#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dmo n SER 2 N 0.00 -5.94 -0.03 1.61 2.88 -1.26 -4.90 113.62 105.98 2dmo n SER 2 Ca 0.00 -0.34 -0.03 0.00 -1.33 0.00 0.00 58.87 57.17 2dmo n SER 2 Cb 0.00 -4.70 -0.13 0.00 -0.75 0.00 0.00 64.21 58.63 2dmo n SER 2 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 2dmo n SER 3 N -2.38 0.38 -3.93 -3.46 7.64 -1.26 -4.98 113.62 105.63 2dmo n SER 3 Ca -0.07 0.17 -0.10 0.00 1.01 0.00 0.00 58.87 59.88 2dmo n SER 3 Cb 0.60 0.79 -0.10 0.00 -1.01 0.00 0.00 64.21 64.49 2dmo n SER 3 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2dmo s GLY 4 N -5.05 0.16 0.01 0.23 0.00 -1.26 -5.17 107.32 96.24 2dmo s GLY 4 Ca -0.07 -0.46 -0.28 0.00 0.00 0.00 0.00 44.72 43.91 2dmo s GLY 4 CO 0.84 -0.58 0.90 -1.35 0.00 0.00 0.00 173.10 172.91 2dmo s SER 5 N -1.81 -0.34 0.03 1.64 1.04 -1.26 -5.09 113.70 107.92 2dmo s SER 5 Ca -0.10 -0.05 -0.07 0.00 0.48 0.00 0.00 55.95 56.22 2dmo s SER 5 Cb -0.04 0.39 -0.01 0.00 0.10 0.00 0.00 66.02 66.46 2dmo s SER 5 CO -0.02 -0.64 0.12 -0.44 0.98 0.00 0.00 173.24 173.24 2dmo s SER 6 N -2.53 0.12 -0.17 7.02 0.01 -1.26 -5.14 113.70 111.74 2dmo s SER 6 Ca 0.06 -0.44 -0.18 0.00 1.31 0.00 0.00 55.95 56.70 2dmo s SER 6 Cb -0.01 0.24 -0.04 0.00 0.21 0.00 0.00 66.02 66.42 2dmo s SER 6 CO -0.08 -0.49 0.50 -0.83 0.41 0.00 0.00 173.24 172.75 2dmo s GLY 7 N -1.99 2.17 -0.12 3.44 0.00 -1.26 -4.77 107.32 104.80 2dmo s GLY 7 Ca -0.07 -0.34 -0.04 0.00 0.00 0.00 0.00 44.72 44.27 2dmo s GLY 7 CO -0.03 0.97 0.01 -0.54 0.00 0.00 0.00 173.10 173.51 2dmo s GLU 8 N 1.31 3.38 0.05 2.90 2.02 -1.20 -4.85 118.70 122.31 2dmo s GLU 8 Ca 0.24 -0.41 -0.31 0.00 0.02 0.00 0.00 54.97 54.52 2dmo s GLU 8 Cb -0.15 -2.93 -0.06 0.00 0.10 0.00 0.00 34.13 31.08 2dmo s GLU 8 CO 0.10 0.51 1.32 0.00 0.02 0.00 0.00 175.26 177.20 2dmo s ALA 9 N -0.33 3.52 0.05 5.21 0.00 -1.26 -1.40 121.76 127.56 2dmo s ALA 9 Ca 0.07 0.92 0.04 0.00 0.00 0.00 0.00 51.96 53.00 2dmo s ALA 9 Cb -0.12 -3.52 -0.02 0.00 0.00 0.00 0.00 23.12 19.45 2dmo s ALA 9 CO 0.02 -0.65 -0.12 -1.01 0.00 0.00 0.00 175.76 173.99 2dmo s HIS 10 N 1.55 1.06 -0.26 0.00 3.76 0.46 -1.65 115.29 120.22 2dmo s HIS 