#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 4.70 -0.10 5.18 1.01 -0.65 -5.02 120.40 125.53 2k33 s VAL 2 Ca 0.00 -1.03 0.02 0.00 0.00 0.00 0.00 61.98 60.97 2k33 s VAL 2 Cb 0.00 -3.43 0.01 0.00 0.00 0.00 0.00 36.38 32.97 2k33 s VAL 2 CO 0.00 -0.14 -0.16 -0.63 0.00 0.00 0.00 175.10 174.17 2k33 s ILE 3 N -1.80 1.50 -0.60 2.22 1.01 -1.26 0.10 121.20 122.38 2k33 s ILE 3 Ca 0.32 -0.66 -0.28 0.00 0.00 0.00 0.00 60.65 60.03 2k33 s ILE 3 Cb -0.10 -1.36 0.02 0.00 0.01 0.00 0.00 42.46 41.03 2k33 s ILE 3 CO 0.25 0.44 1.30 -0.63 0.00 0.00 0.00 174.94 176.30 2k33 s ILE 4 N 0.87 3.87 0.09 2.92 1.01 -0.78 -4.81 121.20 124.38 2k33 s ILE 4 Ca -0.09 0.73 0.10 0.00 0.00 0.00 0.00 60.65 61.39 2k33 s ILE 4 Cb -0.15 -4.63 -0.03 0.00 0.01 0.00 0.00 42.46 37.65 2k33 s ILE 4 CO 0.00 -1.34 -0.26 -0.54 0.00 0.00 0.00 174.94 172.80 2k33 s LYS 5 N 5.32 1.61 0.39 2.79 1.02 -1.26 -4.34 119.74 125.27 2k33 s LYS 5 Ca 0.46 -1.23 -0.26 0.00 0.02 0.00 0.00 55.97 54.96 2k33 s LYS 5 Cb -0.09 -1.95 -0.09 0.00 -0.52 0.00 0.00 37.83 35.18 2k33 s LYS 5 CO 0.24 0.48 1.19 -1.25 -0.92 0.00 0.00 175.35 175.09 2k33 s PRO 6 N -1.69 4.10 0.00 -1.68 0.04 -1.13 -4.92 135.00 129.71 2k33 s PRO 6 Ca 0.13 1.91 0.29 0.00 0.04 0.00 0.00 61.00 63.37 2k33 s PRO 6 Cb -0.10 -2.75 1.68 0.00 0.04 0.00 0.00 34.50 33.37 2k33 s PRO 6 CO 0.04 -0.30 2.08 0.00 0.04 0.00 0.00 177.00 178.87 2k33 n GLN 7 N 0.20 1.05 -4.09 4.56 10.64 -1.26 -4.06 117.38 124.41 2k33 n GLN 7 Ca 0.04 -0.07 -0.10 0.00 -1.83 0.00 0.00 57.00 55.03 2k33 n GLN 7 Cb 0.46 -1.45 -0.08 0.00 -0.86 0.00 0.00 30.24 28.31 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 -2.00 0.00 -0.18 -0.39 -7.23 -1.26 -4.96 120.40 104.38 2k33 s VAL 8 Ca 0.43 -1.69 -0.01 0.00 -1.81 0.00 0.00 61.98 58.90 2k33 s VAL 8 Cb 0.20 -2.35 0.00 0.00 0.56 0.00 0.00 36.38 34.80 2k33 s VAL 8 CO 0.33 0.00 -0.14 -0.44 -0.31 0.00 0.00 175.10 174.55 2k33 s SER 9 N -3.09 3.66 0.00 4.85 0.01 -1.26 -3.83 113.70 114.04 2k33 s SER 9 Ca 0.30 -0.51 0.00 0.00 1.31 0.00 0.00 55.95 57.06 2k33 s SER 9 Cb 0.03 -1.58 0.00 0.00 0.21 0.00 0.00 66.02 64.68 2k33 s SER 9 CO 0.10 0.03 0.00 0.61 0.41 0.00 0.00 173.24 174.39 2k33 n GLY 10 N 4.45 1.62 3.10 3.44 0.00 -0.58 -4.74 105.19 112.49 2k33 n GLY 10 Ca -0.19 0.33 -0.13 0.00 0.00 0.00 0.00 46.02 46.03 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 2.16 -0.01 0.45 1.61 1.01 -0.97 -0.93 120.40 123.71 2k33 s VAL 11 Ca 0.00 0.05 -0.24 0.00 0.00 0.00 0.00 61.98 61.79 2k33 s VAL 11 Cb 0.00 -0.36 -0.09 0.00 0.00 0.00 0.00 36.38 35.93 2k33 s VAL 11 CO 0.00 0.02 1.23 -0.38 0.00 0.00 0.00 175.10 175.97 2k33 n ILE 12 N 3.42 2.81 0.00 2.22 2.08 -0.99 -1.13 119.36 127.77 2k33 n ILE 12 Ca -0.17 -0.50 0.00 0.00 0.56 0.00 0.00 62.75 62.64 2k33 n ILE 12 Cb 0.56 -1.50 0.00 0.00 -0.75 0.00 0.00 39.64 37.96 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 -0.48 0.00 -3.77 1.39 0.31 0.14 -2.22 118.33 113.70 2k33 n VAL 13 Ca 0.08 0.00 -0.05 0.00 -0.01 0.00 0.00 64.34 64.36 2k33 n VAL 13 Cb 0.41 -0.60 -0.02 0.00 -0.91 0.00 0.00 33.84 32.72 2k33 n VAL 13 CO 0.00 0.00 0.00 0.21 -1.32 0.00 0.00 176.83 175.72 2k33 s ASN 14 N -3.60 -0.22 -0.26 4.52 2.47 -1.22 -4.86 114.94 111.77 2k33 s ASN 14 Ca 0.00 -0.45 -0.01 0.00 0.42 0.00 0.00 52.86 52.82 2k33 s ASN 14 Cb 0.00 0.57 0.13 0.00 -1.45 0.00 0.00 41.25 40.50 2k33 s ASN 14 CO 0.00 -1.04 0.31 -1.59 -3.72 0.00 0.00 177.10 171.06 2k33 s LYS 15 N -3.50 0.31 -0.70 0.43 -2.85 -1.26 -0.99 119.74 111.18 2k33 s LYS 15 Ca 0.11 0.11 -0.03 0.00 -1.00 0.00 0.00 55.97 55.17 2k33 s LYS 15 Cb -0.03 -0.69 0.23 0.00 -2.06 0.00 0.00 37.83 35.28 2k33 s LYS 15 CO 0.03 -0.86 2.33 1.28 0.10 0.00 0.00 175.35 178.22 2k33 n LEU 16 N 5.33 7.11 -4.33 2.77 4.77 0.11 -4.93 117.00 127.84 2k33 n LEU 16 Ca -0.03 -4.54 -0.18 0.00 -0.03 0.00 