#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2dbm h SER 2 N 0.00 -0.50 -2.61 1.61 0.02 -2.14 -3.38 113.55 106.55 2dbm h SER 2 Ca 0.00 0.20 -0.54 0.00 -0.84 0.00 0.00 61.79 60.61 2dbm h SER 2 Cb 0.00 0.39 0.01 0.00 0.14 0.00 0.00 62.40 62.93 2dbm h SER 2 CO 0.00 -0.20 1.07 -0.44 -1.14 0.00 0.00 176.83 176.11 2dbm s SER 3 N -5.21 6.62 0.71 3.07 0.01 -1.26 -4.99 113.70 112.65 2dbm s SER 3 Ca -0.14 2.38 -0.08 0.00 1.31 0.00 0.00 55.95 59.41 2dbm s SER 3 Cb 0.21 -2.54 0.05 0.00 0.21 0.00 0.00 66.02 63.95 2dbm s SER 3 CO 0.75 -0.92 1.05 -0.83 0.41 0.00 0.00 173.24 173.69 2dbm s GLY 4 N 3.12 1.64 0.30 3.44 0.00 -1.26 -5.10 107.32 109.46 2dbm s GLY 4 Ca 0.75 -0.75 0.10 0.00 0.00 0.00 0.00 44.72 44.82 2dbm s GLY 4 CO 0.32 -0.35 -0.07 -1.35 0.00 0.00 0.00 173.10 171.65 2dbm s SER 5 N -4.48 4.07 0.46 1.64 1.04 -1.26 -5.15 113.70 110.01 2dbm s SER 5 Ca 0.59 -0.91 0.03 0.00 0.48 0.00 0.00 55.95 56.14 2dbm s SER 5 Cb -0.11 -0.54 -0.03 0.00 0.10 0.00 0.00 66.02 65.44 2dbm s SER 5 CO 0.47 -0.07 0.03 -0.55 0.98 0.00 0.00 173.24 174.10 2dbm s SER 6 N -3.63 3.73 0.00 7.02 0.15 -1.26 -5.11 113.70 114.60 2dbm s SER 6 Ca 0.32 -1.58 0.00 0.00 0.70 0.00 0.00 55.95 55.39 2dbm s SER 6 Cb -0.04 0.27 0.00 0.00 -1.71 0.00 0.00 66.02 64.55 2dbm s SER 6 CO 0.18 -0.76 0.00 0.61 1.20 0.00 0.00 173.24 174.47 2dbm n GLY 7 N -1.10 0.04 3.66 9.45 0.00 -1.26 -5.00 105.19 110.97 2dbm n GLY 7 Ca -0.13 -2.26 -0.43 0.00 0.00 0.00 0.00 46.02 43.21 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 0.00 4.16 0.06 1.61 0.04 -1.26 -4.94 135.00 134.67 2dbm s PRO 8 Ca 0.00 1.98 0.00 0.00 0.04 0.00 0.00 61.00 63.02 2dbm s PRO 8 Cb 0.00 -3.92 -0.04 0.00 0.04 0.00 0.00 34.50 30.58 2dbm s PRO 8 CO 0.00 -0.84 -0.05 0.00 0.04 0.00 0.00 177.00 176.15 2dbm s ARG 11 N -2.13 3.39 0.02 0.00 3.52 -1.07 -1.63 118.95 121.06 2dbm s ARG 11 Ca 0.01 -0.36 -0.30 0.00 -0.13 0.00 0.00 55.73 54.96 2dbm s ARG 11 Cb -0.08 -2.98 -0.04 0.00 -1.56 0.00 0.00 34.95 30.30 2dbm s ARG 11 CO 0.02 0.55 0.96 0.00 -0.81 0.00 0.00 175.30 176.02 2dbm s ALA 12 N -0.44 3.19 -0.10 6.12 0.00 -0.61 -0.24 121.76 129.67 2dbm s ALA 12 Ca 0.09 0.52 0.20 0.00 0.00 0.00 0.00 51.96 52.78 2dbm s ALA 12 Cb -0.12 -3.30 -0.29 0.00 0.00 0.00 0.00 23.12 19.41 2dbm s ALA 12 CO 0.02 -0.17 0.38 1.28 0.00 0.00 0.00 175.76 177.26 2dbm n LEU 13 N 3.63 0.07 