#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dbm s SER 2 N 0.00 7.00 -0.73 1.61 0.15 -1.26 -4.94 113.70 115.53 2dbm s SER 2 Ca 0.00 1.23 -0.30 0.00 0.70 0.00 0.00 55.95 57.58 2dbm s SER 2 Cb 0.00 -2.46 -0.15 0.00 -1.71 0.00 0.00 66.02 61.69 2dbm s SER 2 CO 0.00 -0.37 2.53 -1.20 1.20 0.00 0.00 173.24 175.40 2dbm n SER 3 N 5.02 1.23 0.00 5.45 7.64 -1.26 -4.09 113.62 127.62 2dbm n SER 3 Ca 0.04 -0.04 0.00 0.00 1.01 0.00 0.00 58.87 59.88 2dbm n SER 3 Cb 0.49 -1.20 0.00 0.00 -1.01 0.00 0.00 64.21 62.49 2dbm n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2dbm n GLY 4 N 6.35 1.44 3.22 0.23 0.00 -1.26 -5.12 105.19 110.05 2dbm n GLY 4 Ca 0.53 -0.67 -0.34 0.00 0.00 0.00 0.00 46.02 45.53 2dbm n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2dbm s SER 5 N 0.00 4.22 -0.07 1.61 1.04 -1.26 -5.10 113.70 114.14 2dbm s SER 5 Ca 0.00 -0.76 0.03 0.00 0.48 0.00 0.00 55.95 55.71 2dbm s SER 5 Cb 0.00 -1.67 0.00 0.00 0.10 0.00 0.00 66.02 64.46 2dbm s SER 5 CO 0.00 -0.10 -0.18 -0.44 0.98 0.00 0.00 173.24 173.50 2dbm s SER 6 N 1.35 2.37 0.00 7.02 0.01 -1.26 -5.08 113.70 118.12 2dbm s SER 6 Ca 0.02 -0.41 0.00 0.00 1.31 0.00 0.00 55.95 56.86 2dbm s SER 6 Cb -0.16 -1.02 0.00 0.00 0.21 0.00 0.00 66.02 65.06 2dbm s SER 6 CO -0.05 0.11 0.00 0.61 0.41 0.00 0.00 173.24 174.32 2dbm n GLY 7 N 3.57 3.27 3.67 3.44 0.00 -1.26 -5.03 105.19 112.85 2dbm n GLY 7 Ca -0.21 -1.89 -0.42 0.00 0.00 0.00 0.00 46.02 43.50 2dbm n GLY 7 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dbm s PRO 8 N -3.38 4.22 0.17 1.61 0.04 -1.26 -4.97 135.00 131.43 2dbm s PRO 8 Ca 0.00 2.02 -0.02 0.00 0.04 0.00 0.00 61.00 63.04 2dbm s PRO 8 Cb 0.00 -3.82 -0.04 0.00 0.04 0.00 0.00 34.50 30.68 2dbm s PRO 8 CO 0.00 -0.75 0.12 0.00 0.04 0.00 0.00 177.00 176.41 2dbm s ARG 11 N 0.34 3.54 0.46 0.00 3.52 -1.10 -0.17 118.95 125.53 2dbm s ARG 11 Ca -0.02 -0.27 -0.12 0.00 -0.13 0.00 0.00 55.73 55.20 2dbm s ARG 11 Cb -0.03 -2.89 -0.06 0.00 -1.56 0.00 0.00 34.95 30.40 2dbm s ARG 11 CO -0.01 0.48 0.85 0.00 -0.81 0.00 0.00 175.30 175.81 2dbm s ALA 12 N -1.69 3.26 -0.04 6.12 0.00 -0.57 0.33 121.76 129.17 2dbm s ALA 12 Ca 0.39 -0.12 0.09 0.00 0.00 0.00 0.00 51.96 52.31 2dbm s ALA 12 Cb -0.12 -2.83 -0.13 0.00 0.00 0.00 0.00 23.12 20.04 2dbm s ALA 12 CO 0.27 -0.16 0.13 