10 Ca 0.62 -0.42 -0.15 0.00 -0.15 0.00 0.00 55.06 54.96 2dmo s HIS 10 Cb -0.32 -0.61 -0.04 0.00 1.11 0.00 0.00 32.58 32.72 2dmo s HIS 10 CO 0.28 0.02 0.37 0.50 -0.85 0.00 0.00 174.74 175.06 2dmo s ARG 11 N -1.46 4.04 -0.12 1.40 3.52 -0.05 -1.41 118.95 124.87 2dmo s ARG 11 Ca -0.03 0.05 -0.29 0.00 -0.13 0.00 0.00 55.73 55.33 2dmo s ARG 11 Cb -0.09 -3.64 -0.04 0.00 -1.56 0.00 0.00 34.95 29.63 2dmo s ARG 11 CO 0.01 -0.24 1.50 0.08 -0.81 0.00 0.00 175.30 175.85 2dmo s VAL 12 N 1.95 3.85 -0.12 7.11 1.01 0.25 -2.58 120.40 131.88 2dmo s VAL 12 Ca 0.15 1.02 -0.11 0.00 0.00 0.00 0.00 61.98 63.05 2dmo s VAL 12 Cb -0.16 -3.69 -0.05 0.00 0.00 0.00 0.00 36.38 32.49 2dmo s VAL 12 CO 0.09 -0.12 0.23 -0.76 0.00 0.00 0.00 175.10 174.55 2dmo s LEU 13 N 3.97 4.35 0.33 3.92 1.43 -1.18 -0.23 118.68 131.27 2dmo s LEU 13 Ca 0.66 0.55 -0.29 0.00 -1.03 0.00 0.00 54.13 54.02 2dmo s LEU 13 Cb -0.28 -2.26 -0.12 0.00 0.03 0.00 0.00 46.19 43.56 2dmo s LEU 13 CO 0.24 0.28 1.42 2.22 0.23 0.00 0.00 176.35 180.75 2dmo n PHE 14 N 2.56 2.57 0.00 0.29 -1.74 -1.26 -4.50 117.46 115.38 2dmo n PHE 14 Ca -0.16 0.44 0.00 0.00 -0.56 0.00 0.00 57.45 57.17 2dmo n PHE 14 Cb 0.53 -2.49 0.00 0.00 1.52 0.00 0.00 39.48 39.04 2dmo n PHE 14 CO 0.00 0.00 0.00 0.41 -0.56 0.00 0.00 176.76 176.61 2dmo n GLY 15 N 1.19 -0.57 3.53 4.97 0.00 -1.26 -5.11 105.19 107.94 2dmo n GLY 15 Ca 0.06 0.35 -0.34 0.00 0.00 0.00 0.00 46.02 46.08 2dmo n GLY 15 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 2dmo s PHE 16 N 0.00 3.00 -0.70 1.61 5.36 -1.26 -5.07 117.98 120.92 2dmo s PHE 16 Ca 0.00 -0.19 -0.03 0.00 -0.96 0.00 0.00 56.93 55.75 2dmo s PHE 16 Cb 0.00 -1.87 0.18 0.00 -0.34 0.00 0.00 43.02 40.99 2dmo s PHE 16 CO 0.00 0.09 0.53 0.08 -1.46 0.00 0.00 175.22 174.47 2dmo s VAL 17 N -0.06 3.92 -0.89 3.12 1.01 -1.26 -5.02 120.40 121.22 2dmo s VAL 17 Ca 0.01 -3.20 -0.25 0.00 0.00 0.00 0.00 61.98 58.55 2dmo s VAL 17 Cb -0.13 -3.52 -0.05 0.00 0.00 0.00 0.00 36.38 32.69 2dmo s VAL 17 CO 0.03 -0.94 1.94 -2.16 0.00 0.00 0.00 175.10 173.97 2dmo s PRO 18 N -0.40 2.56 -0.55 2.72 0.04 -1.26 -4.90 135.00 133.20 2dmo s PRO 18 Ca 0.20 -0.26 -0.02 0.00 0.04 0.00 