0.00 56.01 51.23 2k33 n LEU 16 Cb 0.48 -1.14 -0.09 0.00 -2.33 0.00 0.00 43.42 40.34 2k33 n LEU 16 CO 0.03 1.76 -0.21 0.72 -1.33 0.00 0.00 177.39 178.36 2k33 s PHE 17 N -3.11 1.58 0.17 -1.77 -0.71 -1.19 -4.47 117.98 108.48 2k33 s PHE 17 Ca 0.55 -1.34 0.06 0.00 -1.04 0.00 0.00 56.93 55.16 2k33 s PHE 17 Cb 0.41 -0.86 -0.04 0.00 -1.21 0.00 0.00 43.02 41.32 2k33 s PHE 17 CO -0.33 -0.50 -0.13 0.15 -1.34 0.00 0.00 175.22 173.07 2k33 s LYS 18 N -3.86 1.19 -0.53 1.99 -0.14 -1.26 -5.11 119.74 112.03 2k33 s LYS 18 Ca 0.36 -1.50 -0.24 0.00 -1.36 0.00 0.00 55.97 53.23 2k33 s LYS 18 Cb 0.05 -0.89 0.04 0.00 -1.68 0.00 0.00 37.83 35.35 2k33 s LYS 18 CO 0.17 0.14 0.89 0.00 -0.76 0.00 0.00 175.35 175.78 2k33 s ALA 19 N -3.05 3.21 0.00 5.17 0.00 -1.26 -3.64 121.76 122.18 2k33 s ALA 19 Ca 0.19 -1.23 0.00 0.00 0.00 0.00 0.00 51.96 50.92 2k33 s ALA 19 Cb 0.00 -3.65 0.00 0.00 0.00 0.00 0.00 23.12 19.47 2k33 s ALA 19 CO 0.04 -2.26 0.00 0.41 0.00 0.00 0.00 175.76 173.95 2k33 n GLY 20 N 5.09 0.88 0.00 0.00 0.00 -0.71 -4.91 105.19 105.55 2k33 n GLY 20 Ca 0.01 -0.27 0.00 0.00 0.00 0.00 0.00 46.02 45.76 2k33 n GLY 20 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2k33 n ASP 21 N 0.50 0.78 -4.79 1.61 2.03 -1.20 -4.90 116.55 110.58 2k33 n ASP 21 Ca 0.00 -1.00 -0.23 0.00 0.52 0.00 0.00 54.79 54.08 2k33 n ASP 21 Cb 0.00 0.00 -0.06 0.00 -0.72 0.00 0.00 41.12 40.35 2k33 n ASP 21 CO 0.00 0.00 0.00 -0.54 -1.92 0.00 0.00 177.20 174.74 2k33 s LYS 22 N -1.98 2.38 0.17 -0.67 1.02 -1.26 -0.94 119.74 118.45 2k33 s LYS 22 Ca 0.00 -1.66 0.01 0.00 0.02 0.00 0.00 55.97 54.34 2k33 s LYS 22 Cb 0.00 -2.17 -0.05 0.00 -0.52 0.00 0.00 37.83 35.09 2k33 s LYS 22 CO 0.00 -0.09 0.01 0.14 -0.92 0.00 0.00 175.35 174.50 2k33 s VAL 23 N -2.51 0.57 -0.03 3.17 -7.23 -0.96 -4.83 120.40 108.58 2k33 s VAL 23 Ca 0.43 -1.97 0.03 0.00 -1.81 0.00 0.00 61.98 58.66 2k33 s VAL 23 Cb -0.00 -2.12 -0.03 0.00 0.56 0.00 0.00 36.38 34.79 2k33 s VAL 23 CO 0.25 -0.46 -0.10 -0.54 -0.31 0.00 0.00 175.10 173.93 2k33 s LYS 24 N -3.94 2.54 -0.74 4.82 -0.14 -1.26 -2.52 119.74 118.49 2k33 s LYS 24 Ca 0.24 -0.69 -0.25 0.00 -1.36 0.00 0.00 55.97 53.92 2k33 s LYS 24 Cb 0.06 -2.46 -0.15 0.00 -1.68 0.00 0.00 37.83 33.61 2k33 s LYS 24 CO 0.04 0.62 2.40 1.17 -0.76 0.00 0.00 175.35 178.82 2k33 n LYS 25 N 1.98 0.60 0.00 1.68 4.81 -1.26 0.19 118.16 126.16 2k33 n LYS 25 Ca -0.17 -0.52 0.00 0.00 -0.87 0.00 0.00 58.31 56.75 2k33 n LYS 25 Cb 0.52 -3.29 0.00 0.00 0.02 0.00 0.00 35.03 32.29 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 6.47 1.20 3.78 3.14 0.00 -0.72 -4.91 105.19 114.16 2k33 n GLY 26 Ca 0.47 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 46.11 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 -0.54 4.21 0.24 1.61 0.74 0.13 -4.66 119.66 121.39 2k33 s GLN 27 Ca 0.00 0.59 -0.31 0.00 0.05 0.00 0.00 55.36 55.69 2k33 s GLN 27 Cb 0.00 -3.32 -0.11 0.00 1.10 0.00 0.00 33.01 30.68 2k33 s GLN 27 CO 0.00 0.44 1.64 0.99 -0.55 0.00 0.00 175.29 177.82 2k33 s THR 28 N -0.37 2.12 0.00 -0.34 2.01 -1.26 -1.12 115.64 116.69 2k33 s THR 28 Ca 0.28 0.09 0.00 0.00 0.31 0.00 0.00 61.69 62.37 2k33 s THR 28 Cb -0.17 -3.06 0.00 0.00 0.01 0.00 0.00 72.50 69.28 2k33 s THR 28 CO 0.15 0.01 0.00 0.18 -0.69 0.00 0.00 174.62 174.27 2k33 n LEU 29 N 3.13 1.28 -4.32 4.42 4.77 0.92 -4.65 117.00 122.54 2k33 n LEU 29 Ca 0.12 0.00 -0.19 0.00 -0.03 0.00 0.00 56.01 55.91 2k33 n LEU 29 Cb 0.37 0.00 -0.09 0.00 -2.33 0.00 0.00 43.42 41.37 2k33 n LEU 29 CO 0.63 0.21 -0.18 -0.36 -1.33 0.00 0.00 177.39 176.37 2k33 s PHE 30 N -1.52 1.61 -0.16 -1.77 0.08 -1.02 0.10 117.98 115.29 2k33 s PHE 30 Ca 0.00 -1.43 -0.11 0.00 0.12 0.00 0.00 56.93 55.50 2k33 s PHE 30 Cb 0.00 -0.82 0.05 0.00 -0.57 0.00 0.00 43.02 41.68 2k33 s PHE 30 CO 0.00 -0.60 0.40 0.42 -0.10 0.00 0.00 