0.00 0.00 4.77 -1.06 -0.71 117.00 123.70 2dbm n LEU 13 Ca 0.05 0.03 -0.18 0.00 -0.03 0.00 0.00 56.01 55.88 2dbm n LEU 13 Cb 0.51 0.17 -0.06 0.00 -2.33 0.00 0.00 43.42 41.71 2dbm n LEU 13 CO 0.51 0.17 -0.11 -1.22 -1.33 0.00 0.00 177.39 175.42 2dbm n TYR 14 N -2.48 -0.11 -3.73 -1.77 4.02 -1.26 -4.77 117.16 107.07 2dbm n TYR 14 Ca -0.14 -2.01 -0.38 0.00 -0.01 0.00 0.00 57.90 55.36 2dbm n TYR 14 Cb 0.79 0.06 -0.12 0.00 -0.02 0.00 0.00 39.34 40.05 2dbm n TYR 14 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 2dbm s ASP 15 N -2.84 5.36 -0.02 7.72 1.01 -1.26 -1.28 116.67 125.35 2dbm s ASP 15 Ca 0.20 -1.28 -0.27 0.00 0.71 0.00 0.00 52.55 51.91 2dbm s ASP 15 Cb 0.01 -1.88 -0.03 0.00 1.01 0.00 0.00 42.92 42.02 2dbm s ASP 15 CO 0.14 -0.38 0.85 0.12 0.21 0.00 0.00 175.17 176.11 2dbm s PHE 16 N 1.38 3.63 -0.44 4.23 5.36 -0.88 -5.00 117.98 126.26 2dbm s PHE 16 Ca -0.00 1.50 0.04 0.00 -0.96 0.00 0.00 56.93 57.51 2dbm s PHE 16 Cb -0.20 -2.97 0.12 0.00 -0.34 0.00 0.00 43.02 39.62 2dbm s PHE 16 CO 0.02 0.05 0.17 -2.00 -1.46 0.00 0.00 175.22 172.00 2dbm s GLU 17 N 0.85 1.78 0.61 10.12 2.12 -1.26 -3.95 118.70 128.97 2dbm s GLU 17 Ca 0.45 -2.29 -0.17 0.00 0.36 0.00 0.00 54.97 53.33 2dbm s GLU 17 Cb -0.20 -3.29 -0.03 0.00 0.26 0.00 0.00 34.13 30.88 2dbm s GLU 17 CO 0.24 -1.04 1.12 -1.25 -0.54 0.00 0.00 175.26 173.79 2dbm s PRO 18 N 0.26 3.04 -0.07 4.30 0.04 -1.26 -4.99 135.00 136.32 2dbm s PRO 18 Ca 0.14 1.49 0.06 0.00 0.04 0.00 0.00 61.00 62.73 2dbm s PRO 18 Cb -0.23 -1.97 -0.09 0.00 0.04 0.00 0.00 34.50 32.25 2dbm s PRO 18 CO -0.04 -1.08 0.02 -1.91 0.04 0.00 0.00 177.00 174.04 2dbm n GLU 19 N -1.94 2.76 -4.47 4.56 4.07 -1.26 -5.05 120.64 119.31 2dbm n GLU 19 Ca 0.11 -0.00 -0.27 0.00 -0.06 0.00 0.00 57.16 56.93 2dbm n GLU 19 Cb 0.52 -1.19 -0.10 0.00 -0.06 0.00 0.00 31.44 30.61 2dbm n GLU 19 CO 0.00 0.00 0.00 0.54 -0.06 0.00 0.00 177.13 177.61 2dbm s ASN 20 N -3.91 4.07 1.06 4.31 2.20 -1.26 -5.14 114.94 116.26 2dbm s ASN 20 Ca -0.04 -1.29 -0.14 0.00 -0.94 0.00 0.00 52.86 50.45 2dbm s ASN 20 Cb 0.02 -0.38 0.22 0.00 -2.00 0.00 0.00 41.25 39.11 2dbm s ASN 20 CO 0.30 -0.50 1.10 -1.61 -2.94 0.00 0.00 177.10 173.45 2dbm s GLU 21 N -3.78 -0.05 0.00 3.55 0.41 -1.26 -3.91 118.70 113.66 2dbm s GLU 21 Ca 0.36 0.32 0.00 0.00 -0.41 0.00 0.00 54.97 55.24 2dbm s GLU 21 Cb 0.08 -1.70 0.00 0.00 -1.78 0.00 0.00 34.13 30.73 2dbm s GLU 21 CO 0.19 -3.01 0.00 0.41 -0.49 0.00 0.00 175.26 172.36 2dbm n GLY 22 N -1.11 1.73 3.71 -1.39 0.00 -1.26 -4.95 105.19 101.92 2dbm n GLY 22 Ca 0.07 -0.13 -0.42 0.00 0.00 0.00 0.00 46.02 45.55 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 0.00 4.18 -0.33 1.61 2.02 -1.25 -3.09 118.70 121.83 2dbm s GLU 23 Ca 0.00 2.46 -0.21 0.00 0.02 0.00 0.00 54.97 57.24 2dbm s GLU 23 Cb 0.00 -3.25 -0.00 0.00 0.10 0.00 0.00 34.13 30.98 2dbm s GLU 23 CO 0.00 -0.70 0.65 -1.17 0.02 0.00 0.00 175.26 174.06 2dbm s LEU 24 N 1.57 4.20 -0.14 1.80 2.96 -0.35 -4.87 118.68 123.85 2dbm s LEU 24 Ca 0.73 0.29 -0.17 0.00 -0.22 0.00 0.00 54.13 54.76 2dbm s LEU 24 Cb -0.45 -2.82 -0.04 0.00 0.50 0.00 0.00 46.19 43.37 2dbm s LEU 24 CO 0.32 -0.56 0.43 -0.83 -1.32 0.00 0.00 176.35 174.39 2dbm s GLY 25 N 1.73 2.31 0.48 7.98 0.00 -1.26 -4.63 107.32 113.92 2dbm s GLY 25 Ca 0.25 -0.28 0.03 0.00 0.00 0.00 0.00 44.72 44.71 2dbm s GLY 25 CO 0.14 0.72 0.02 -0.11 0.00 0.00 0.00 173.10 173.86 2dbm s PHE 26 N 0.70 1.97 -0.02 1.90 -0.12 -1.25 -4.97 117.98 116.18 2dbm s PHE 26 Ca 0.23 -0.95 0.01 0.00 -0.05 0.00 0.00 56.93 56.18 2dbm s PHE 26 Cb -0.15 -1.58 0.01 0.00 -0.63 0.00 0.00 43.02 40.68 2dbm s PHE 26 CO 0.09 0.20 -0.03 0.15 -0.05 0.00 0.00 175.22 175.57 2dbm s LYS 27 N -3.83 0.45 0.04 1.99 1.02 -1.26 -2.07 119.74 116.08 2dbm s LYS 27 Ca 0.14 -0.09 -0.35 0.00 0.02 0.00 0.00 55.97 55.69 2dbm s LYS 27 Cb 0.03 -0.50 -0.18 0.00 -0.52 0.00 0.00 37.83 36.67 2dbm s LYS 27 CO 0.07 -0.00 0.88 -1.91 -0.92 0.00 0.00 175.35 173.47 2dbm n GLU 28 N 3.51 0.00 0.00 1.68 0.00 -0.40 -0.08 120.64 125.35 2dbm n GLU 28 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 57.16 56.96 2dbm n GLU 28 Cb 0.54 -1.29 0.00 0.00 0.00 0.00 0.00 31.44 30.70 2dbm n GLU 28 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2dbm n GLY 29 N 1.47 3.08 3.77 8.31 0.00 0.11 -4.94 105.19 116.99 2dbm n GLY 29 Ca 0.18 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.82 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 0.22 7.19 -0.26 1.61 1.11 0.89 -4.71 116.67 122.71 2dbm s ASP 30 Ca 0.00 1.97 -0.10 0.00 0.18 0.00 0.00 52.55 54.60 2dbm s ASP 30 Cb 0.00 -2.59 -0.05 0.00 1.07 0.00 0.00 42.92 41.35 2dbm s ASP 30 CO 0.00 -0.18 0.16 -0.63 1.18 0.00 0.00 175.17 175.69 2dbm s ILE 31 N -1.52 5.14 -0.36 