0.00 61.00 60.96 2dmo s PRO 18 Cb -0.17 -5.04 0.14 0.00 0.04 0.00 0.00 34.50 29.48 2dmo s PRO 18 CO -0.06 -3.35 0.35 -1.21 0.04 0.00 0.00 177.00 172.78 2dmo s GLU 19 N 7.00 2.33 0.25 4.56 2.02 -1.26 -3.59 118.70 130.01 2dmo s GLU 19 Ca 0.70 -2.36 -0.03 0.00 0.02 0.00 0.00 54.97 53.30 2dmo s GLU 19 Cb -0.07 -3.63 0.01 0.00 0.10 0.00 0.00 34.13 30.55 2dmo s GLU 19 CO 0.00 -1.13 0.39 0.25 0.02 0.00 0.00 175.26 174.79 2dmo n THR 20 N 3.72 0.00 0.12 3.63 -2.24 -1.26 -5.03 114.28 113.21 2dmo n THR 20 Ca 0.05 -1.13 0.01 0.00 -2.27 0.00 0.00 64.05 60.71 2dmo n THR 20 Cb 0.38 0.76 -0.00 0.00 -2.10 0.00 0.00 70.33 69.36 2dmo n THR 20 CO 0.00 0.00 0.00 0.07 -0.57 0.00 0.00 175.07 174.57 2dmo h LYS 21 N 0.00 0.00 0.00 -0.78 5.09 -2.03 -3.37 116.57 115.48 2dmo h LYS 21 Ca -0.20 0.00 -0.30 0.00 0.09 0.00 0.00 60.65 60.24 2dmo h LYS 21 Cb 0.85 0.00 -0.05 0.00 0.10 0.00 0.00 32.23 33.13 2dmo h LYS 21 CO 0.27 0.54 -1.67 0.39 -2.09 0.00 0.00 179.45 176.89 2dmo n GLU 22 N -3.20 0.57 -1.00 0.07 1.02 -1.26 -4.97 120.64 111.86 2dmo n GLU 22 Ca 0.00 0.47 -0.28 0.00 -0.02 0.00 0.00 57.16 57.33 2dmo n GLU 22 Cb 0.77 -1.66 0.20 0.00 -0.02 0.00 0.00 31.44 30.73 2dmo n GLU 22 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 2dmo s GLU 23 N -2.41 -0.08 -0.10 3.49 2.02 -1.26 -4.23 118.70 116.12 2dmo s GLU 23 Ca -0.32 0.54 0.01 0.00 0.02 0.00 0.00 54.97 55.22 2dmo s GLU 23 Cb 0.09 -1.68 -0.02 0.00 0.10 0.00 0.00 34.13 32.62 2dmo s GLU 23 CO 0.55 -3.08 -0.14 -1.17 0.02 0.00 0.00 175.26 171.44 2dmo s LEU 24 N -6.70 2.72 -0.35 1.80 2.96 -1.24 -4.47 118.68 113.39 2dmo s LEU 24 Ca 0.66 -0.29 -0.29 0.00 -0.22 0.00 0.00 54.13 54.00 2dmo s LEU 24 Cb -0.20 -1.59 0.02 0.00 0.50 0.00 0.00 46.19 44.92 2dmo s LEU 24 CO 0.59 0.22 1.13 -1.58 -1.32 0.00 0.00 176.35 175.39 2dmo s GLN 25 N 0.01 3.97 0.17 1.98 0.74 -1.24 -4.68 119.66 120.62 2dmo s GLN 25 Ca -0.04 0.99 0.10 0.00 0.05 0.00 0.00 55.36 56.47 2dmo s GLN 25 Cb -0.14 -3.80 -0.04 0.00 1.10 0.00 0.00 33.01 30.13 2dmo s GLN 25 CO 0.04 -1.04 -0.20 0.14 -0.55 0.00 0.00 175.29 173.68 2dmo s VAL 26 N 3.94 2.63 0.29 1.34 -7.23 -1.26 -5.12 120.40 114.99 2dmo s VAL 26 Ca 0.48 -1.84 