175.22 175.34 2k33 s ILE 31 N -3.59 -0.01 -0.01 0.64 1.01 -0.16 0.40 121.20 119.47 2k33 s ILE 31 Ca 0.36 0.05 0.00 0.00 0.00 0.00 0.00 60.65 61.07 2k33 s ILE 31 Cb 0.04 -0.58 0.01 0.00 0.01 0.00 0.00 42.46 41.94 2k33 s ILE 31 CO 0.19 0.02 0.01 -0.63 0.00 0.00 0.00 174.94 174.53 2k33 s ILE 32 N 0.88 0.02 -0.17 2.92 1.01 -0.69 0.23 121.20 125.40 2k33 s ILE 32 Ca -0.05 0.06 -0.10 0.00 0.00 0.00 0.00 60.65 60.56 2k33 s ILE 32 Cb -0.06 -0.07 -0.05 0.00 0.01 0.00 0.00 42.46 42.29 2k33 s ILE 32 CO -0.07 0.05 0.17 -1.83 0.00 0.00 0.00 174.94 173.26 2k33 s GLU 33 N 0.41 4.04 0.00 2.79 -1.05 -0.29 -0.02 118.70 124.58 2k33 s GLU 33 Ca -0.03 -0.13 0.00 0.00 -0.15 0.00 0.00 54.97 54.66 2k33 s GLU 33 Cb -0.05 -3.37 0.00 0.00 -0.44 0.00 0.00 34.13 30.27 2k33 s GLU 33 CO -0.01 0.40 0.00 0.00 0.95 0.00 0.00 175.26 176.60 2k33 n GLN 34 N 3.17 0.00 -0.79 -4.83 0.00 -1.25 -2.30 117.38 111.37 2k33 n GLN 34 Ca -0.16 0.00 -0.04 0.00 0.00 0.00 0.00 57.00 56.80 2k33 n GLN 34 Cb 0.53 0.00 -0.04 0.00 0.00 0.00 0.00 30.24 30.72 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 -1.69 -0.61 0.00 2.61 8.00 -1.26 -4.59 116.55 119.01 2k33 n ASP 35 Ca 0.00 -1.50 0.00 0.00 0.71 0.00 0.00 54.79 54.00 2k33 n ASP 35 Cb 0.00 0.18 0.00 0.00 -0.02 0.00 0.00 41.12 41.28 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 0.06 0.02 -1.24 -0.00 -1.26 -4.22 117.38 110.74 2k33 n GLN 36 Ca -0.17 -0.45 -0.06 0.00 -0.00 0.00 0.00 57.00 56.32 2k33 n GLN 36 Cb 0.58 -0.74 -0.04 0.00 -0.00 0.00 0.00 30.24 30.05 2k33 n GLN 36 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 2k33 h ALA 37 N 0.00 -0.66 -2.37 2.61 0.00 -1.91 -3.46 119.26 113.48 2k33 h ALA 37 Ca 0.00 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.80 2k33 h ALA 37 Cb 0.40 0.68 -0.18 0.00 0.00 0.00 0.00 17.79 18.69 2k33 h ALA 37 CO 0.00 -0.72 -0.01 0.45 0.00 0.00 0.00 179.25 178.97 2k33 s SER 38 N -3.34 -0.42 0.65 0.00 0.15 -1.26 -5.02 113.70 104.46 2k33 s SER 38 Ca -0.06 0.28 0.41 0.00 0.70 0.00 0.00 55.95 57.28 2k33 s SER 38 Cb 0.02 0.45 2.26 0.00 -1.71 0.00 0.00 66.02 67.04 2k33 s SER 38 CO 0.23 -0.62 2.32 0.11 1.20 0.00 0.00 173.24 176.47 2k33 h LYS 39 N 3.13 0.00 0.00 5.44 1.79 -1.92 0.19 116.57 125.19 2k33 h LYS 39 Ca -0.30 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.17 2k33 h LYS 39 Cb 1.18 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.83 2k33 h LYS 39 CO 0.41 0.00 0.00 -0.25 -1.08 0.00 0.00 179.45 178.53 2k33 n ASP 40 N -3.23 0.00 0.00 0.86 9.92 -1.26 -4.30 116.55 118.54 2k33 n ASP 40 Ca -0.03 -0.58 0.00 0.00 -0.53 0.00 0.00 54.79 53.66 2k33 n ASP 40 Cb 0.10 -0.12 0.00 0.00 -0.64 0.00 0.00 41.12 40.46 2k33 n ASP 40 CO 0.00 0.00 0.00 0.49 0.13 0.00 0.00 177.20 177.82 2k33 n PHE 41 N -1.12 0.00 0.00 1.24 3.01 0.67 -5.13 117.46 116.13 2k33 n PHE 41 Ca 0.18 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.64 2k33 n PHE 41 Cb 0.15 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.62 2k33 n PHE 41 CO 0.00 0.00 0.00 -1.71 1.01 0.00 0.00 176.76 176.06 2k33 n ASN 42 N -1.38 0.00 0.00 4.37 4.05 -1.21 -5.07 115.26 116.01 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 -2.11 -3.05 0.00 0.00 177.26 172.10 2k33 n ARG 43 N -0.02 0.25 -0.04 1.20 1.85 -1.26 -4.30 116.66 114.35 2k33 n ARG 43 Ca 0.00 0.00 0.24 0.00 -1.00 0.00 0.00 57.85 57.09 2k33 n ARG 43 Cb 0.00 -0.83 0.72 0.00 -1.05 0.00 0.00 32.46 31.30 2k33 n ARG 43 CO 0.00 0.00 0.00 0.77 -0.01 0.00 0.00 177.63 178.39 2k33 h SER 44 N 0.00 0.00 -0.81 2.89 0.02 -1.98 0.84 113.55 114.52 2k33 h SER 44 Ca 0.00 0.00 0.24 0.00 -0.84 0.00 0.00 61.79 61.19 2k33 h SER 44 Cb 0.67 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 63.17 2k33 h SER 44 CO 0.00 0.00 0.60 0.11 -1.14 0.00 0.00 176.83 176.40 2k33 h LYS 45 N 0.00 0.00 -0.88 3.45 1.57 -1.85 -3.37 