k33 n SER 38 CO 0.00 0.00 0.00 0.11 -1.23 0.00 0.00 175.04 173.92 2k33 h LYS 39 N 2.49 0.00 0.00 -1.46 1.79 -1.94 0.30 116.57 117.76 2k33 h LYS 39 Ca 0.00 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2k33 h LYS 39 Cb 0.00 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.65 2k33 h LYS 39 CO 0.08 0.00 0.00 -0.25 -1.08 0.00 0.00 179.45 178.20 2k33 n ASP 40 N -3.66 0.40 0.00 0.86 8.00 -1.26 -4.23 116.55 116.65 2k33 n ASP 40 Ca 0.03 0.62 0.00 0.00 0.71 0.00 0.00 54.79 56.15 2k33 n ASP 40 Cb 0.40 -0.70 0.00 0.00 -0.02 0.00 0.00 41.12 40.81 2k33 n ASP 40 CO 0.00 0.00 0.00 0.33 -0.39 0.00 0.00 177.20 177.14 2k33 n PHE 41 N -1.97 0.00 0.00 1.24 7.35 0.11 -5.14 117.46 119.05 2k33 n PHE 41 Ca 0.01 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.70 2k33 n PHE 41 Cb 0.15 0.00 0.00 0.00 0.35 0.00 0.00 39.48 39.98 2k33 n PHE 41 CO 0.00 0.00 0.00 -1.71 -0.76 0.00 0.00 176.76 174.29 2k33 n ASN 42 N -0.36 0.00 0.00 -2.13 4.05 -1.19 -5.12 115.26 110.51 2k33 n ASN 42 Ca 0.00 0.00 0.00 0.00 0.45 0.00 0.00 54.58 55.03 2k33 n ASN 42 Cb 0.00 0.00 0.00 0.00 1.23 0.00 0.00 39.78 41.01 2k33 n ASN 42 CO 0.00 0.00 0.00 -1.14 -3.05 0.00 0.00 177.26 173.07 2k33 n ARG 43 N -0.01 0.00 0.00 1.20 0.00 -1.26 -4.88 116.66 111.71 2k33 n ARG 43 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.85 2k33 n ARG 43 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32.46 32.46 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 -1.79 -0.06 -0.11 6.15 2.88 -1.26 -2.92 113.62 116.51 2k33 n SER 44 Ca 0.00 0.00 -0.05 0.00 -1.33 0.00 0.00 58.87 57.49 2k33 n SER 44 Cb 0.00 0.00 -0.04 0.00 -0.75 0.00 0.00 64.21 63.42 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 0.00 -0.08 0.00 -1.46 1.79 -1.89 -3.38 116.57 111.56 2k33 h LYS 45 Ca 0.00 0.01 -0.02 0.00 -2.18 0.00 0.00 60.65 58.46 2k33 h LYS 45 Cb 0.00 0.02 -0.02 0.00 -1.58 0.00 0.00 32.23 30.65 2k33 h LYS 45 CO 0.00 -0.05 -0.03 0.00 -1.08 0.00 0.00 179.45 178.28 2k33 n ALA 46 N -2.97 -1.01 -1.48 3.86 0.00 -1.15 -2.68 120.51 115.09 2k33 n ALA 46 Ca -0.00 -0.09 0.19 0.00 0.00 0.00 0.00 53.44 53.53 2k33 n ALA 46 Cb 0.12 -0.34 -0.07 0.00 0.00 0.00 0.00 19.45 19.17 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 -0.05 -0.87 -4.37 0.00 4.32 -1.17 -4.92 117.00 109.94 2k33 n LEU 47 Ca -0.03 1.99 -0.19 0.00 -0.02 0.00 0.00 56.01 57.75 2k33 n LEU 47 Cb 0.37 -4.73 -0.10 0.00 -1.62 0.00 0.00 43.42 37.34 2k33 n LEU 47 CO -0.02 -3.22 -0.45 0.72 -1.22 0.00 0.00 177.39 173.20 2k33 s PHE 48 N -3.14 1.82 -0.08 -1.77 -0.71 -1.26 -4.95 117.98 107.89 2k33 