0.01 0.00 -1.81 0.00 0.00 61.98 58.82 2dmo s VAL 26 Cb -0.12 -2.26 -0.03 0.00 0.56 0.00 0.00 36.38 34.53 2dmo s VAL 26 CO 0.20 -0.07 0.46 -0.04 -0.31 0.00 0.00 175.10 175.34 2dmo s MET 27 N -2.59 3.48 0.10 4.82 -1.94 -1.26 -4.94 119.30 116.97 2dmo s MET 27 Ca 0.21 -0.45 -0.31 0.00 -1.71 0.00 0.00 55.69 53.43 2dmo s MET 27 Cb -0.09 -2.76 -0.08 0.00 2.01 0.00 0.00 34.83 33.91 2dmo s MET 27 CO 0.11 0.28 1.37 -1.25 -0.01 0.00 0.00 175.02 175.52 2dmo s PRO 28 N -4.00 4.33 -0.06 2.03 0.04 -1.26 -2.88 135.00 133.19 2dmo s PRO 28 Ca 0.38 2.03 0.00 0.00 0.04 0.00 0.00 61.00 63.45 2dmo s PRO 28 Cb -0.10 -3.27 0.00 0.00 0.04 0.00 0.00 34.50 31.17 2dmo s PRO 28 CO 0.32 -0.42 0.00 0.41 0.04 0.00 0.00 177.00 177.35 2dmo n GLY 29 N 3.47 0.40 4.00 0.56 0.00 0.68 -5.00 105.19 109.30 2dmo n GLY 29 Ca 0.11 -1.00 -0.22 0.00 0.00 0.00 0.00 46.02 44.92 2dmo n GLY 29 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 2dmo s ASN 30 N -2.99 4.75 -0.05 1.61 0.02 -1.14 -4.79 114.94 112.35 2dmo s ASN 30 Ca 0.00 -0.48 0.06 0.00 -1.02 0.00 0.00 52.86 51.43 2dmo s ASN 30 Cb 0.00 -0.05 -0.01 0.00 0.02 0.00 0.00 41.25 41.21 2dmo s ASN 30 CO 0.00 -1.56 -0.25 -0.63 0.02 0.00 0.00 177.10 174.68 2dmo s ILE 31 N -2.91 2.12 0.06 0.60 -1.09 -1.26 -0.58 121.20 118.14 2dmo s ILE 31 Ca 0.63 -1.06 -0.00 0.00 -2.23 0.00 0.00 60.65 57.99 2dmo s ILE 31 Cb -0.06 -1.76 -0.04 0.00 -1.58 0.00 0.00 42.46 39.02 2dmo s ILE 31 CO 0.41 0.57 -0.04 0.68 -1.23 0.00 0.00 174.94 175.34 2dmo s VAL 32 N -0.31 0.30 -0.51 2.92 -7.23 -0.50 -4.93 120.40 110.14 2dmo s VAL 32 Ca 0.01 -1.78 -0.08 0.00 -1.81 0.00 0.00 61.98 58.32 2dmo s VAL 32 Cb -0.13 -1.48 0.13 0.00 0.56 0.00 0.00 36.38 35.47 2dmo s VAL 32 CO 0.02 -0.94 0.38 -0.36 -0.31 0.00 0.00 175.10 173.88 2dmo s PHE 33 N -3.71 3.46 -0.19 2.82 0.08 -1.19 -0.40 117.98 118.85 2dmo s PHE 33 Ca 0.07 -2.01 -0.29 0.00 0.12 0.00 0.00 56.93 54.81 2dmo s PHE 33 Cb 0.06 -3.47 -0.06 0.00 -0.57 0.00 0.00 43.02 38.98 2dmo s PHE 33 CO -0.08 -0.98 2.18 0.28 -0.10 0.00 0.00 175.22 176.52 2dmo n VAL 34 N 4.67 0.40 -0.05 -0.44 0.31 -0.49 -2.50 118.33 120.23 2dmo n VAL 34 Ca -0.04 -0.40 -0.02 0.00 -0.01 0.00 0.00 