1.28 0.00 0.00 0.00 175.76 177.28 2dbm n LEU 13 N -1.58 0.00 -4.20 0.00 4.77 0.32 -1.59 117.00 114.71 2dbm n LEU 13 Ca 0.04 0.00 -0.14 0.00 -0.03 0.00 0.00 56.01 55.88 2dbm n LEU 13 Cb 0.54 0.09 -0.09 0.00 -2.33 0.00 0.00 43.42 41.63 2dbm n LEU 13 CO 0.49 0.09 -0.16 -0.31 -1.33 0.00 0.00 177.39 176.17 2dbm s TYR 14 N -2.47 1.27 -0.22 -1.77 2.02 -1.25 -4.78 117.35 110.16 2dbm s TYR 14 Ca -0.04 -1.41 -0.19 0.00 -0.37 0.00 0.00 57.07 55.06 2dbm s TYR 14 Cb 0.05 -0.53 -0.03 0.00 -0.40 0.00 0.00 41.96 41.05 2dbm s TYR 14 CO 0.38 -0.75 0.54 0.16 -1.57 0.00 0.00 175.55 174.31 2dbm s ASP 15 N -3.21 6.55 0.03 2.29 -4.77 -1.26 -3.53 116.67 112.76 2dbm s ASP 15 Ca 0.38 0.66 0.09 0.00 -3.30 0.00 0.00 52.55 50.38 2dbm s ASP 15 Cb 0.05 -2.30 -0.03 0.00 -1.09 0.00 0.00 42.92 39.55 2dbm s ASP 15 CO 0.17 -0.23 -0.25 0.12 0.70 0.00 0.00 175.17 175.67 2dbm s PHE 16 N 1.89 2.21 0.01 2.11 5.36 -1.05 -5.01 117.98 123.50 2dbm s PHE 16 Ca 0.24 -0.41 0.05 0.00 -0.96 0.00 0.00 56.93 55.86 2dbm s PHE 16 Cb -0.16 -1.35 -0.03 0.00 -0.34 0.00 0.00 43.02 41.14 2dbm s PHE 16 CO 0.09 0.08 -0.14 -1.21 -1.46 0.00 0.00 175.22 172.58 2dbm s GLU 17 N -1.07 2.31 0.29 10.12 2.02 -1.26 -3.01 118.70 128.11 2dbm s GLU 17 Ca 0.11 -0.84 -0.29 0.00 0.02 0.00 0.00 54.97 53.97 2dbm s GLU 17 Cb -0.10 -2.32 -0.10 0.00 0.10 0.00 0.00 34.13 31.72 2dbm s GLU 17 CO 0.01 0.58 1.24 -1.25 0.02 0.00 0.00 175.26 175.86 2dbm s PRO 18 N -1.23 4.45 -0.14 0.39 0.04 -1.26 -4.86 135.00 132.40 2dbm s PRO 18 Ca 0.14 2.05 -0.05 0.00 0.04 0.00 0.00 61.00 63.19 2dbm s PRO 18 Cb -0.11 -3.13 -0.25 0.00 0.04 0.00 0.00 34.50 31.05 2dbm s PRO 18 CO 0.04 -0.07 0.28 0.39 0.04 0.00 0.00 177.00 177.68 2dbm n GLU 19 N 1.26 0.74 -4.23 4.56 -0.58 -1.26 -5.02 120.64 116.10 2dbm n GLU 19 Ca 0.01 0.25 -0.18 0.00 -0.42 0.00 0.00 57.16 56.81 2dbm n GLU 19 Cb 0.43 -1.68 -0.07 0.00 -0.57 0.00 0.00 31.44 29.54 2dbm n GLU 19 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 2dbm s ASN 20 N -6.95 1.41 0.61 1.62 2.20 -1.26 -5.01 114.94 107.55 2dbm s ASN 20 Ca -0.24 -1.68 0.30 0.00 -0.94 0.00 0.00 52.86 50.30 2dbm s ASN 20 Cb 0.07 0.57 1.63 0.00 -2.00 0.00 0.00 41.25 41.52 2dbm s ASN 20 CO 0.75 -1.10 2.01 -0.33 -2.94 0.00 0.00 177.10 175.48 2dbm h GLU 21 N 2.16 0.00 -1.33 3.55 5.08 -2.05 -1.20 