0.77 -1.09 -1.26 -1.58 121.20 121.30 2dbm s ILE 31 Ca 0.51 0.11 -0.15 0.00 -2.23 0.00 0.00 60.65 58.88 2dbm s ILE 31 Cb -0.22 -3.42 -0.01 0.00 -1.58 0.00 0.00 42.46 37.23 2dbm s ILE 31 CO 0.28 0.30 0.34 -0.63 -1.23 0.00 0.00 174.94 174.01 2dbm s ILE 32 N 1.48 5.19 0.82 2.92 1.09 -0.65 -4.91 121.20 127.14 2dbm s ILE 32 Ca 0.07 -0.13 -0.14 0.00 -1.10 0.00 0.00 60.65 59.35 2dbm s ILE 32 Cb -0.15 -3.84 0.04 0.00 -1.06 0.00 0.00 42.46 37.45 2dbm s ILE 32 CO 0.08 -0.14 0.82 0.41 -0.10 0.00 0.00 174.94 176.01 2dbm n THR 33 N 5.23 1.41 -5.22 2.92 -1.04 -1.26 -3.05 114.28 113.28 2dbm n THR 33 Ca -0.10 -0.25 -0.31 0.00 -2.04 0.00 0.00 64.05 61.36 2dbm n THR 33 Cb 0.49 -0.93 -0.16 0.00 -1.82 0.00 0.00 70.33 67.91 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 -3.08 2.05 0.09 -4.42 1.43 -0.99 -3.95 118.68 109.82 2dbm s LEU 34 Ca 0.67 -0.48 0.00 0.00 -1.03 0.00 0.00 54.13 53.29 2dbm s LEU 34 Cb -0.29 -1.31 0.00 0.00 0.03 0.00 0.00 46.19 44.62 2dbm s LEU 34 CO 0.57 0.25 0.00 0.35 0.23 0.00 0.00 176.35 177.75 2dbm n THR 35 N 2.88 0.27 -3.98 5.49 -2.24 0.24 -4.78 114.28 112.16 2dbm n THR 35 Ca -0.17 0.09 -0.11 0.00 -2.27 0.00 0.00 64.05 61.59 2dbm n THR 35 Cb 0.52 -1.00 -0.03 0.00 -2.10 0.00 0.00 70.33 67.72 2dbm n THR 35 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 2dbm s ASN 36 N -5.21 0.21 -0.06 3.42 3.84 -0.97 -5.00 114.94 111.15 2dbm s ASN 36 Ca 0.00 -1.11 0.03 0.00 0.21 0.00 0.00 52.86 51.99 2dbm s ASN 36 Cb 0.00 0.67 0.01 0.00 -0.55 0.00 0.00 41.25 41.38 2dbm s ASN 36 CO 0.00 -1.30 -0.13 -1.58 -2.79 0.00 0.00 177.10 171.30 2dbm s GLN 37 N -3.43 1.79 -0.25 0.43 0.74 -1.26 0.11 119.66 117.78 2dbm s GLN 37 Ca 0.23 -0.46 -0.06 0.00 0.05 0.00 0.00 55.36 55.12 2dbm s GLN 37 Cb -0.02 -1.47 -0.13 0.00 1.10 0.00 0.00 33.01 32.49 2dbm s GLN 37 CO 0.13 0.06 -0.28 -0.89 -0.55 0.00 0.00 175.29 173.76 2dbm n ILE 38 N 3.72 1.41 -3.40 -2.34 -0.00 -1.24 -4.99 119.36 112.53 2dbm n ILE 38 Ca -0.22 -0.45 -0.15 0.00 -0.00 0.00 0.00 62.75 61.93 2dbm n ILE 38 Cb 0.52 -1.61 0.02 0.00 -0.00 0.00 0.00 39.64 38.57 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 -3.70 1.79 0.12 4.38 2.03 -1.23 -5.03 116.55 114.92 2dbm n ASP 39 Ca -0.47 -2.14 0.12 0.00 0.52 0.00 0.00 54.79 52.81 2dbm n ASP 39 Cb 0.91 -0.15 0.10 0.00 -0.72 0.00 0.00 41.12 41.26 2dbm n ASP 39 CO 0.00 0.00 0.00 -0.33 -1.92 0.00 0.00 177.20 174.95 2dbm h GLU 40 N 0.00 0.00 0.00 -0.67 3.07 -2.02 -3.34 114.58 111.61 2dbm h GLU 40 Ca -0.21 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.65 2dbm h GLU 40 Cb 0.84 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.75 2dbm h GLU 40 CO 0.31 0.00 -0.09 0.09 -1.40 0.00 0.00 179.01 177.92 2dbm n ASN 41 N -2.58 1.20 -4.11 1.42 5.03 -1.26 -5.04 115.26 109.93 2dbm n ASN 41 Ca 0.02 -1.98 -0.23 0.00 0.87 0.00 0.00 54.58 53.26 2dbm n ASN 41 Cb 0.51 -0.13 -0.15 0.00 -1.02 0.00 0.00 39.78 38.98 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 -0.98 1.34 0.56 3.10 0.52 -1.26 -1.37 118.94 120.86 2dbm s TRP 42 Ca 0.07 -0.29 0.05 0.00 0.02 0.00 0.00 56.10 55.95 2dbm s TRP 42 Cb 0.06 -0.88 0.05 0.00 -1.15 0.00 0.00 33.47 31.55 2dbm s TRP 42 CO 0.01 -0.06 0.41 0.66 0.02 0.00 0.00 176.95 177.98 2dbm n TYR 43 N 2.87 -0.49 -3.83 -1.98 4.01 0.01 -3.48 117.16 114.27 2dbm n TYR 43 Ca -0.15 -2.40 -0.22 0.00 -0.16 0.00 0.00 57.90 54.97 2dbm n TYR 43 Cb 0.54 -0.46 -0.17 0.00 -0.31 0.00 0.00 39.34 38.95 2dbm n TYR 43 CO 0.00 0.00 0.00 -2.00 -0.46 0.00 0.00 176.86 174.40 2dbm s GLU 44 N -4.30 0.54 0.21 -0.72 2.12 0.30 -2.56 118.70 114.28 2dbm s GLU 44 Ca 0.31 0.10 -0.06 0.00 0.36 0.00 0.00 54.97 55.68 2dbm s GLU 44 Cb -0.02 -0.85 0.02 0.00 0.26 0.00 0.00 34.13 33.54 2dbm s GLU 44 CO 0.20 -0.26 0.39 0.41 -0.54 0.00 0.00 175.26 175.46 2dbm n GLY 45 N 4.90 1.79 3.47 -1.50 0.00 -1.20 0.82 105.19 113.47 2dbm n GLY 45 Ca -0.11 -1.26 -0.35 0.00 0.00 0.00 0.00 46.02 44.30 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 -2.18 3.66 -0.16 1.61 -1.94 -1.26 -2.82 119.30 116.21 2dbm s MET 46 Ca 0.11 -0.50 -0.11 0.00 -1.71 0.00 0.00 55.69 53.48 2dbm s MET 46 Cb -0.02 -3.08 0.05 0.00 2.01 0.00 0.00 34.83 33.80 2dbm s MET 46 CO 0.08 0.06 0.41 -1.17 -0.01 0.00 0.00 175.02 174.39 2dbm s LEU 47 N 0.88 0.08 -1.32 -0.03 2.96 -0.60 -4.16 118.68 116.48 2dbm s LEU 47 Ca 0.01 0.87 -0.04 0.00 -0.22 0.00 0.00 54.13 54.75 2dbm s LEU 47 Cb -0.14 1.36 0.00 0.00 0.50 0.00 0.00 46.19 47.91 2dbm s LEU 47 CO 0.02 -0.18 0.54 1.41 -1.32 0.00 0.00 176.35 176.82 2dbm n HIS 48 N 3.81 -1.70 -1.68 5.38 8.25 -1.26 -1.74 115.22 126.28 2dbm n HIS 48 Ca -0.20 0.46 -0.18 0.00 -0.26 0.00 0.00 57.72 57.54 2dbm n HIS 48 Cb 0.56 -4.01 -0.06 0.00 1.12 0.00 0.00 29.99 27.60 