64.34 63.86 2dmo n VAL 34 Cb 0.41 -2.48 -0.02 0.00 -0.91 0.00 0.00 33.84 30.84 2dmo n VAL 34 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 2dmo h LEU 35 N 14.24 -0.01 -8.28 7.52 3.38 -0.84 -3.18 115.31 128.15 2dmo h LEU 35 Ca -0.42 -0.15 -0.22 0.00 0.09 0.00 0.00 57.88 57.18 2dmo h LEU 35 Cb 1.24 0.00 -0.17 0.00 0.09 0.00 0.00 40.66 41.82 2dmo h LEU 35 CO 0.96 0.57 -0.71 -1.59 0.09 0.00 0.00 178.44 177.76 2dmo s LYS 36 N -1.68 0.65 -0.66 1.13 -2.85 -1.23 -4.75 119.74 110.36 2dmo s LYS 36 Ca -0.03 -1.07 -0.05 0.00 -1.00 0.00 0.00 55.97 53.82 2dmo s LYS 36 Cb -0.00 -0.13 0.17 0.00 -2.06 0.00 0.00 37.83 35.80 2dmo s LYS 36 CO 0.11 -0.02 0.50 0.15 0.10 0.00 0.00 175.35 176.19 2dmo s LYS 37 N -2.93 2.75 1.13 1.78 1.02 -1.26 -0.57 119.74 121.66 2dmo s LYS 37 Ca 0.02 -2.49 -0.18 0.00 0.02 0.00 0.00 55.97 53.34 2dmo s LYS 37 Cb -0.00 -3.86 0.15 0.00 -0.52 0.00 0.00 37.83 33.59 2dmo s LYS 37 CO -0.04 -1.19 0.16 0.41 -0.92 0.00 0.00 175.35 173.77 2dmo n GLY 38 N 3.63 -2.58 0.09 -3.33 0.00 -0.46 -4.92 105.19 97.62 2dmo n GLY 38 Ca 0.08 -0.87 -0.08 0.00 0.00 0.00 0.00 46.02 45.15 2dmo n GLY 38 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2dmo n ASN 39 N -2.04 0.60 -2.22 1.61 2.85 -1.26 -4.24 115.26 110.56 2dmo n ASN 39 Ca 0.02 0.28 -0.25 0.00 -0.11 0.00 0.00 54.58 54.53 2dmo n ASN 39 Cb 0.57 0.30 0.02 0.00 1.24 0.00 0.00 39.78 41.91 2dmo n ASN 39 CO 0.00 0.00 0.00 0.47 -2.11 0.00 0.00 177.26 175.62 2dmo n ASP 40 N -2.93 6.82 -2.29 1.20 8.00 -1.26 -4.77 116.55 121.31 2dmo n ASP 40 Ca -0.21 -3.31 -0.18 0.00 0.71 0.00 0.00 54.79 51.80 2dmo n ASP 40 Cb 1.06 -1.09 -0.02 0.00 -0.02 0.00 0.00 41.12 41.06 2dmo n ASP 40 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 2dmo n ASN 41 N 0.16 -5.07 -4.05 -2.24 4.13 -1.26 -4.92 115.26 102.00 2dmo n ASN 41 Ca 0.44 0.12 -0.35 0.00 1.68 0.00 0.00 54.58 56.47 2dmo n ASN 41 Cb 0.56 -4.29 -0.10 0.00 -1.54 0.00 0.00 39.78 34.41 2dmo n ASN 41 CO 0.00 0.00 0.00 0.26 0.28 0.00 0.00 177.26 177.80 2dmo s TRP 42 N -2.82 3.41 -0.16 3.10 0.23 -1.26 -3.90 118.94 117.53 2dmo s TRP 42 Ca 0.00 -2.89 -0.13 0.00 -2.03 0.00 0.00 56.10 51.05 2dmo s TRP 42 Cb 