s PHE 48 Ca 0.00 -0.53 -0.31 0.00 -1.04 0.00 0.00 56.93 55.05 2k33 s PHE 48 Cb 0.00 -0.84 0.10 0.00 -1.21 0.00 0.00 43.02 41.08 2k33 s PHE 48 CO 0.00 0.42 1.37 0.45 -1.34 0.00 0.00 175.22 176.12 2k33 s SER 49 N -3.35 0.00 0.57 1.98 0.15 -1.26 -4.89 113.70 106.90 2k33 s SER 49 Ca 0.24 -0.04 0.28 0.00 0.70 0.00 0.00 55.95 57.13 2k33 s SER 49 Cb -0.01 0.03 1.52 0.00 -1.71 0.00 0.00 66.02 65.84 2k33 s SER 49 CO 0.08 -0.05 2.00 0.06 1.20 0.00 0.00 173.24 176.53 2k33 h GLN 50 N 2.00 0.00 0.00 5.44 3.07 -2.03 -3.35 115.11 120.25 2k33 h GLN 50 Ca -0.21 0.00 -0.08 0.00 0.09 0.00 0.00 58.65 58.44 2k33 h GLN 50 Cb 1.18 0.00 -0.09 0.00 0.08 0.00 0.00 27.48 28.64 2k33 h GLN 50 CO 0.29 0.00 0.18 -1.13 0.09 0.00 0.00 178.83 178.27 2k33 n SER 51 N -3.96 -1.12 0.09 0.06 3.41 -1.26 -5.05 113.62 105.79 2k33 n SER 51 Ca 0.06 -1.65 -0.14 0.00 -0.26 0.00 0.00 58.87 56.88 2k33 n SER 51 Cb 0.52 1.03 -0.08 0.00 -0.26 0.00 0.00 64.21 65.42 2k33 n SER 51 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2k33 h ALA 52 N 1.37 -0.75 -3.38 7.33 0.00 -1.90 -3.41 119.26 118.52 2k33 h ALA 52 Ca -0.53 -0.06 -0.51 0.00 0.00 0.00 0.00 54.91 53.81 2k33 h ALA 52 Cb 1.23 0.76 -0.34 0.00 0.00 0.00 0.00 17.79 19.45 2k33 h ALA 52 CO -0.17 -1.00 -0.81 0.96 0.00 0.00 0.00 179.25 178.24 2k33 s ILE 53 N -5.88 1.09 0.76 0.00 -4.36 -1.26 -5.09 121.20 106.46 2k33 s ILE 53 Ca -0.16 -0.43 -0.16 0.00 -0.26 0.00 0.00 60.65 59.65 2k33 s ILE 53 Cb 0.08 -1.02 -0.02 0.00 1.25 0.00 0.00 42.46 42.75 2k33 s ILE 53 CO 0.63 0.35 0.55 -1.20 0.24 0.00 0.00 174.94 175.51 2k33 n SER 54 N 4.03 -1.18 -0.62 4.36 7.64 -1.26 -4.91 113.62 121.68 2k33 n SER 54 Ca -0.21 0.55 0.12 0.00 1.01 0.00 0.00 58.87 60.34 2k33 n SER 54 Cb 0.51 -1.23 0.12 0.00 -1.01 0.00 0.00 64.21 62.60 2k33 n SER 54 CO 0.00 0.00 0.00 1.67 -3.01 0.00 0.00 175.04 173.70 2k33 n GLN 55 N -1.01 1.57 -3.07 1.43 7.27 -1.26 -4.41 117.38 117.89 2k33 n GLN 55 Ca 0.10 -1.24 -0.42 0.00 0.07 0.00 0.00 57.00 55.51 2k33 n GLN 55 Cb 0.50 -1.47 -0.06 0.00 2.41 0.00 0.00 30.24 31.62 2k33 n GLN 55 CO 0.00 0.00 0.00 0.15 0.07 0.00 0.00 177.06 177.28 2k33 s LYS 56 N -2.29 3.80 -1.98 3.69 1.02 -1.26 -3.95 119.74 118.78 2k33 s LYS 56 Ca 0.24 0.23 0.00 0.00 0.02 0.00 0.00 55.97 56.46 2k33 s LYS 56 Cb 0.19 -3.77 0.00 0.00 -0.52 0.00 0.00 37.83 33.73 2k33 s LYS 56 CO 0.46 -0.68 0.00 0.39 -0.92 0.00 0.00 175.35 174.59 2k33 n GLU 57 N 6.05 -1.46 -4.24 1.68 -0.58 -1.26 -4.95 120.64 115.87 2k33 n GLU 57 Ca -0.00 1.16 -0.26 0.00 -0.42 0.00 0.00 57.16 57.63 2k33 n GLU 57 Cb 0.49 -5.53 -0.17 0.00 -0.57 0.00 