114.58 120.79 2dbm h GLU 21 Ca -0.26 0.00 -0.57 0.00 -1.00 0.00 0.00 59.36 57.52 2dbm h GLU 21 Cb 1.23 0.00 -0.24 0.00 0.50 0.00 0.00 28.75 30.25 2dbm h GLU 21 CO 0.38 0.00 0.73 0.41 -1.00 0.00 0.00 179.01 179.53 2dbm n GLY 22 N -1.38 5.21 2.81 -3.84 0.00 -1.26 -4.88 105.19 101.85 2dbm n GLY 22 Ca 0.03 -1.94 -0.15 0.00 0.00 0.00 0.00 46.02 43.96 2dbm n GLY 22 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2dbm s GLU 23 N -3.11 -0.01 -0.47 1.61 0.41 -0.45 -4.56 118.70 112.11 2dbm s GLU 23 Ca 0.53 0.22 -0.10 0.00 -0.41 0.00 0.00 54.97 55.21 2dbm s GLU 23 Cb 0.41 -0.23 0.11 0.00 -1.78 0.00 0.00 34.13 32.65 2dbm s GLU 23 CO -0.07 -0.16 0.35 -1.17 -0.49 0.00 0.00 175.26 173.72 2dbm s LEU 24 N 1.07 5.64 0.26 1.80 2.96 -1.23 -4.74 118.68 124.44 2dbm s LEU 24 Ca -0.09 -1.80 -0.30 0.00 -0.22 0.00 0.00 54.13 51.73 2dbm s LEU 24 Cb -0.12 -2.03 -0.09 0.00 0.50 0.00 0.00 46.19 44.44 2dbm s LEU 24 CO -0.04 -0.68 1.12 -0.83 -1.32 0.00 0.00 176.35 174.61 2dbm s GLY 25 N 2.66 2.98 0.45 7.98 0.00 -1.26 -4.72 107.32 115.41 2dbm s GLY 25 Ca 0.05 0.91 0.05 0.00 0.00 0.00 0.00 44.72 45.73 2dbm s GLY 25 CO 0.00 1.59 0.01 -0.11 0.00 0.00 0.00 173.10 174.59 2dbm s PHE 26 N -0.90 2.25 0.17 1.90 -0.12 -1.16 -4.96 117.98 115.16 2dbm s PHE 26 Ca 0.46 -0.79 0.09 0.00 -0.05 0.00 0.00 56.93 56.65 2dbm s PHE 26 Cb -0.32 -1.70 -0.04 0.00 -0.63 0.00 0.00 43.02 40.32 2dbm s PHE 26 CO 0.40 0.35 -0.19 0.15 -0.05 0.00 0.00 175.22 175.89 2dbm s LYS 27 N -3.78 1.32 -0.10 1.99 -0.14 -1.26 -2.54 119.74 115.23 2dbm s LYS 27 Ca 0.24 -1.43 -0.35 0.00 -1.36 0.00 0.00 55.97 53.07 2dbm s LYS 27 Cb 0.07 -1.42 -0.12 0.00 -1.68 0.00 0.00 37.83 34.67 2dbm s LYS 27 CO 0.12 0.29 1.88 -1.91 -0.76 0.00 0.00 175.35 174.97 2dbm n GLU 28 N 0.29 2.11 -1.61 1.68 2.13 -1.23 -0.92 120.64 123.09 2dbm n GLU 28 Ca -0.13 0.77 0.00 0.00 0.66 0.00 0.00 57.16 58.46 2dbm n GLU 28 Cb 0.57 -2.61 0.00 0.00 0.27 0.00 0.00 31.44 29.67 2dbm n GLU 28 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2dbm n GLY 29 N 4.41 0.46 3.46 8.31 0.00 -0.62 -4.95 105.19 116.26 2dbm n GLY 29 Ca 0.23 -0.88 -0.37 0.00 0.00 0.00 0.00 46.02 44.99 2dbm n GLY 29 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2dbm s ASP 30 N -2.93 5.35 -0.11 1.61 1.11 -0.09 -4.74 116.67 116.86 2dbm s ASP 30 Ca 