0.00 -3.10 -0.05 0.00 0.03 0.00 0.00 33.47 30.36 2dmo s TRP 42 CO 0.00 -0.79 0.27 0.00 0.96 0.00 0.00 176.95 177.39 2dmo s ALA 43 N -0.35 3.60 0.38 0.98 0.00 -0.25 -1.35 121.76 124.77 2dmo s ALA 43 Ca 0.19 -0.48 -0.25 0.00 0.00 0.00 0.00 51.96 51.42 2dmo s ALA 43 Cb -0.19 -2.36 -0.09 0.00 0.00 0.00 0.00 23.12 20.47 2dmo s ALA 43 CO -0.04 0.10 1.03 0.99 0.00 0.00 0.00 175.76 177.84 2dmo s THR 44 N 0.44 3.80 0.07 0.00 2.01 0.27 -1.44 115.64 120.79 2dmo s THR 44 Ca 0.15 1.41 -0.06 0.00 0.31 0.00 0.00 61.69 63.50 2dmo s THR 44 Cb -0.13 -3.74 -0.01 0.00 0.01 0.00 0.00 72.50 68.63 2dmo s THR 44 CO 0.03 0.04 0.12 0.68 -0.69 0.00 0.00 174.62 174.80 2dmo s VAL 45 N -1.63 0.16 -0.10 3.82 -7.23 -0.49 -0.14 120.40 114.79 2dmo s VAL 45 Ca 0.56 -1.35 0.03 0.00 -1.81 0.00 0.00 61.98 59.42 2dmo s VAL 45 Cb -0.22 -1.35 -0.00 0.00 0.56 0.00 0.00 36.38 35.37 2dmo s VAL 45 CO 0.27 -0.74 -0.22 -0.04 -0.31 0.00 0.00 175.10 174.06 2dmo s MET 46 N -3.75 3.07 -0.15 4.82 -1.94 -1.04 -2.07 119.30 118.25 2dmo s MET 46 Ca 0.04 -0.85 -0.04 0.00 -1.71 0.00 0.00 55.69 53.14 2dmo s MET 46 Cb 0.05 -2.35 0.07 0.00 2.01 0.00 0.00 34.83 34.61 2dmo s MET 46 CO -0.10 0.20 0.16 0.12 -0.01 0.00 0.00 175.02 175.39 2dmo s PHE 47 N 0.30 -0.09 -1.36 -0.03 5.36 -0.01 -3.16 117.98 118.98 2dmo s PHE 47 Ca -0.16 0.19 -0.09 0.00 -0.96 0.00 0.00 56.93 55.91 2dmo s PHE 47 Cb -0.17 -0.43 0.01 0.00 -0.34 0.00 0.00 43.02 42.08 2dmo s PHE 47 CO 0.08 -0.45 1.15 -1.71 -1.46 0.00 0.00 175.22 172.83 2dmo n ASN 48 N 5.31 -6.37 -0.98 6.13 5.15 -1.26 -1.75 115.26 121.49 2dmo n ASN 48 Ca -0.05 -0.52 -0.10 0.00 -0.60 0.00 0.00 54.58 53.31 2dmo n ASN 48 Cb 0.49 -5.01 -0.02 0.00 -0.53 0.00 0.00 39.78 34.72 2dmo n ASN 48 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2dmo n GLY 49 N -1.98 0.36 3.10 8.20 0.00 -1.26 -5.02 105.19 108.59 2dmo n GLY 49 Ca 0.00 -0.52 -0.26 0.00 0.00 0.00 0.00 46.02 45.24 2dmo n GLY 49 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2dmo s GLN 50 N -3.92 1.93 -0.05 1.61 -0.21 -0.72 -5.13 119.66 113.17 2dmo s GLN 50 Ca 0.00 -0.56 -0.09 0.00 0.02 0.00 0.00 55.36 54.73 2dmo s GLN 50 Cb 0.00 -1.59 -0.05 0.00 1.00 0.00 