0.00 31.44 25.66 2k33 n GLU 57 CO 0.00 0.00 0.00 0.71 -0.48 0.00 0.00 177.13 177.36 2k33 s TYR 58 N -2.61 1.54 0.00 -0.32 2.02 -1.25 -5.13 117.35 111.59 2k33 s TYR 58 Ca 0.00 -0.69 0.00 0.00 -0.37 0.00 0.00 57.07 56.01 2k33 s TYR 58 Cb 0.00 -1.19 0.00 0.00 -0.40 0.00 0.00 41.96 40.37 2k33 s TYR 58 CO 0.00 -0.42 0.00 -3.47 -1.57 0.00 0.00 175.55 170.09 2k33 n ASP 59 N 4.39 1.44 0.04 2.29 -0.08 -1.26 -4.63 116.55 118.74 2k33 n ASP 59 Ca -0.18 -0.99 0.06 0.00 -1.51 0.00 0.00 54.79 52.18 2k33 n ASP 59 Cb 0.51 0.00 -0.08 0.00 2.34 0.00 0.00 41.12 43.89 2k33 n ASP 59 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 2k33 n SER 60 N -1.54 0.60 -0.24 1.67 7.64 -1.26 -4.02 113.62 116.48 2k33 n SER 60 Ca 0.00 0.25 0.21 0.00 1.01 0.00 0.00 58.87 60.33 2k33 n SER 60 Cb 0.00 0.74 0.55 0.00 -1.01 0.00 0.00 64.21 64.49 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 0.34 0.56 6.43 4.64 -1.98 0.37 113.55 123.91 2k33 h SER 61 Ca -0.09 0.04 -0.28 0.00 -0.47 0.00 0.00 61.79 60.98 2k33 h SER 61 Cb 1.28 -0.02 -0.03 0.00 -0.31 0.00 0.00 62.40 63.32 2k33 h SER 61 CO 0.02 0.13 -1.52 0.17 -0.87 0.00 0.00 176.83 174.76 2k33 h LEU 62 N 0.34 0.17 -7.75 5.97 8.10 -1.99 -3.42 115.31 116.72 2k33 h LEU 62 Ca 0.47 -0.26 -0.72 0.00 0.11 0.00 0.00 57.88 57.48 2k33 h LEU 62 Cb 1.27 -0.05 -0.32 0.00 -0.44 0.00 0.00 40.66 41.12 2k33 h LEU 62 CO -0.16 1.22 -0.30 0.00 -4.11 0.00 0.00 178.44 175.10 2k33 s ALA 63 N -2.63 3.59 0.00 0.17 0.00 0.12 -5.02 121.76 117.99 2k33 s ALA 63 Ca -0.06 -3.00 0.00 0.00 0.00 0.00 0.00 51.96 48.90 2k33 s ALA 63 Cb 0.08 -2.86 0.00 0.00 0.00 0.00 0.00 23.12 20.34 2k33 s ALA 63 CO 0.83 -2.06 0.00 2.41 0.00 0.00 0.00 175.76 176.94 2k33 n THR 64 N 4.09 0.00 -3.32 0.00 -1.04 -1.09 -4.28 114.28 108.64 2k33 n THR 64 Ca 0.04 0.00 -0.45 0.00 -2.04 0.00 0.00 64.05 61.59 2k33 n THR 64 Cb 0.41 0.00 -0.00 0.00 -1.82 0.00 0.00 70.33 68.92 2k33 n THR 64 CO 0.00 0.00 0.00 -1.48 -0.64 0.00 0.00 175.07 172.95 2k33 s LEU 65 N 0.00 6.31 1.09 -4.42 0.05 -1.26 -4.84 118.68 115.60 2k33 s LEU 65 Ca 0.00 -3.48 -0.19 0.00 0.05 0.00 0.00 54.13 50.51 2k33 s LEU 65 Cb 0.00 -2.22 0.07 0.00 -2.05 0.00 0.00 46.19 41.99 2k33 s LEU 65 CO 0.00 -0.34 -0.09 0.47 -0.55 0.00 0.00 176.35 175.84 2k33 n ASP 66 N 2.99 -2.44 -4.05 1.48 9.92 -1.26 -4.89 116.55 118.29 2k33 n ASP 66 Ca 0.24 -0.06 -0.17 0.00 -0.53 0.00 0.00 54.79 54.26 2k33 n ASP 66 Cb 0.40 -0.94 -0.14 0.00 -0.64 0.00 0.00 41.12 39.80 2k33 n ASP 66 CO 0.00 0.00 0.00 -1.00 0.13 0.00 0.00 177.20 176.33 2k33 s HIS 67 N -2.23 0.83 -0.37 1.24 3.76 -1.26 -3.80 