0.00 -0.27 -0.27 0.00 0.18 0.00 0.00 52.55 52.20 2dbm s ASP 30 Cb 0.00 -1.97 -0.02 0.00 1.07 0.00 0.00 42.92 42.00 2dbm s ASP 30 CO 0.00 -0.08 0.87 -0.63 1.18 0.00 0.00 175.17 176.51 2dbm s ILE 31 N 1.63 4.89 -0.22 0.77 1.09 -1.26 -1.50 121.20 126.60 2dbm s ILE 31 Ca 0.06 1.76 -0.01 0.00 -1.10 0.00 0.00 60.65 61.36 2dbm s ILE 31 Cb -0.16 -4.19 0.02 0.00 -1.06 0.00 0.00 42.46 37.08 2dbm s ILE 31 CO 0.05 0.09 -0.12 -0.63 -0.10 0.00 0.00 174.94 174.23 2dbm s ILE 32 N 1.67 2.56 0.70 2.92 1.09 0.76 -4.91 121.20 125.99 2dbm s ILE 32 Ca 0.43 -0.94 -0.17 0.00 -1.10 0.00 0.00 60.65 58.86 2dbm s ILE 32 Cb -0.18 -2.20 -0.07 0.00 -1.06 0.00 0.00 42.46 38.95 2dbm s ILE 32 CO 0.17 0.36 0.30 0.41 -0.10 0.00 0.00 174.94 176.09 2dbm n THR 33 N 4.65 1.34 -5.00 2.92 -1.04 -1.25 -2.90 114.28 113.00 2dbm n THR 33 Ca -0.18 -0.43 -0.32 0.00 -2.04 0.00 0.00 64.05 61.07 2dbm n THR 33 Cb 0.49 -0.55 -0.16 0.00 -1.82 0.00 0.00 70.33 68.29 2dbm n THR 33 CO 0.00 0.00 0.00 -0.76 -0.64 0.00 0.00 175.07 173.67 2dbm s LEU 34 N 1.43 2.27 0.05 -4.42 1.43 0.12 -3.78 118.68 115.79 2dbm s LEU 34 Ca 0.62 -0.50 0.00 0.00 -1.03 0.00 0.00 54.13 53.22 2dbm s LEU 34 Cb -0.36 -1.47 0.00 0.00 0.03 0.00 0.00 46.19 44.38 2dbm s LEU 34 CO 0.61 0.15 0.00 0.35 0.23 0.00 0.00 176.35 177.69 2dbm n THR 35 N 3.63 0.65 -3.94 5.49 -2.24 -0.69 -4.69 114.28 112.50 2dbm n THR 35 Ca -0.19 0.22 -0.10 0.00 -2.27 0.00 0.00 64.05 61.71 2dbm n THR 35 Cb 0.53 -1.54 -0.02 0.00 -2.10 0.00 0.00 70.33 67.19 2dbm n THR 35 CO 0.00 0.00 0.00 0.20 -0.57 0.00 0.00 175.07 174.70 2dbm s ASN 36 N -5.53 0.11 -0.02 3.42 0.01 -1.14 -5.04 114.94 106.76 2dbm s ASN 36 Ca 0.00 -1.04 0.06 0.00 -0.71 0.00 0.00 52.86 51.16 2dbm s ASN 36 Cb 0.00 0.70 -0.01 0.00 0.41 0.00 0.00 41.25 42.34 2dbm s ASN 36 CO 0.00 -1.35 -0.18 -1.58 -1.51 0.00 0.00 177.10 172.48 2dbm s GLN 37 N -3.36 1.48 -0.15 -0.60 0.74 -1.26 -0.36 119.66 116.15 2dbm s GLN 37 Ca 0.20 -0.65 -0.04 0.00 0.05 0.00 0.00 55.36 54.93 2dbm s GLN 37 Cb -0.03 -1.42 -0.08 0.00 1.10 0.00 0.00 33.01 32.58 2dbm s GLN 37 CO 0.12 0.38 -0.16 -0.89 -0.55 0.00 0.00 175.29 174.19 2dbm n ILE 38 N 2.66 0.81 -3.51 -2.34 -0.00 -1.22 -4.97 119.36 110.78 2dbm n ILE 38 Ca -0.15 -0.25 -0.23 0.00 -0.00 0.00 0.00 62.75 62.12 2dbm n ILE 38 Cb 0.54 -1.39 0.03 0.00 -0.00 0.00 0.00 39.64 38.81 2dbm n ILE 38 CO 0.00 0.00 0.00 -0.67 -0.00 0.00 0.00 176.55 175.88 2dbm n ASP 39 N -3.34 2.46 0.18 4.38 2.03 -1.16 -5.02 116.55 116.09 2dbm n ASP 39 Ca -0.27 -2.73 0.12 0.00 0.52 0.00 0.00 54.79 52.43 2dbm n ASP 39 Cb 0.73 -0.21 0.11 0.00 -0.72 0.00 0.00 41.12 41.03 2dbm n ASP 39 CO 0.00 0.00 0.00 -0.08 -1.92 0.00 0.00 177.20 175.20 2dbm h GLU 40 N 0.00 0.00 0.00 -0.67 4.57 -2.02 -3.33 114.58 113.13 2dbm h GLU 40 Ca -0.31 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 57.87 2dbm h GLU 40 Cb 1.26 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.85 2dbm h GLU 40 CO 0.47 0.00 -0.06 0.09 -1.18 0.00 0.00 179.01 178.33 2dbm n ASN 41 N -2.95 1.14 -4.05 1.04 5.03 -1.26 -5.01 115.26 109.21 2dbm n ASN 41 Ca 0.03 -1.83 -0.24 0.00 0.87 0.00 0.00 54.58 53.40 2dbm n ASN 41 Cb 0.54 -0.09 -0.16 0.00 -1.02 0.00 0.00 39.78 39.05 2dbm n ASN 41 CO 0.00 0.00 0.00 0.26 -1.83 0.00 0.00 177.26 175.69 2dbm s TRP 42 N -0.83 1.39 0.54 3.10 0.52 -1.25 -1.15 118.94 121.26 2dbm s TRP 42 Ca 0.05 -0.44 0.06 0.00 0.02 0.00 0.00 56.10 55.78 2dbm s TRP 42 Cb 0.04 -0.99 0.04 0.00 -1.15 0.00 0.00 33.47 31.41 2dbm s TRP 42 CO 0.00 -0.20 0.45 0.71 0.02 0.00 0.00 176.95 177.93 2dbm s TYR 43 N 0.39 1.64 -0.20 -1.98 2.02 0.17 -2.97 117.35 116.41 2dbm s TYR 43 Ca -0.09 -0.82 -0.02 0.00 -0.37 0.00 0.00 57.07 55.77 2dbm s TYR 43 Cb -0.13 -1.96 0.06 0.00 -0.40 0.00 0.00 41.96 39.54 2dbm s TYR 43 CO 0.02 -0.54 0.02 -2.00 -1.57 0.00 0.00 175.55 171.49 2dbm s GLU 44 N -4.32 0.81 0.17 -0.62 2.12 0.51 -2.53 118.70 114.85 2dbm s GLU 44 Ca 0.38 -0.52 0.04 0.00 0.36 0.00 0.00 54.97 55.23 2dbm s GLU 44 Cb -0.03 -2.19 -0.02 0.00 0.26 0.00 0.00 34.13 32.16 2dbm s GLU 44 CO 0.23 -0.64 0.15 0.41 -0.54 0.00 0.00 175.26 174.87 2dbm n GLY 45 N 4.99 3.45 3.21 -1.50 0.00 -1.20 -1.70 105.19 112.43 2dbm n GLY 45 Ca -0.09 -1.78 -0.31 0.00 0.00 0.00 0.00 46.02 43.84 2dbm n GLY 45 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2dbm s MET 46 N -2.70 2.70 -0.10 1.61 -1.94 -1.25 -3.12 119.30 114.50 2dbm s MET 46 Ca 0.21 -0.83 -0.03 0.00 -1.71 0.00 0.00 55.69 53.34 2dbm s MET 46 Cb 0.01 -2.13 0.04 0.00 2.01 0.00 0.00 34.83 34.76 2dbm s MET 46 CO 0.15 0.22 0.05 -1.17 -0.01 0.00 0.00 175.02 174.26 2dbm s LEU 47 N 0.21 0.45 -1.44 -0.03 