116.57 115.49 2k33 h LYS 45 Ca 0.30 0.00 0.10 0.00 -1.87 0.00 0.00 60.65 59.18 2k33 h LYS 45 Cb 1.36 0.00 -0.21 0.00 0.08 0.00 0.00 32.23 33.46 2k33 h LYS 45 CO -0.00 0.00 -0.23 0.00 -0.57 0.00 0.00 179.45 178.64 2k33 s ALA 46 N -4.94 -2.52 -0.09 3.86 0.00 0.29 -4.89 121.76 113.48 2k33 s ALA 46 Ca -0.05 1.60 0.04 0.00 0.00 0.00 0.00 51.96 53.55 2k33 s ALA 46 Cb 0.21 -2.32 0.00 0.00 0.00 0.00 0.00 23.12 21.00 2k33 s ALA 46 CO 0.74 -1.49 -0.22 -0.51 0.00 0.00 0.00 175.76 174.28 2k33 s LEU 47 N 2.87 2.00 -0.17 0.00 1.43 -1.25 -4.92 118.68 118.63 2k33 s LEU 47 Ca 0.16 -0.50 -0.07 0.00 -1.03 0.00 0.00 54.13 52.69 2k33 s LEU 47 Cb -0.13 -1.28 0.07 0.00 0.03 0.00 0.00 46.19 44.88 2k33 s LEU 47 CO -0.21 0.14 0.39 0.72 0.23 0.00 0.00 176.35 177.62 2k33 s PHE 48 N 0.35 -0.65 0.00 0.29 -0.71 -1.26 -4.61 117.98 111.39 2k33 s PHE 48 Ca -0.16 1.32 0.00 0.00 -1.04 0.00 0.00 56.93 57.05 2k33 s PHE 48 Cb -0.17 0.23 0.00 0.00 -1.21 0.00 0.00 43.02 41.87 2k33 s PHE 48 CO 0.07 -0.40 0.00 0.43 -1.34 0.00 0.00 175.22 173.99 2k33 n SER 49 N 4.87 0.00 -2.71 1.98 7.64 -1.26 -5.03 113.62 119.11 2k33 n SER 49 Ca -0.15 0.00 -0.05 0.00 1.01 0.00 0.00 58.87 59.68 2k33 n SER 49 Cb 0.52 0.10 0.05 0.00 -1.01 0.00 0.00 64.21 63.87 2k33 n SER 49 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2k33 n GLN 50 N -2.00 0.38 -3.64 1.43 10.64 -1.26 -4.97 117.38 117.96 2k33 n GLN 50 Ca 0.00 -1.26 -0.22 0.00 -1.83 0.00 0.00 57.00 53.69 2k33 n GLN 50 Cb 0.00 -0.74 0.06 0.00 -0.86 0.00 0.00 30.24 28.70 2k33 n GLN 50 CO 0.00 0.00 0.00 0.43 -1.83 0.00 0.00 177.06 175.66 2k33 n SER 51 N 2.06 -2.81 0.35 2.61 7.64 -1.26 -4.92 113.62 117.29 2k33 n SER 51 Ca 0.09 -0.71 -0.18 0.00 1.01 0.00 0.00 58.87 59.08 2k33 n SER 51 Cb 0.64 -4.50 -0.09 0.00 -1.01 0.00 0.00 64.21 59.25 2k33 n SER 51 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2k33 h ALA 52 N 0.92 -0.87 -3.34 -0.43 0.00 -1.93 -3.41 119.26 110.19 2k33 h ALA 52 Ca -0.59 -0.18 -0.56 0.00 0.00 0.00 0.00 54.91 53.58 2k33 h ALA 52 Cb 1.36 0.36 -0.38 0.00 0.00 0.00 0.00 17.79 19.13 2k33 h ALA 52 CO 0.56 -0.99 -0.79 0.96 0.00 0.00 0.00 179.25 178.99 2k33 s ILE 53 N -6.05 1.12 -0.22 0.00 -4.36 -1.26 -5.09 121.20 105.34 2k33 s ILE 53 Ca -0.17 -0.66 -0.29 0.00 -0.26 0.00 0.00 60.65 59.27 2k33 s ILE 53 Cb 0.04 -1.31 -0.06 0.00 1.25 0.00 0.00 42.46 42.38 2k33 s ILE 53 CO 0.62 0.11 2.22 -1.20 0.24 0.00 0.00 174.94 176.92 2k33 n SER 54 N 4.87 3.22 0.19 4.36 7.64 -1.26 -4.81 113.62 127.82 2k33 n SER 54 Ca -0.12 0.24 0.14 0.00 1.01 0.00 0.00 58.87 60.14 2k33 n SER 54 Cb 0.47 -1.54 0.61 0.00 -1.01 0.00 0.00 64.21 62.75 2k33 n SER 54 CO 0.00 0.00 0.00 1.56 -3.01 0.00 0.00 175.04 173.59 2k33 h GLN 55 N 14.78 0.00 0.00 1.43 1.08 -1.99 0.17 115.11 130.57 2k33 h GLN 55 Ca -0.40 0.00 -0.06 0.00 -1.45 0.00 0.00 58.65 56.73 2k33 h GLN 55 Cb 1.25 0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 28.67 2k33 h GLN 55 CO 0.96 0.00 -0.30 1.57 -0.95 0.00 0.00 178.83 180.11 2k33 h LYS 56 N 0.00 0.00 0.00 1.46 2.10 -2.04 -3.18 116.57 114.90 2k33 h LYS 56 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2k33 h LYS 56 Cb 0.33 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.66 2k33 h LYS 56 CO 0.00 0.30 0.00 -0.85 -2.00 0.00 0.00 179.45 176.90 2k33 n GLU 57 N -3.78 4.81 -4.54 0.07 0.28 -0.91 -5.06 120.64 111.51 2k33 n GLU 57 Ca -0.01 -0.13 -0.27 0.00 -0.16 0.00 0.00 57.16 56.59 2k33 n GLU 57 Cb 0.39 -0.62 -0.08 0.00 1.43 0.00 0.00 31.44 32.56 2k33 n GLU 57 CO 0.00 0.00 0.00 -0.47 -0.16 0.00 0.00 177.13 176.50 2k33 s TYR 58 N -0.72 1.78 -0.02 -1.84 5.04 0.53 -5.07 117.35 117.05 2k33 s TYR 58 Ca 0.00 -1.33 -0.09 0.00 -2.44 0.00 0.00 57.07 53.21 2k33 s TYR 58 Cb 0.00 -1.16 0.03 0.00 0.35 0.00 0.00 41.96 41.18 2k33 s TYR 58 CO 0.00 -0.33 0.39 -3.47 -1.34 0.00 0.00 