115.29 113.45 2k33 s HIS 67 Ca 0.54 -0.26 -0.03 0.00 -0.15 0.00 0.00 55.06 55.16 2k33 s HIS 67 Cb -0.11 -0.51 0.09 0.00 1.11 0.00 0.00 32.58 33.16 2k33 s HIS 67 CO 0.66 -0.01 0.14 0.99 -0.85 0.00 0.00 174.74 175.68 2k33 s THR 68 N -0.59 3.28 -0.01 1.30 2.01 0.89 -4.98 115.64 117.54 2k33 s THR 68 Ca 0.00 -1.78 -0.30 0.00 0.31 0.00 0.00 61.69 59.92 2k33 s THR 68 Cb -0.06 -3.12 -0.05 0.00 0.01 0.00 0.00 72.50 69.29 2k33 s THR 68 CO 0.00 -0.49 1.30 -1.61 -0.69 0.00 0.00 174.62 173.13 2k33 s GLU 69 N 1.20 4.33 -0.61 4.92 2.02 -1.26 -1.98 118.70 127.32 2k33 s GLU 69 Ca 0.04 1.83 -0.25 0.00 0.02 0.00 0.00 54.97 56.62 2k33 s GLU 69 Cb -0.22 -3.53 0.05 0.00 0.10 0.00 0.00 34.13 30.53 2k33 s GLU 69 CO -0.03 -0.48 1.03 0.42 0.02 0.00 0.00 175.26 176.22 2k33 s ILE 70 N 2.11 4.23 0.40 -1.63 1.09 0.17 -4.94 121.20 122.63 2k33 s ILE 70 Ca 0.60 0.21 -0.01 0.00 -1.10 0.00 0.00 60.65 60.35 2k33 s ILE 70 Cb -0.29 -4.66 -0.02 0.00 -1.06 0.00 0.00 42.46 36.43 2k33 s ILE 70 CO 0.25 -1.34 0.63 -1.59 -0.10 0.00 0.00 174.94 172.79 2k33 s LYS 71 N 4.37 3.36 0.37 2.79 -2.85 -1.26 -1.79 119.74 124.72 2k33 s LYS 71 Ca 0.30 -0.29 -0.25 0.00 -1.00 0.00 0.00 55.97 54.74 2k33 s LYS 71 Cb -0.12 -2.58 -0.10 0.00 -2.06 0.00 0.00 37.83 32.97 2k33 s LYS 71 CO 0.17 -0.05 0.99 0.00 0.10 0.00 0.00 175.35 176.57 2k33 s ALA 72 N -2.47 3.14 0.22 0.59 0.00 0.38 -4.89 121.76 118.73 2k33 s ALA 72 Ca 0.44 0.59 -0.01 0.00 0.00 0.00 0.00 51.96 52.98 2k33 s ALA 72 Cb -0.10 -3.22 0.21 0.00 0.00 0.00 0.00 23.12 20.01 2k33 s ALA 72 CO 0.38 -0.01 1.58 -1.00 0.00 0.00 0.00 175.76 176.72 2k33 h PRO 73 N 2.73 0.54 -3.49 0.00 0.13 -1.92 -1.90 132.00 128.09 2k33 h PRO 73 Ca -0.48 -0.29 -0.05 0.00 -0.87 0.00 0.00 66.00 64.32 2k33 h PRO 73 Cb 1.20 0.01 -0.11 0.00 0.13 0.00 0.00 31.00 32.23 2k33 h PRO 73 CO 0.63 0.87 -0.10 -0.59 -0.23 0.00 0.00 178.00 178.59 2k33 s PHE 74 N -4.19 0.01 0.82 1.56 -0.12 -1.26 -4.60 117.98 110.19 2k33 s PHE 74 Ca -0.07 -0.35 -0.12 0.00 -0.05 0.00 0.00 56.93 56.34 2k33 s PHE 74 Cb 0.12 0.23 0.08 0.00 -0.63 0.00 0.00 43.02 42.82 2k33 s PHE 74 CO 0.82 -0.80 1.11 0.16 -0.05 0.00 0.00 175.22 176.46 2k33 s ASP 75 N -2.88 4.34 0.00 1.98 1.47 -1.26 -4.47 116.67 115.85 2k33 s ASP 75 Ca 0.10 1.19 0.00 0.00 1.18 0.00 0.00 52.55 55.01 2k33 s ASP 75 Cb 0.01 -1.88 0.00 0.00 -0.34 0.00 0.00 42.92 40.71 2k33 s ASP 75 CO -0.04 -2.05 0.00 0.61 0.68 0.00 0.00 175.17 174.37 2k33 n GLY 76 N -2.26 0.45 3.71 2.12 0.00 -1.01 -4.60 105.19 103.60 2k33 n GLY 76 Ca 0.07 -1.33 -0.35 0.00 0.00 0.00 0.00 46.02 44.41 