2.96 0.34 -3.84 118.68 117.33 2dbm s LEU 47 Ca -0.13 -0.25 -0.11 0.00 -0.22 0.00 0.00 54.13 53.41 2dbm s LEU 47 Cb -0.16 -0.31 0.05 0.00 0.50 0.00 0.00 46.19 46.27 2dbm s LEU 47 CO 0.07 -0.27 1.07 1.41 -1.32 0.00 0.00 176.35 177.31 2dbm n HIS 48 N 5.22 -2.57 -1.41 5.38 8.25 -1.26 -1.00 115.22 127.84 2dbm n HIS 48 Ca -0.06 0.96 -0.07 0.00 -0.26 0.00 0.00 57.72 58.29 2dbm n HIS 48 Cb 0.49 -4.50 -0.03 0.00 1.12 0.00 0.00 29.99 27.07 2dbm n HIS 48 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2dbm n GLY 49 N -1.83 0.76 3.13 -1.41 0.00 -1.26 -5.01 105.19 99.57 2dbm n GLY 49 Ca 0.01 -0.68 -0.32 0.00 0.00 0.00 0.00 46.02 45.03 2dbm n GLY 49 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2dbm s HIS 50 N -2.30 2.63 -0.38 1.61 3.76 -0.17 -5.10 115.29 115.35 2dbm s HIS 50 Ca 0.00 -1.45 -0.10 0.00 -0.15 0.00 0.00 55.06 53.36 2dbm s HIS 50 Cb 0.00 -1.82 0.04 0.00 1.11 0.00 0.00 32.58 31.92 2dbm s HIS 50 CO 0.00 -0.70 0.21 0.45 -0.85 0.00 0.00 174.74 173.84 2dbm s SER 51 N 1.11 5.64 0.32 1.40 0.15 -1.26 -0.51 113.70 120.56 2dbm s SER 51 Ca -0.00 -1.17 -0.01 0.00 0.70 0.00 0.00 55.95 55.46 2dbm s SER 51 Cb -0.14 -1.99 0.01 0.00 -1.71 0.00 0.00 66.02 62.19 2dbm s SER 51 CO -0.08 -0.42 0.44 0.61 1.20 0.00 0.00 173.24 174.99 2dbm n GLY 52 N 4.95 2.21 3.69 9.45 0.00 -1.18 -5.01 105.19 119.28 2dbm n GLY 52 Ca -0.11 -1.60 -0.35 0.00 0.00 0.00 0.00 46.02 43.96 2dbm n GLY 52 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2dbm s PHE 53 N -3.10 3.29 0.10 1.61 0.08 -1.26 -3.25 117.98 115.45 2dbm s PHE 53 Ca 0.27 0.17 0.04 0.00 0.12 0.00 0.00 56.93 57.53 2dbm s PHE 53 Cb -0.01 -1.98 -0.04 0.00 -0.57 0.00 0.00 43.02 40.43 2dbm s PHE 53 CO 0.19 0.33 -0.11 -0.59 -0.10 0.00 0.00 175.22 174.94 2dbm s PHE 54 N -0.18 1.12 0.58 0.36 -0.71 -1.05 -3.54 117.98 114.55 2dbm s PHE 54 Ca 0.07 -0.62 -0.18 0.00 -1.04 0.00 0.00 56.93 55.16 2dbm s PHE 54 Cb -0.12 -0.61 -0.04 0.00 -1.21 0.00 0.00 43.02 41.04 2dbm s PHE 54 CO 0.01 0.03 1.12 -1.25 -1.34 0.00 0.00 175.22 173.79 2dbm s PRO 55 N -2.65 3.20 0.06 1.99 0.04 -1.26 -0.66 135.00 135.73 2dbm s PRO 55 Ca 0.05 1.54 0.22 0.00 0.04 0.00 0.00 61.00 62.85 2dbm s PRO 55 Cb -0.04 -1.99 -0.16 0.00 0.04 0.00 0.00 34.50 32.35 2dbm s PRO 55 CO 0.01 -0.96 0.77 -0.89 0.04 0.00 0.00 177.00 175.97 