175.55 170.80 2k33 n ASP 59 N -1.44 -0.30 -0.13 4.32 -0.08 -1.26 -4.39 116.55 113.27 2k33 n ASP 59 Ca -0.07 -1.02 0.12 0.00 -1.51 0.00 0.00 54.79 52.31 2k33 n ASP 59 Cb 0.65 0.45 0.17 0.00 2.34 0.00 0.00 41.12 44.73 2k33 n ASP 59 CO 0.00 0.00 0.00 -1.54 0.12 0.00 0.00 177.20 175.78 2k33 n SER 60 N -0.32 0.94 0.26 1.67 3.41 -1.26 -4.03 113.62 114.30 2k33 n SER 60 Ca 0.02 -0.74 0.13 0.00 -0.26 0.00 0.00 58.87 58.01 2k33 n SER 60 Cb 0.17 0.42 0.73 0.00 -0.26 0.00 0.00 64.21 65.26 2k33 n SER 60 CO 0.00 0.00 0.00 0.77 -0.16 0.00 0.00 175.04 175.65 2k33 h SER 61 N 0.62 0.00 0.66 4.04 4.64 -1.99 -2.42 113.55 119.11 2k33 h SER 61 Ca 0.00 0.00 -0.27 0.00 -0.47 0.00 0.00 61.79 61.05 2k33 h SER 61 Cb 0.53 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.59 2k33 h SER 61 CO 0.00 0.12 -1.41 0.17 -0.87 0.00 0.00 176.83 174.83 2k33 h LEU 62 N 0.00 0.10 0.00 5.97 8.10 -2.00 -3.47 115.31 124.01 2k33 h LEU 62 Ca -0.00 -0.14 -0.01 0.00 0.11 0.00 0.00 57.88 57.84 2k33 h LEU 62 Cb 0.35 -0.03 -0.00 0.00 -0.44 0.00 0.00 40.66 40.54 2k33 h LEU 62 CO 0.02 1.12 -0.00 0.00 -4.11 0.00 0.00 178.44 175.46 2k33 n ALA 63 N -2.51 0.01 -3.34 0.17 0.00 -0.91 -5.16 120.51 108.76 2k33 n ALA 63 Ca -0.11 -0.03 -0.03 0.00 0.00 0.00 0.00 53.44 53.27 2k33 n ALA 63 Cb 1.01 0.01 -0.01 0.00 0.00 0.00 0.00 19.45 20.46 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 -0.63 0.00 -3.61 0.00 -2.24 -1.26 -4.90 114.28 101.64 2k33 n THR 64 Ca 0.00 -0.31 -0.28 0.00 -2.27 0.00 0.00 64.05 61.19 2k33 n THR 64 Cb 0.01 0.14 -0.11 0.00 -2.10 0.00 0.00 70.33 68.26 2k33 n THR 64 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 2k33 s LEU 65 N 0.00 2.53 1.07 3.22 1.43 -1.26 -4.74 118.68 120.94 2k33 s LEU 65 Ca 0.04 -3.06 -0.18 0.00 -1.03 0.00 0.00 54.13 49.90 2k33 s LEU 65 Cb 0.00 -0.88 0.05 0.00 0.03 0.00 0.00 46.19 45.39 2k33 s LEU 65 CO 0.03 -0.19 -0.12 0.47 0.23 0.00 0.00 176.35 176.77 2k33 n ASP 66 N 2.93 -2.53 -4.06 2.29 8.00 -1.26 -4.92 116.55 116.99 2k33 n ASP 66 Ca 0.20 -0.01 -0.17 0.00 0.71 0.00 0.00 54.79 55.52 2k33 n ASP 66 Cb 0.40 -0.95 -0.13 0.00 -0.02 0.00 0.00 41.12 40.42 2k33 n ASP 66 CO 0.00 0.00 0.00 -1.00 -0.39 0.00 0.00 177.20 175.81 2k33 s HIS 67 N -2.23 0.86 -0.40 1.24 3.76 -1.26 -3.96 115.29 113.29 2k33 s HIS 67 Ca 0.53 -0.29 -0.06 0.00 -0.15 0.00 0.00 55.06 55.09 2k33 s HIS 67 Cb -0.11 -0.53 0.09 0.00 1.11 0.00 0.00 32.58 33.14 2k33 s HIS 67 CO 0.67 -0.01 0.21 0.99 -0.85 0.00 0.00 174.74 175.75 2k33 s THR 68 N -0.69 3.74 -0.08 1.30 2.01 0.97 -4.97 115.64 117.92 2k33 s THR 68 Ca -0.01 -1.66 -0.30 0.00 0.31 0.00 0.00 61.69 60.04 2k33 s THR 68 Cb -0.06 -3.38 -0.03 0.00 0.01 0.00 0.00 72.50 69.04 2k33 s THR 68 CO 0.00 -0.54 1.22 -1.61 -0.69 0.00 0.00 174.62 173.00 2k33 s GLU 69 N 1.30 4.32 -0.03 4.92 2.02 -1.26 -1.71 118.70 128.27 2k33 s GLU 69 Ca 0.04 1.68 -0.23 0.00 0.02 0.00 0.00 54.97 56.47 2k33 s GLU 69 Cb -0.23 -3.60 -0.04 0.00 0.10 0.00 0.00 34.13 30.36 2k33 s GLU 69 CO -0.01 -0.51 0.69 0.42 0.02 0.00 0.00 175.26 175.88 2k33 s ILE 70 N 2.49 4.94 0.35 -1.63 1.09 0.16 -4.96 121.20 123.65 2k33 s ILE 70 Ca 0.56 1.44 0.09 0.00 -1.10 0.00 0.00 60.65 61.64 2k33 s ILE 70 Cb -0.24 -4.03 -0.06 0.00 -1.06 0.00 0.00 42.46 37.06 2k33 s ILE 70 CO 0.20 0.31 -0.04 -0.54 -0.10 0.00 0.00 174.94 174.78 2k33 s LYS 71 N 0.38 1.94 0.44 2.79 1.02 -1.26 -0.06 119.74 125.00 2k33 s LYS 71 Ca 0.36 -1.88 -0.25 0.00 0.02 0.00 0.00 55.97 54.23 2k33 s LYS 71 Cb -0.18 -1.79 -0.08 0.00 -0.52 0.00 0.00 37.83 35.26 2k33 s LYS 71 CO 0.19 0.11 1.28 0.00 -0.92 0.00 0.00 175.35 176.01 2k33 s ALA 72 N -2.58 3.12 -0.02 5.17 0.00 -0.27 -4.83 121.76 122.35 2k33 s ALA 72 Ca 0.34 1.19 -0.25 0.00 0.00 0.00 0.00 51.96 53.23 2k33 s ALA 72 Cb 0.02 -3.48 -0.20 0.00 0.00 0.00 0.00 23.12 19.47 2k33 s ALA 72 CO 0.18 -0.88 