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 -3.74 4.76 -0.03 2.61 2.01 -0.83 -1.35 115.64 119.07 2k33 s THR 77 Ca 0.00 -0.07 -0.01 0.00 0.31 0.00 0.00 61.69 61.93 2k33 s THR 77 Cb 0.00 -3.07 -0.04 0.00 0.01 0.00 0.00 72.50 69.40 2k33 s THR 77 CO 0.00 0.56 0.05 -0.51 -0.69 0.00 0.00 174.62 174.03 2k33 s ILE 78 N -0.45 4.60 0.00 1.82 2.07 -1.02 -1.66 121.20 126.57 2k33 s ILE 78 Ca 0.10 -0.36 0.00 0.00 -1.41 0.00 0.00 60.65 58.98 2k33 s ILE 78 Cb -0.12 -3.05 0.00 0.00 0.13 0.00 0.00 42.46 39.42 2k33 s ILE 78 CO 0.02 0.43 0.00 0.61 -1.91 0.00 0.00 174.94 174.09 2k33 n GLY 79 N 1.49 -0.23 3.27 1.50 0.00 -0.18 -1.27 105.19 109.78 2k33 n GLY 79 Ca -0.15 -1.56 -0.19 0.00 0.00 0.00 0.00 46.02 44.12 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 2.11 -4.87 1.61 5.75 -1.26 -3.98 116.55 115.91 2k33 n ASP 80 Ca 0.00 -2.44 -0.31 0.00 -0.01 0.00 0.00 54.79 52.03 2k33 n ASP 80 Cb 0.00 -0.21 -0.05 0.00 -1.03 0.00 0.00 41.12 39.83 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 -2.63 3.42 -0.06 2.12 0.00 -1.26 -4.38 121.76 118.97 2k33 s ALA 81 Ca 0.40 -0.15 -0.02 0.00 0.00 0.00 0.00 51.96 52.19 2k33 s ALA 81 Cb -0.03 -2.62 -0.03 0.00 0.00 0.00 0.00 23.12 20.43 2k33 s ALA 81 CO 0.26 0.30 -0.07 1.28 0.00 0.00 0.00 175.76 177.52 2k33 n LEU 82 N -0.56 1.02 0.00 0.00 4.32 0.87 -4.98 117.00 117.68 2k33 n LEU 82 Ca 0.02 0.05 -0.14 0.00 -0.02 0.00 0.00 56.01 55.92 2k33 n LEU 82 Cb 0.53 -0.19 0.02 0.00 -1.62 0.00 0.00 43.42 42.17 2k33 n LEU 82 CO 0.44 0.24 0.13 1.33 -1.22 0.00 0.00 177.39 178.31 2k33 n VAL 83 N -3.14 0.00 -3.88 4.08 0.24 -1.26 -5.07 118.33 109.30 2k33 n VAL 83 Ca -0.12 -1.27 -0.14 0.00 -2.04 0.00 0.00 64.34 60.77 2k33 n VAL 83 Cb 0.59 -0.45 -0.01 0.00 -1.47 0.00 0.00 33.84 32.50 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 -2.24 2.09 -4.85 -1.34 3.02 -1.26 -5.10 115.26 105.58 2k33 n ASN 84 Ca 0.04 -1.99 -0.34 0.00 -0.03 0.00 0.00 54.58 52.27 2k33 n ASN 84 Cb 0.38 0.03 -0.06 0.00 -0.61 0.00 0.00 39.78 39.53 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 -1.50 4.84 0.00 2.41 1.01 -1.26 -4.06 121.20 122.64 2k33 s ILE 85 Ca 0.11 0.73 0.00 0.00 0.00 0.00 0.00 60.65 61.49 2k33 s ILE 85 Cb -0.01 -3.68 0.00 0.00 0.01 0.00 0.00 42.46 38.79 2k33 s ILE 85 CO 0.07 0.05 0.00 0.61 0.00 0.00 0.00 174.94 175.67 2k33 n GLY 86 N 0.23 0.48 3.76 6.18 0.00 -0.86 -4.96 105.19 110.01 2k33 n GLY 86 Ca -0.01 -0.56 -0.36 0.00 0.00 0.00 0.00 46.02 45.09 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 -2.51 6.28 0.09 1.61 -1.08 -1.26 -4.77 116.67 115.03 2k33 s ASP 87 Ca 0.00 0.32 -0.31 0.00 -0.52 0.00 0.00 52.55 52.04 2k33 s ASP 87 Cb 0.00 -2.10 -0.10 0.00 -1.46 0.00 0.00 42.92 39.27 2k33 s ASP 87 CO 0.00 0.21 1.84 -0.47 0.52 0.00 0.00 175.17 177.27 2k33 s TYR 88 N 0.10 1.95 0.23 -5.34 5.04 -1.26 -2.35 117.35 115.72 2k33 s TYR 88 Ca 0.10 -0.09 0.08 0.00 -2.44 0.00 0.00 57.07 54.72 2k33 s TYR 88 Cb -0.11 -4.16 -0.04 0.00 0.35 0.00 0.00 41.96 38.00 2k33 s TYR 88 CO -0.00 -4.89 0.11 0.14 -1.34 0.00 0.00 175.55 169.56 2k33 s VAL 89 N 3.21 4.07 -0.53 3.14 -7.23 0.08 -4.96 120.40 118.18 2k33 s VAL 89 Ca 0.82 -1.51 0.04 0.00 -1.81 0.00 0.00 61.98 59.51 2k33 s VAL 89 Cb -0.44 -3.16 0.15 0.00 0.56 0.00 0.00 36.38 33.49 2k33 s VAL 89 CO 0.37 -0.30 0.33 -0.44 -0.31 0.00 0.00 175.10 174.75 2k33 s SER 90 N -3.59 3.92 0.36 4.85 0.01 -1.26 -2.43 113.70 115.57 2k33 s SER 90 Ca 0.31 -3.13 0.00 0.00 1.31 0.00 0.00 55.95 54.45 2k33 s SER 90 Cb -0.08 -1.30 0.00 0.00 0.21 0.00 0.00 66.02 64.85 2k33 s SER 90 CO 0.22 -0.19 0.00 0.00 0.41 0.00 0.00 173.24 173.68 2k33 n ALA 91 N 2.91 0.00 0.22 1.44 0.00 -1.24 -1.39 120.51 122.45 2k33 n ALA 91 Ca 0.13 0.00 0.11 0.00 0.00 0.00 0.00 53.44 53.68 2k33 n ALA 91 Cb 0.35 0.00 0.55 0.00 0.00 0.00 0.00 19.45 20.35 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 -3.64 0.58 0.21 0.00 2.88 0.21 -2.03 113.62 111.83 2k33 n SER 92 Ca 0.00 0.73 0.11 0.00 -1.33 0.00 0.00 58.87 58.38 2k33 n SER 92 Cb 0.00 -0.82 0.66 0.00 -0.75 0.00 0.00 64.21 63.30 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 0.92 -3.03 2.46 2.02 -1.49 -3.38 112.91 110.42 2k33 h THR 93 Ca 0.00 0.00 -0.61 0.00 0.77 0.00 0.00 66.41 66.57 2k33 h THR 93 Cb 0.10 0.94 -0.12 0.00 -1.74 0.00 0.00 68.15 67.33 2k33 h THR 93 CO 0.00 0.00 0.62 -0.89 0.37 0.00 0.00 175.52 175.62 2k33 s THR 94 N -5.04 4.30 -0.40 3.16 2.01 -0.86 -4.95 115.64 113.86 2k33 s THR 94 Ca -0.05 0.20 -0.18 0.00 0.31 0.00 0.00 61.69 61.96 2k33 s THR 94 Cb 0.17 -4.61 0.01 0.00 0.01 0.00 0.00 72.50 68.09 2k33 s THR 94 CO 0.68 -1.25 0.51 -1.83 -0.69 0.00 0.00 174.62 172.04 2k33 s GLU 95 N 4.17 3.32 -0.05 4.92 -1.05 -1.26 -4.27 118.70 124.48 2k33 s GLU 95 Ca 0.30 -0.46 0.15 0.00 -0.15 0.00 0.00 54.97 54.81 2k33 s GLU 95 Cb -0.13 -3.91 -0.23 0.00 -0.44 0.00 0.00 34.13 29.42 2k33 s GLU 95 CO 0.17 -0.82 0.29 1.47 0.95 0.00 0.00 175.26 177.32 2k33 n LEU 96 N 5.82 0.00 -3.51 1.83 -0.00 -1.26 -4.73 117.00 115.15 2k33 n LEU 96 Ca -0.05 0.00 -0.13 0.00 -0.00 0.00 0.00 56.01 55.83 2k33 n LEU 96 Cb 0.48 0.08 -0.04 0.00 -0.00 0.00 0.00 43.42 43.94 2k33 n LEU 96 CO 0.48 0.08 0.33 0.54 -0.00 0.00 0.00 177.39 178.81 2k33 s VAL 97 