0.00 33.01 32.37 2dmo s GLN 50 CO 0.00 0.14 0.25 0.21 -2.12 0.00 0.00 175.29 173.77 2dmo s LYS 51 N 0.35 3.60 0.28 2.91 2.20 -1.26 -0.83 119.74 126.98 2dmo s LYS 51 Ca -0.11 0.02 -0.20 0.00 -0.36 0.00 0.00 55.97 55.32 2dmo s LYS 51 Cb -0.14 -3.16 0.04 0.00 -1.51 0.00 0.00 37.83 33.06 2dmo s LYS 51 CO 0.04 0.71 0.81 0.20 -0.36 0.00 0.00 175.35 176.75 2dmo s GLY 52 N -1.28 0.03 -0.05 5.54 0.00 -0.88 -4.81 107.32 105.87 2dmo s GLY 52 Ca 0.22 -0.36 -0.01 0.00 0.00 0.00 0.00 44.72 44.57 2dmo s GLY 52 CO 0.11 0.09 0.01 1.08 0.00 0.00 0.00 173.10 174.38 2dmo s LEU 53 N -3.01 3.58 0.06 0.66 1.43 -1.26 -1.40 118.68 118.75 2dmo s LEU 53 Ca 0.13 0.10 -0.17 0.00 -1.03 0.00 0.00 54.13 53.16 2dmo s LEU 53 Cb -0.05 -1.91 0.03 0.00 0.03 0.00 0.00 46.19 44.30 2dmo s LEU 53 CO 0.07 0.34 0.39 0.68 0.23 0.00 0.00 176.35 178.07 2dmo s VAL 54 N -0.97 0.06 -0.13 -1.59 -7.23 -0.52 -3.70 120.40 106.33 2dmo s VAL 54 Ca 0.16 -0.52 -0.29 0.00 -1.81 0.00 0.00 61.98 59.51 2dmo s VAL 54 Cb -0.11 -1.01 -0.04 0.00 0.56 0.00 0.00 36.38 35.78 2dmo s VAL 54 CO 0.05 -0.29 1.55 -2.16 -0.31 0.00 0.00 175.10 173.95 2dmo s PRO 55 N -2.84 4.07 0.32 4.82 0.04 -1.25 -1.09 135.00 139.07 2dmo s PRO 55 Ca -0.03 1.90 0.04 0.00 0.04 0.00 0.00 61.00 62.95 2dmo s PRO 55 Cb -0.00 -3.95 0.54 0.00 0.04 0.00 0.00 34.50 31.13 2dmo s PRO 55 CO -0.05 -0.95 1.82 0.00 0.04 0.00 0.00 177.00 177.86 2dmo h ASN 57 N 0.45 0.35 -1.15 0.00 -0.73 -1.90 -1.33 115.58 111.27 2dmo h ASN 57 Ca 0.09 0.02 -0.56 0.00 1.87 0.00 0.00 56.30 57.72 2dmo h ASN 57 Cb 0.46 -0.05 -0.21 0.00 0.27 0.00 0.00 38.32 38.79 2dmo h ASN 57 CO 0.03 0.18 0.65 -1.22 -0.37 0.00 0.00 177.43 176.70 2dmo n TYR 58 N -4.47 2.23 -3.91 0.67 4.01 -0.97 -4.90 117.16 109.82 2dmo n TYR 58 Ca 0.14 -2.25 -0.09 0.00 -0.16 0.00 0.00 57.90 55.53 2dmo n TYR 58 Cb 0.53 -1.26 -0.09 0.00 -0.31 0.00 0.00 39.34 38.21 2dmo n TYR 58 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 2dmo s LEU 59 N -2.87 1.70 -0.02 7.72 1.43 -0.50 -3.09 118.68 123.05 2dmo s LEU 59 Ca 0.52 -0.54 0.02 0.00 -1.03 0.00 0.00 54.13 53.10 2dmo s LEU 59 Cb 0.39 0.71 0.00 0.00 0.03 0.00 0.00 46.19 47.32 2dmo s LEU 59 CO -0.18 -0.55 -0.07 -0.70 0.23 0.00 0.00 176.35 175.07 2dmo s GLU 60 N -2.84 0.71 -0.18 1.70 2.12 -1.06 -4.97 118.70 114.18 2dmo s GLU 60 Ca -0.03 -0.25 -0.29 0.00 0.36 0.00 0.00 54.97 54.76 2dmo s GLU 60 Cb 0.00 -0.69 -0.03 0.00 0.26 0.00 0.00 34.13 33.67 2dmo s GLU 60 CO -0.06 0.11 1.58 -1.25 -0.54 0.00 0.00 175.26 175.11 2dmo s PRO 61 N 0.09 3.93 -0.79 4.30 0.04 -1.26 -0.87 135.00 140.43 2dmo s PRO 61 Ca -0.01 1.77 -0.17 0.00 0.04 0.00 0.00 61.00 62.63 2dmo s PRO 61 Cb -0.06 -3.99 0.16 0.00 0.04 0.00 0.00 34.50 30.64 2dmo s PRO 61 CO -0.00 -1.13 0.86 0.08 0.04 0.00 0.00 177.00 176.84 2dmo s VAL 62 N 4.76 5.12 -0.54 -0.36 1.01 -0.66 -4.91 120.40 124.82 2dmo s VAL 62 Ca 0.70 -1.78 -0.14 0.00 0.00 0.00 0.00 61.98 60.76 2dmo s VAL 62 Cb -0.26 -4.57 0.13 0.00 0.00 0.00 0.00 36.38 31.68 2dmo s VAL 62 CO 0.28 -1.20 0.47 -0.55 0.00 0.00 0.00 175.10 174.10 2dmo s SER 63 N 3.05 6.09 0.96 3.32 0.15 -1.26 -4.67 113.70 121.34 2dmo s SER 63 Ca 0.20 -1.87 -0.15 0.00 0.70 0.00 0.00 55.95 54.83 2dmo s SER 63 Cb -0.13 -2.16 0.21 0.00 -1.71 0.00 0.00 66.02 62.24 2dmo s SER 63 CO -0.05 -0.80 1.32 -0.83 1.20 0.00 0.00 173.24 174.08 2dmo s GLY 64 N 3.28 1.81 0.20 9.45 0.00 -1.26 -5.01 107.32 115.78 2dmo s GLY 64 Ca 0.04 -1.34 -0.30 0.00 0.00 0.00 0.00 44.72 43.12 2dmo s GLY 64 CO 0.01 -0.54 1.30 2.56 0.00 0.00 0.00 173.10 176.43 2dmo s PRO 65 N -5.87 4.39 0.35 2.90 0.04 -1.26 -5.01 135.00 130.54 2dmo s PRO 65 Ca 0.75 2.04 -0.17 0.00 0.04 0.00 0.00 61.00 63.67 2dmo s PRO 65 Cb -0.03 -3.20 0.06 0.00 0.04 0.00 0.00 34.50 31.37 2dmo s PRO 65 CO 0.53 -0.24 0.82 -1.54 0.04 0.00 0.00 177.00 176.61 2dmo s SER 66 N 0.32 -0.01 0.13 6.66 1.04 -1.26 -5.18 113.70 115.40 2dmo s SER 66 Ca 0.56 -1.06 0.10 0.00 0.48 0.00 0.00 55.95 56.03 2dmo s SER 66 Cb -0.36 0.80 -0.04 0.00 0.10 0.00 0.00 66.02 66.52 2dmo s SER 66 CO 0.38 -1.59 -0.23 -0.94 0.98 0.00 0.00 173.24 171.85 2dmo s SER 67 N -3.10 3.58 0.00 7.02 1.04 -1.26 -5.32 113.70 115.66 2dmo s SER 67 Ca 0.16 -0.67 0.00 0.00 0.48 0.00 0.00 55.95 55.92 2dmo s SER 67 Cb -0.05 -0.37 0.00 0.00 0.10 0.00 0.00 66.02 65.70 2dmo s SER 67 CO 0.10 0.18 0.00 0.61 0.98 0.00 0.00 173.24 175.11