1.28 -1.00 0.00 0.00 0.00 175.76 175.33 2k33 h PRO 73 N 2.33 0.04 0.00 0.00 0.13 -1.93 -1.91 132.00 130.66 2k33 h PRO 73 Ca -0.50 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 64.61 2k33 h PRO 73 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 2k33 h PRO 73 CO 0.61 0.52 -0.03 1.97 -0.23 0.00 0.00 178.00 180.84 2k33 n PHE 74 N -4.82 0.00 -0.27 1.56 1.16 -1.26 -4.69 117.46 109.14 2k33 n PHE 74 Ca -0.08 0.00 0.03 0.00 -1.87 0.00 0.00 57.45 55.53 2k33 n PHE 74 Cb 0.26 0.07 -0.02 0.00 -1.61 0.00 0.00 39.48 38.19 2k33 n PHE 74 CO 0.00 0.00 0.00 -0.40 -1.87 0.00 0.00 176.76 174.49 2k33 n ASP 75 N 0.00 -1.58 0.00 5.98 5.68 -1.26 -4.34 116.55 121.04 2k33 n ASP 75 Ca 0.00 0.23 0.00 0.00 -0.50 0.00 0.00 54.79 54.52 2k33 n ASP 75 Cb 0.51 -0.91 0.00 0.00 -1.14 0.00 0.00 41.12 39.58 2k33 n ASP 75 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2k33 n GLY 76 N -2.67 0.32 3.22 6.12 0.00 -1.05 -4.64 105.19 106.50 2k33 n GLY 76 Ca -0.01 -0.41 -0.22 0.00 0.00 0.00 0.00 46.02 45.37 2k33 n GLY 76 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2k33 s THR 77 N 0.00 1.45 -0.03 2.61 -1.32 -0.41 -2.26 115.64 115.68 2k33 s THR 77 Ca 0.00 -1.27 0.06 0.00 -1.21 0.00 0.00 61.69 59.27 2k33 s THR 77 Cb 0.00 -1.31 -0.01 0.00 -1.51 0.00 0.00 72.50 69.67 2k33 s THR 77 CO 0.00 0.00 -0.20 -0.51 -2.21 0.00 0.00 174.62 171.70 2k33 s ILE 78 N -1.00 1.61 0.00 5.08 2.07 -0.12 -2.23 121.20 126.61 2k33 s ILE 78 Ca 0.04 -0.85 0.00 0.00 -1.41 0.00 0.00 60.65 58.43 2k33 s ILE 78 Cb -0.09 -1.35 0.00 0.00 0.13 0.00 0.00 42.46 41.15 2k33 s ILE 78 CO 0.02 0.46 0.00 0.61 -1.91 0.00 0.00 174.94 174.12 2k33 n GLY 79 N 2.75 1.06 3.93 1.50 0.00 -1.05 -1.73 105.19 111.65 2k33 n GLY 79 Ca -0.16 -1.53 -0.28 0.00 0.00 0.00 0.00 46.02 44.05 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 -1.00 6.38 0.14 1.61 2.15 -1.26 -3.17 116.67 121.53 2k33 s ASP 80 Ca 0.00 0.33 -0.30 0.00 0.43 0.00 0.00 52.55 53.00 2k33 s ASP 80 Cb 0.00 -1.98 -0.07 0.00 -0.30 0.00 0.00 42.92 40.57 2k33 s ASP 80 CO 0.00 0.05 1.15 0.00 -0.17 0.00 0.00 175.17 176.20 2k33 s ALA 81 N -1.71 3.39 -0.14 3.66 0.00 -1.26 -4.40 121.76 121.29 2k33 s ALA 81 Ca 0.37 0.86 -0.16 0.00 0.00 0.00 0.00 51.96 53.02 2k33 s ALA 81 Cb -0.12 -3.40 -0.24 0.00 0.00 0.00 0.00 23.12 19.36 2k33 s ALA 81 CO 0.28 -0.32 0.43 -0.07 0.00 0.00 0.00 175.76 176.08 2k33 h LEU 82 N 5.63 0.25 0.00 0.00 4.07 -1.62 -3.49 115.31 120.17 2k33 h LEU 82 Ca -0.44 -0.78 -0.31 0.00 0.08 0.00 0.00 57.88 56.43 2k33 h LEU 82 Cb 1.21 -0.08 0.01 0.00 1.08 0.00 0.00 40.66 42.88 2k33 h LEU 82 CO 0.75 1.60 -0.08 1.33 -1.08 0.00 0.00 178.44 180.96 2k33 n VAL 83 N -4.03 0.00 -3.96 1.22 0.24 -1.26 -5.08 118.33 105.46 2k33 n VAL 83 Ca -0.28 -1.24 0.00 0.00 -2.04 0.00 0.00 64.34 60.78 2k33 n VAL 83 Cb 0.84 -0.57 0.00 0.00 -1.47 0.00 0.00 33.84 32.64 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 -2.40 1.88 -4.86 -1.34 3.02 -1.26 -5.10 115.26 105.20 2k33 n ASN 84 Ca 0.07 -0.96 -0.34 0.00 -0.03 0.00 0.00 54.58 53.32 2k33 n ASN 84 Cb 0.38 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.49 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 -0.99 4.90 0.00 2.41 1.01 -1.26 -4.09 121.20 123.18 2k33 s ILE 85 Ca 0.00 0.66 0.00 0.00 0.00 0.00 0.00 60.65 61.31 2k33 s ILE 85 Cb 0.00 -3.68 0.00 0.00 0.01 0.00 0.00 42.46 38.79 2k33 s ILE 85 CO 0.00 0.10 0.00 0.61 0.00 0.00 0.00 174.94 175.65 2k33 n GLY 86 N 0.38 0.49 3.42 6.18 0.00 -0.94 -4.98 105.19 109.74 2k33 n GLY 86 Ca -0.03 -0.57 -0.32 0.00 0.00 0.00 0.00 46.02 45.10 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 -2.52 3.82 0.57 1.61 -1.08 -1.26 -4.87 116.67 112.94 2k33 s ASP 87 Ca 0.00 -0.28 -0.21 0.00 -0.52 0.00 0.00 52.55 51.54 2k33 s ASP 87 Cb 0.00 -0.90 -0.04 0.00 -1.46 0.00 0.00 42.92 40.52 2k33 s ASP 