N -2.95 0.02 0.11 1.47 0.11 -1.25 -0.09 120.40 117.83 2k33 s VAL 97 Ca -0.06 -0.16 0.07 0.00 -2.93 0.00 0.00 61.98 58.89 2k33 s VAL 97 Cb 0.09 -1.02 -0.04 0.00 -1.53 0.00 0.00 36.38 33.88 2k33 s VAL 97 CO 0.65 -0.09 -0.16 0.00 -3.33 0.00 0.00 175.10 172.17 2k33 s ARG 98 N -3.15 1.04 -0.11 1.54 3.03 -1.26 -0.66 118.95 119.38 2k33 s ARG 98 Ca -0.02 -1.19 -0.01 0.00 2.03 0.00 0.00 55.73 56.54 2k33 s ARG 98 Cb -0.00 -1.06 -0.03 0.00 -1.03 0.00 0.00 34.95 32.83 2k33 s ARG 98 CO -0.07 0.22 -0.06 0.54 -1.13 0.00 0.00 175.30 174.80 2k33 s VAL 99 N -1.73 3.72 0.23 4.99 0.11 0.13 -1.00 120.40 126.85 2k33 s VAL 99 Ca 0.07 -0.44 0.01 0.00 -2.93 0.00 0.00 61.98 58.69 2k33 s VAL 99 Cb -0.07 -2.57 -0.05 0.00 -1.53 0.00 0.00 36.38 32.16 2k33 s VAL 99 CO 0.04 0.55 0.09 0.28 -3.33 0.00 0.00 175.10 172.73 2k33 s THR 100 N -0.22 0.45 0.00 5.04 -1.32 -0.67 -2.49 115.64 116.42 2k33 s THR 100 Ca 0.03 -2.00 0.00 0.00 -1.21 0.00 0.00 61.69 58.52 2k33 s THR 100 Cb -0.13 -2.54 0.00 0.00 -1.51 0.00 0.00 72.50 68.32 2k33 s THR 100 CO 0.03 -0.06 0.00 -3.20 -2.21 0.00 0.00 174.62 169.17 2k33 n ASN 101 N -0.39 -4.54 0.12 8.08 5.15 -1.26 -1.97 115.26 120.44 2k33 n ASN 101 Ca -0.00 0.00 0.00 0.00 -0.60 0.00 0.00 54.58 53.98 2k33 n ASN 101 Cb 0.66 0.00 0.00 0.00 -0.53 0.00 0.00 39.78 39.91 2k33 n ASN 101 CO 0.00 0.00 0.00 -0.11 1.40 0.00 0.00 177.26 178.55 2k33 n LEU 102 N 0.00 -2.11 -4.75 1.20 -0.00 -1.26 -4.33 117.00 105.74 2k33 n LEU 102 Ca 0.00 0.57 -0.33 0.00 -0.00 0.00 0.00 56.01 56.25 2k33 n LEU 102 Cb 0.00 2.16 0.07 0.00 -0.00 0.00 0.00 43.42 45.65 2k33 n LEU 102 CO 0.00 0.07 0.75 0.54 -0.00 0.00 0.00 177.39 178.76 2k33 s ASN 103 N -1.71 4.73 -0.74 1.96 2.20 -1.26 -3.91 114.94 116.20 2k33 s ASN 103 Ca 0.00 2.11 -0.26 0.00 -0.94 0.00 0.00 52.86 53.77 2k33 s ASN 103 Cb 0.00 -2.56 -0.03 0.00 -2.00 0.00 0.00 41.25 36.65 2k33 s ASN 103 CO 0.00 -1.89 1.90 -2.16 -2.94 0.00 0.00 177.10 172.01 2k33 s PRO 104 N -4.08 2.59 0.05 3.55 0.04 -1.26 -4.89 135.00 130.99 2k33 s PRO 104 Ca 0.69 0.20 0.02 0.00 0.04 0.00 0.00 61.00 61.95 2k33 s PRO 104 Cb -0.23 -4.69 -0.04 0.00 0.04 0.00 0.00 34.50 29.58 2k33 s PRO 104 CO 0.44 -3.03 0.08 0.42 0.04 0.00 0.00 177.00 174.94 2k33 s ILE 105 N 9.55 4.59 -0.43 0.56 -1.09 -1.26 -5.04 121.20 128.09 2k33 s ILE 105 Ca 0.69 -0.63 0.06 0.00 -2.23 0.00 0.00 60.65 58.54 2k33 s ILE 105 Cb -0.10 -3.16 0.32 0.00 -1.58 0.00 0.00 42.46 37.94 2k33 s ILE 105 CO 0.11 0.22 1.19 0.00 -1.23 0.00 0.00 174.94 175.23 2k33 n TYR 106 N 0.76 -2.35 -3.22 3.97 4.11 -1.26 -5.09 117.16 114.08 2k33 n TYR 106 