2dbm n ILE 56 N -1.62 0.22 1.15 0.56 5.41 -0.30 -4.02 119.36 120.76 2dbm n ILE 56 Ca 0.11 -0.45 0.08 0.00 1.00 0.00 0.00 62.75 63.50 2dbm n ILE 56 Cb 0.51 -0.02 0.50 0.00 -0.71 0.00 0.00 39.64 39.92 2dbm n ILE 56 CO 0.00 0.00 0.00 0.59 0.00 0.00 0.00 176.55 177.14 2dbm n ASN 57 N -2.30 0.00 -0.01 4.38 4.13 -1.26 -2.47 115.26 117.73 2dbm n ASN 57 Ca -0.01 -0.62 -0.00 0.00 1.68 0.00 0.00 54.58 55.62 2dbm n ASN 57 Cb 0.53 0.00 -0.02 0.00 -1.54 0.00 0.00 39.78 38.74 2dbm n ASN 57 CO 0.00 0.00 0.00 -1.22 0.28 0.00 0.00 177.26 176.32 2dbm n TYR 58 N -0.96 0.00 -4.62 3.10 4.01 -1.26 -5.00 117.16 112.43 2dbm n TYR 58 Ca 0.13 0.00 -0.33 0.00 -0.16 0.00 0.00 57.90 57.53 2dbm n TYR 58 Cb 0.06 -0.12 -0.13 0.00 -0.31 0.00 0.00 39.34 38.84 2dbm n TYR 58 CO 0.00 0.00 0.00 0.14 -0.46 0.00 0.00 176.86 176.54 2dbm s VAL 59 N -2.13 3.47 0.22 -0.72 -7.23 -1.03 0.12 120.40 113.09 2dbm s VAL 59 Ca -0.01 -0.52 -0.27 0.00 -1.81 0.00 0.00 61.98 59.36 2dbm s VAL 59 Cb 0.01 -2.47 -0.09 0.00 0.56 0.00 0.00 36.38 34.40 2dbm s VAL 59 CO 0.13 0.53 0.87 -0.70 -0.31 0.00 0.00 175.10 175.62 2dbm s GLU 60 N 0.13 4.70 -0.37 4.82 2.12 0.15 -4.79 118.70 125.47 2dbm s GLU 60 Ca -0.04 1.33 -0.17 0.00 0.36 0.00 0.00 54.97 56.45 2dbm s GLU 60 Cb -0.14 -3.20 0.00 0.00 0.26 0.00 0.00 34.13 31.05 2dbm s GLU 60 CO 0.04 0.50 0.43 0.42 -0.54 0.00 0.00 175.26 176.12 2dbm s ILE 61 N -1.24 5.09 -0.19 -3.70 -1.09 -1.26 -2.70 121.20 116.11 2dbm s ILE 61 Ca 0.40 0.02 -0.03 0.00 -2.23 0.00 0.00 60.65 58.82 2dbm s ILE 61 Cb -0.24 -3.93 -0.22 0.00 -1.58 0.00 0.00 42.46 36.49 2dbm s ILE 61 CO 0.28 -0.23 0.07 0.18 -1.23 0.00 0.00 174.94 174.01 2dbm n LEU 62 N 5.57 2.80 -4.13 2.97 4.77 -1.25 -4.84 117.00 122.90 2dbm n LEU 62 Ca -0.07 0.04 -0.34 0.00 -0.03 0.00 0.00 56.01 55.61 2dbm n LEU 62 Cb 0.49 -1.02 -0.14 0.00 -2.33 0.00 0.00 43.42 40.42 2dbm n LEU 62 CO 0.44 0.89 -0.39 -0.69 -1.33 0.00 0.00 177.39 176.31 2dbm s VAL 63 N -2.54 2.65 0.01 4.08 1.01 -1.25 -5.06 120.40 119.31 2dbm s VAL 63 Ca -0.29 -1.52 -0.30 0.00 0.00 0.00 0.00 61.98 59.87 2dbm s VAL 63 Cb 0.08 -2.55 -0.07 0.00 0.00 0.00 0.00 36.38 33.83 2dbm s VAL 63 CO 0.68 -0.10 1.75 0.00 0.00 0.00 0.00 175.10 177.44 2dbm s ALA 64 N 1.18 3.63 0.69 5.51 0.00 -1.26 -4.48 121.76 127.03 2dbm s ALA 64 Ca -0.06 1.15 -0.17 0.00 0.00 0.00 0.00 51.96 52.88 2dbm s ALA 64 Cb -0.20 -3.76 -0.07 0.00 0.00 0.00 0.00 23.12 19.09 2dbm s ALA 64 CO -0.03 -1.36 0.37 1.28 0.00 0.00 0.00 175.76 176.02 2dbm n LEU 65 N 6.77 -0.11 -4.72 0.00 4.77 -1.26 -4.88 117.00 117.57 2dbm n LEU 65 Ca 0.18 0.60 -0.42 0.00 -0.03 0.00 0.00 56.01 56.33 2dbm n LEU 65 Cb 0.41 -1.14 -0.03 0.00 -2.33 0.00 0.00 43.42 40.34 2dbm n LEU 65 CO 0.64 -3.47 1.03 -2.16 -1.33 0.00 0.00 177.39 172.10 2dbm s PRO 66 N -2.40 4.34 -0.11 3.23 0.04 -1.26 -4.96 135.00 133.87 2dbm s PRO 66 Ca 0.63 2.04 -0.29 0.00 0.04 0.00 0.00 61.00 63.42 2dbm s PRO 66 Cb -0.37 -3.25 -0.03 0.00 0.04 0.00 0.00 34.50 30.88 2dbm s PRO 66 CO 0.60 -0.40 1.48 -1.01 0.04 0.00 0.00 177.00 177.71 2dbm s HIS 67 N 1.00 2.37 -0.07 0.56 3.76 -1.26 -5.00 115.29 116.64 2dbm s HIS 67 Ca 0.63 0.57 0.05 0.00 -0.15 0.00 0.00 55.06 56.16 2dbm s HIS 67 Cb -0.36 -3.74 -0.00 0.00 1.11 0.00 0.00 32.58 29.59 2dbm s HIS 67 CO 0.31 -2.84 -0.22 0.45 -0.85 0.00 0.00 174.74 171.59 2dbm s SER 68 N 2.79 2.80 0.00 1.40 0.15 -1.26 -4.93 113.70 114.65 2dbm s SER 68 Ca 0.65 -0.49 0.00 0.00 0.70 0.00 0.00 55.95 56.81 2dbm s SER 68 Cb -0.28 -1.05 0.00 0.00 -1.71 0.00 0.00 66.02 62.98 2dbm s SER 68 CO 0.23 0.17 0.00 0.61 1.20 0.00 0.00 173.24 175.45 2dbm n GLY 69 N 3.32 0.66 3.57 9.45 0.00 -1.26 -4.98 105.19 115.94 2dbm n GLY 69 Ca -0.19 -0.65 -0.27 0.00 0.00 0.00 0.00 46.02 44.91 2dbm n GLY 69 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2dbm s PRO 70 N -0.80 2.53 -0.11 1.61 0.04 -1.26 -4.84 135.00 132.17 2dbm s PRO 70 Ca 0.00 -0.59 -0.30 0.00 0.04 0.00 0.00 61.00 60.15 2dbm s PRO 70 Cb 0.00 -5.12 0.12 0.00 0.04 0.00 0.00 34.50 29.54 2dbm s PRO 70 CO 0.00 -3.59 1.00 0.45 0.04 0.00 0.00 177.00 174.91 2dbm s SER 71 N 7.52 -0.32 0.32 6.66 0.15 -1.26 -5.18 113.70 121.59 2dbm s SER 71 Ca 0.70 0.16 0.05 0.00 0.70 0.00 0.00 55.95 57.56 2dbm s SER 71 Cb -0.05 0.30 -0.01 0.00 -1.71 0.00 0.00 66.02 64.55 2dbm s SER 71 CO 0.04 -0.42 0.46 -0.44 1.20 0.00 0.00 173.24 174.08 2dbm s SER 72 N -1.83 6.05 0.00 5.45 0.01 -1.26 -5.19 113.70 116.93 2dbm s SER 72 Ca 0.03 -0.07 0.00 0.00 1.31 0.00 0.00 55.95 57.23 2dbm s SER 72 Cb -0.01 -1.43 0.00 0.00 0.21 0.00 0.00 66.02 64.79 2dbm s SER 72 CO -0.04 -0.37 0.00 0.61 0.41 0.00 0.00 173.24 173.85