87 CO 0.00 0.31 1.36 0.00 0.52 0.00 0.00 175.17 177.35 2k33 n TYR 88 N 2.57 2.27 -3.81 -5.34 4.19 -1.26 -2.36 117.16 113.42 2k33 n TYR 88 Ca -0.17 0.43 -0.12 0.00 3.31 0.00 0.00 57.90 61.34 2k33 n TYR 88 Cb 0.52 -2.35 -0.10 0.00 0.49 0.00 0.00 39.34 37.90 2k33 n TYR 88 CO 0.00 0.00 0.00 0.14 0.91 0.00 0.00 176.86 177.91 2k33 s VAL 89 N -1.30 0.06 0.55 2.97 -7.23 -0.11 -4.90 120.40 110.44 2k33 s VAL 89 Ca 0.74 -0.46 -0.02 0.00 -1.81 0.00 0.00 61.98 60.43 2k33 s VAL 89 Cb -0.41 -0.48 0.11 0.00 0.56 0.00 0.00 36.38 36.17 2k33 s VAL 89 CO 0.47 -0.25 0.76 -0.24 -0.31 0.00 0.00 175.10 175.53 2k33 n SER 90 N 1.72 0.81 0.00 4.85 2.88 -1.26 -1.52 113.62 121.10 2k33 n SER 90 Ca -0.20 -1.73 0.00 0.00 -1.33 0.00 0.00 58.87 55.61 2k33 n SER 90 Cb 0.56 -0.51 0.00 0.00 -0.75 0.00 0.00 64.21 63.51 2k33 n SER 90 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 2k33 n ALA 91 N -3.06 0.00 1.05 -1.46 0.00 -1.25 -4.09 120.51 111.70 2k33 n ALA 91 Ca -0.12 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.43 2k33 n ALA 91 Cb 0.42 0.00 0.09 0.00 0.00 0.00 0.00 19.45 19.96 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 -0.22 2.29 0.14 0.00 2.88 -1.26 -2.85 113.62 114.61 2k33 n SER 92 Ca 0.00 -1.65 0.02 0.00 -1.33 0.00 0.00 58.87 55.91 2k33 n SER 92 Cb 0.00 0.25 0.08 0.00 -0.75 0.00 0.00 64.21 63.79 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 3.20 0.99 -3.02 2.46 2.02 -1.93 -3.40 112.91 113.21 2k33 h THR 93 Ca 0.00 -2.22 -0.72 0.00 0.77 0.00 0.00 66.41 64.24 2k33 h THR 93 Cb 0.82 2.36 -0.21 0.00 -1.74 0.00 0.00 68.15 69.38 2k33 h THR 93 CO 0.00 0.53 0.28 -0.89 0.37 0.00 0.00 175.52 175.81 2k33 s THR 94 N -3.08 5.01 -1.12 3.16 2.01 -1.26 -4.91 115.64 115.46 2k33 s THR 94 Ca 0.03 -1.53 -0.03 0.00 0.31 0.00 0.00 61.69 60.46 2k33 s THR 94 Cb 0.09 -4.55 0.27 0.00 0.01 0.00 0.00 72.50 68.31 2k33 s THR 94 CO 0.74 -1.19 1.86 -1.84 -0.69 0.00 0.00 174.62 173.50 2k33 n GLU 95 N 5.75 4.94 -0.21 4.92 0.28 -1.26 -4.49 120.64 130.56 2k33 n GLU 95 Ca 0.04 -4.33 -0.12 0.00 -0.16 0.00 0.00 57.16 52.60 2k33 n GLU 95 Cb 0.45 -2.54 -0.09 0.00 1.43 0.00 0.00 31.44 30.69 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 5.02 -1.79 -8.14 -1.84 -0.00 -1.92 -3.43 115.31 103.21 2k33 h LEU 96 Ca 0.48 0.25 -0.25 0.00 -0.00 0.00 0.00 57.88 58.36 2k33 h LEU 96 Cb 0.41 0.75 -0.21 0.00 -0.00 0.00 0.00 40.66 41.61 2k33 h LEU 96 CO 1.31 -0.31 -0.72 0.54 -0.00 0.00 0.00 178.44 179.25 2k33 s VAL 97 N -5.35 0.45 0.19 0.15 0.11 -1.26 -1.63 120.40 113.04 2k33 s VAL 97 Ca -0.12 -1.10 0.06 0.00 -2.93 0.00 0.00 61.98 57.89 2k33 s VAL 97 Cb 0.08 -0.60 -0.04 0.00 -1.53 0.00 0.00 36.38 34.29 2k33 s VAL 97 CO 0.56 -0.45 0.10 0.00 -3.33 0.00 0.00 175.10 171.99 2k33 s ARG 98 N -1.71 2.74 -0.11 1.54 1.70 -1.26 -1.87 118.95 119.98 2k33 s ARG 98 Ca -0.10 -0.99 0.03 0.00 -0.47 0.00 0.00 55.73 54.20 2k33 s ARG 98 Cb -0.09 -2.53 0.00 0.00 -0.57 0.00 0.00 34.95 31.77 2k33 s ARG 98 CO -0.00 0.46 -0.22 0.54 -1.08 0.00 0.00 175.30 174.99 2k33 s VAL 99 N -1.84 1.96 0.23 4.99 0.11 0.12 -2.53 120.40 123.43 2k33 s VAL 99 Ca 0.30 -0.94 0.00 0.00 -2.93 0.00 0.00 61.98 58.41 2k33 s VAL 99 Cb -0.09 -1.71 -0.04 0.00 -1.53 0.00 0.00 36.38 33.00 2k33 s VAL 99 CO 0.22 0.53 0.14 0.28 -3.33 0.00 0.00 175.10 172.94 2k33 s THR 100 N 0.55 0.13 -0.19 5.04 -1.32 -0.95 -1.63 115.64 117.27 2k33 s THR 100 Ca -0.14 -2.00 -0.06 0.00 -1.21 0.00 0.00 61.69 58.28 2k33 s THR 100 Cb -0.17 -2.53 0.02 0.00 -1.51 0.00 0.00 72.50 68.32 2k33 s THR 100 CO 0.05 0.00 0.12 0.59 -2.21 0.00 0.00 174.62 173.17 2k33 n ASN 101 N -0.46 -3.16 -3.91 8.08 4.13 -1.26 -1.29 115.26 117.38 2k33 n ASN 101 Ca 0.02 1.11 -0.10 0.00 1.68 0.00 0.00 54.58 57.30 2k33 n ASN 101 Cb 0.66 -4.46 -0.06 0.00 -1.54 0.00 0.00 39.78 34.38 2k33 n ASN 101 CO 0.00 0.00 0.00 -1.48 0.28 0.00 0.00 177.26 176.06 2k33 s LEU 102 N -0.86 0.69 0.47 3.41 -0.00 -1.26 -3.41 118.68 117.72 2k33 s LEU 102 Ca -0.14 -0.78 -0.14 0.00 -0.00 0.00 0.00 54.13 53.07 2k33 s LEU 102 Cb 0.01 1.47 -0.07 0.00 -0.00 0.00 0.00 46.19 47.59 2k33 s LEU 102 CO 0.64 -0.95 0.90 0.20 -0.00 0.00 0.00 176.35 177.14 2k33 s ASN 103 N -2.95 6.60 -0.67 1.48 -0.87 -1.26 -4.97 114.94 112.30 2k33 s ASN 103 Ca 0.16 1.41 -0.26 0.00 -1.57 0.00 0.00 52.86 52.59 2k33 s ASN 103 Cb 0.02 -2.44 -0.03 0.00 -0.02 0.00 0.00 41.25 38.78 2k33 s ASN 103 CO 0.00 -0.50 1.88 -2.16 -2.57 0.00 0.00 177.10 173.75 2k33 s PRO 104 N -3.93 2.61 0.04 -0.60 0.04 -1.26 -4.97 135.00 126.93 2k33 s PRO 104 Ca 0.56 0.42 0.01 0.00 0.04 0.00 0.00 61.00 62.03 2k33 s PRO 104 Cb -0.10 -4.53 -0.04 0.00 0.04 0.00 0.00 34.50 29.87 2k33 s PRO 104 CO 0.30 -2.87 0.09 0.42 0.04 0.00 0.00 177.00 174.99 2k33 s ILE 105 N 9.28 4.71 0.00 0.56 -1.09 -1.26 -4.99 121.20 128.41 2k33 s ILE 105 Ca 0.68 -0.56 0.00 0.00 -2.23 0.00 0.00 60.65 58.53 2k33 s ILE 105 Cb -0.11 -3.22 0.00 0.00 -1.58 0.00 0.00 42.46 37.55 2k33 s ILE 105 CO 0.16 0.23 0.75 0.00 -1.23 0.00 0.00 174.94 174.85 2k33 n TYR 106 N 0.77 0.00 -3.90 3.97 4.11 -1.26 -5.15 117.16 115.70 2k33 n TYR 106 Ca -0.10 -0.35 -0.02 0.00 -0.00 0.00 0.00 57.90 57.43 2k33 n TYR 106 Cb 0.52 0.42 0.02 0.00 -0.00 0.00 0.00 39.34 40.30 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 0.00 -1.80 0.59 -3.48 0.00 -1.26 -5.17 121.76 110.64 2k33 s ALA 107 Ca 0.00 -0.23 -0.07 0.00 0.00 0.00 0.00 51.96 51.65 2k33 s ALA 107 Cb 0.00 0.78 -0.01 0.00 0.00 0.00 0.00 23.12 23.90 2k33 s ALA 107 CO 0.00 -1.08 0.93 -0.51 0.00 0.00 0.00 175.76 175.09 2k33 s ASP 108 N -3.48 5.78 0.11 0.00 1.01 -1.26 -5.00 116.67 113.82 2k33 s ASP 108 Ca 0.23 0.91 0.00 0.00 0.71 0.00 0.00 52.55 54.41 2k33 s ASP 108 Cb -0.02 -1.95 0.00 0.00 1.01 0.00 0.00 42.92 41.96 2k33 s ASP 108 CO 0.04 -0.99 0.00 0.61 0.21 0.00 0.00 175.17 175.04 2k33 n GLY 109 N -2.61 -1.50 0.35 0.21 0.00 -1.26 -5.01 105.19 95.38 2k33 n GLY 109 Ca 0.04 0.34 -0.14 0.00 0.00 0.00 0.00 46.02 46.27 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 -0.75 -5.20 1.61 0.87 -1.99 -3.49 113.55 104.61 2k33 h SER 110 Ca 0.00 0.03 -0.00 0.00 -1.23 0.00 0.00 61.79 60.59 2k33 h SER 110 Cb 0.00 0.19 0.00 0.00 -0.44 0.00 0.00 62.40 62.15 2k33 h SER 110 CO 0.00 -0.51 -1.00 1.57 -0.53 0.00 0.00 176.83 176.36 2k33 n HIS 111 N -4.52 -3.86 -3.64 2.24 -0.00 -1.26 -5.01 115.22 99.18 2k33 n HIS 111 Ca -0.11 1.71 -0.30 0.00 0.46 0.00 0.00 57.72 59.48 2k33 n HIS 111 Cb 0.35 -3.91 -0.04 0.00 -0.12 0.00 0.00 29.99 26.27 2k33 n HIS 111 CO 0.00 0.00 0.00 -1.58 0.46 0.00 0.00 176.34 175.22 2k33 s HIS 112 N -1.62 3.48 -0.07 1.57 2.46 -1.26 -5.03 115.29 114.81 2k33 s HIS 112 Ca 0.00 0.49 -0.08 0.00 0.47 0.00 0.00 55.06 55.95 2k33 s HIS 112 Cb -0.00 -1.97 -0.04 0.00 -0.13 0.00 0.00 32.58 30.44 2k33 s HIS 112 CO 0.76 0.38 -0.17 0.72 -2.47 0.00 0.00 174.74 173.96 2k33 n HIS 113 N -0.30 0.00 -1.30 3.88 8.25 -1.26 -5.13 115.22 119.36 2k33 n HIS 113 Ca -0.03 0.00 0.16 0.00 -0.26 0.00 0.00 57.72 57.59 2k33 n HIS 113 Cb 0.53 -0.33 -0.07 0.00 1.12 0.00 0.00 29.99 31.23 2k33 n HIS 113 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2k33 n HIS 114 N -3.83 -3.43 -3.75 4.41 8.25 -1.26 -4.79 115.22 110.81 2k33 n HIS 114 Ca -0.14 1.85 -0.38 0.00 -0.26 0.00 0.00 57.72 58.79 2k33 n HIS 114 Cb 0.41 -3.12 -0.12 0.00 1.12 0.00 0.00 29.99 28.27 2k33 n HIS 114 CO 0.00 0.00 0.00 -1.01 0.64 0.00 0.00 176.34 175.97 2k33 s HIS 115 N -3.67 3.26 0.00 4.41 3.76 -1.26 -5.35 115.29 116.45 2k33 s HIS 115 Ca 0.00 -1.44 0.00 0.00 -0.15 0.00 0.00 55.06 53.47 2k33 s HIS 115 Cb 0.00 -2.30 0.00 0.00 1.11 0.00 0.00 32.58 31.39 2k33 s HIS 115 CO 0.00 -0.73 0.00 -2.39 -0.85 0.00 0.00 174.74 170.77