Ca -0.10 -1.83 -0.02 0.00 -0.00 0.00 0.00 57.90 55.94 2k33 n TYR 106 Cb 0.52 1.55 -0.03 0.00 -0.00 0.00 0.00 39.34 41.38 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 0.22 -1.85 0.01 -3.48 0.00 -1.26 -5.15 121.76 110.25 2k33 s ALA 107 Ca 0.21 0.63 0.07 0.00 0.00 0.00 0.00 51.96 52.87 2k33 s ALA 107 Cb 0.30 -2.34 -0.03 0.00 0.00 0.00 0.00 23.12 21.05 2k33 s ALA 107 CO -0.08 -1.82 -0.20 0.34 0.00 0.00 0.00 175.76 174.00 2k33 s ASP 108 N 2.65 3.57 -0.02 0.00 2.15 -1.26 -5.02 116.67 118.74 2k33 s ASP 108 Ca 0.10 -0.41 0.10 0.00 0.43 0.00 0.00 52.55 52.77 2k33 s ASP 108 Cb -0.11 -0.55 -0.15 0.00 -0.30 0.00 0.00 42.92 41.81 2k33 s ASP 108 CO -0.27 0.29 0.20 0.61 -0.17 0.00 0.00 175.17 175.83 2k33 n GLY 109 N 1.97 -0.46 0.20 2.66 0.00 -1.26 -4.54 105.19 103.76 2k33 n GLY 109 Ca -0.16 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.63 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 0.14 -1.99 1.61 0.87 -2.08 -3.43 113.55 108.66 2k33 h SER 110 Ca -0.03 -0.05 -0.63 0.00 -1.23 0.00 0.00 61.79 59.86 2k33 h SER 110 Cb 0.58 -0.04 0.02 0.00 -0.44 0.00 0.00 62.40 62.52 2k33 h SER 110 CO 0.00 0.50 1.09 1.57 -0.53 0.00 0.00 176.83 179.46 2k33 n HIS 111 N -4.08 2.31 -2.09 2.24 -0.00 -1.26 -4.91 115.22 107.44 2k33 n HIS 111 Ca -0.02 0.03 -0.39 0.00 0.46 0.00 0.00 57.72 57.81 2k33 n HIS 111 Cb 0.43 -2.65 -0.00 0.00 -0.12 0.00 0.00 29.99 27.64 2k33 n HIS 111 CO 0.00 0.00 0.00 -1.01 0.46 0.00 0.00 176.34 175.79 2k33 s HIS 112 N 4.07 2.82 0.07 1.57 3.76 -1.26 -4.97 115.29 121.36 2k33 s HIS 112 Ca 0.93 1.44 -0.31 0.00 -0.15 0.00 0.00 55.06 56.98 2k33 s HIS 112 Cb -0.72 -3.61 -0.06 0.00 1.11 0.00 0.00 32.58 29.30 2k33 s HIS 112 CO 0.53 -1.99 1.19 -1.01 -0.85 0.00 0.00 174.74 172.61 2k33 s HIS 113 N -1.31 3.45 0.08 1.40 3.76 -1.26 -5.04 115.29 116.37 2k33 s HIS 113 Ca 0.59 1.33 -0.01 0.00 -0.15 0.00 0.00 55.06 56.82 2k33 s HIS 113 Cb -0.36 -3.41 0.02 0.00 1.11 0.00 0.00 32.58 29.94 2k33 s HIS 113 CO 0.46 -1.21 0.11 1.58 -0.85 0.00 0.00 174.74 174.82 2k33 n HIS 114 N 3.76 -3.74 -0.07 1.40 -0.00 -1.26 -5.00 115.22 110.31 2k33 n HIS 114 Ca 0.08 -0.13 -0.14 0.00 0.46 0.00 0.00 57.72 58.00 2k33 n HIS 114 Cb 0.46 -0.08 -0.06 0.00 -0.12 0.00 0.00 29.99 30.19 2k33 n HIS 114 CO 0.00 0.00 0.00 1.25 0.46 0.00 0.00 176.34 178.05 2k33 h HIS 115 N -0.80 0.75 0.00 1.57 2.76 -2.07 -3.57 115.15 113.79 2k33 h HIS 115 Ca -0.04 -0.25 0.00 0.00 -2.20 0.00 0.00 60.37 57.89 2k33 h HIS 115 Cb 0.11 -0.15 0.00 0.00 1.55 0.00 0.00 27.41 28.92 2k33 h HIS 115 CO 0.00 0.98 0.00 1.58 -1.30 0.00 0.00 177.93 179.19