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 -1.43 1.32 2.95 -1.41 0.00 -1.26 -4.97 105.19 100.39 2dbm n GLY 49 Ca -0.09 -0.17 -0.13 0.00 0.00 0.00 0.00 46.02 45.62 2dbm n GLY 49 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2dbm s HIS 50 N -2.70 -0.14 -0.36 1.61 5.65 -0.71 -5.13 115.29 113.51 2dbm s HIS 50 Ca 0.00 0.39 -0.20 0.00 0.25 0.00 0.00 55.06 55.50 2dbm s HIS 50 Cb 0.00 -0.03 0.00 0.00 -1.18 0.00 0.00 32.58 31.37 2dbm s HIS 50 CO 0.00 -0.11 0.59 0.45 -0.65 0.00 0.00 174.74 175.02 2dbm s SER 51 N 0.65 6.38 0.28 9.88 0.15 -1.26 -1.56 113.70 128.21 2dbm s SER 51 Ca -0.05 0.05 0.00 0.00 0.70 0.00 0.00 55.95 56.66 2dbm s SER 51 Cb -0.07 -2.31 -0.02 0.00 -1.71 0.00 0.00 66.02 61.91 2dbm s SER 51 CO -0.03 -0.56 0.28 -0.83 1.20 0.00 0.00 173.24 173.30 2dbm s GLY 52 N 1.79 1.67 -0.02 9.45 0.00 -1.13 -5.00 107.32 114.09 2dbm s GLY 52 Ca 0.22 -1.71 -0.13 0.00 0.00 0.00 0.00 44.72 43.10 2dbm s GLY 52 CO 0.14 -1.27 0.35 -1.36 0.00 0.00 0.00 173.10 170.97 2dbm s PHE 53 N -3.68 3.70 0.09 1.90 0.08 -1.18 -3.22 117.98 115.67 2dbm s PHE 53 Ca 0.36 0.89 0.05 0.00 0.12 0.00 0.00 56.93 58.35 2dbm s PHE 53 Cb 0.03 -2.21 -0.03 0.00 -0.57 0.00 0.00 43.02 40.24 2dbm s PHE 53 CO 0.19 0.66 -0.13 -0.59 -0.10 0.00 0.00 175.22 175.26 2dbm s PHE 54 N -1.08 1.19 0.38 0.36 -0.71 -1.06 -1.21 117.98 115.85 2dbm s PHE 54 Ca 0.22 -0.55 -0.26 0.00 -1.04 0.00 0.00 56.93 55.30 2dbm s PHE 54 Cb -0.16 -0.65 -0.09 0.00 -1.21 0.00 0.00 43.02 40.91 2dbm s PHE 54 CO 0.12 0.06 1.20 -1.25 -1.34 0.00 0.00 175.22 174.00 2dbm s PRO 55 N -2.33 4.16 0.05 1.99 0.04 -1.26 -0.81 135.00 136.84 2dbm s PRO 55 Ca 0.03 1.93 0.23 0.00 0.04 0.00 0.00 61.00 63.23 2dbm s PRO 55 Cb -0.06 -2.81 0.06 0.00 0.04 0.00 0.00 34.50 31.72 2dbm s PRO 55 CO 0.02 -0.26 1.03 -0.89 0.04 0.00 0.00 177.00 176.95 2dbm n ILE 56 N 0.33 0.17 1.69 0.56 5.41 -0.47 -3.92 119.36 123.12 2dbm n ILE 56 Ca 0.03 -0.24 0.05 0.00 1.00 0.00 0.00 62.75 63.59 2dbm n ILE 56 Cb 0.45 0.21 0.25 0.00 -0.71 0.00 0.00 39.64 39.84 2dbm n ILE 56 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 176.55 176.09 2dbm n ASN 57 N -1.96 0.58 -0.34 4.38 0.23 -1.26 -3.21 115.26 113.67 2dbm n ASN 57 Ca 0.02 -1.78 0.04 0.00 -0.53 0.00 0.00 54.58 52.33 2dbm n ASN 57 Cb 0.43 -0.06 0.06 0.00 -2.08 0.00 0.00 39.78 38.14 2dbm n ASN 57 CO 0.00 0.00 0.00 -1.22 -0.93 0.00 0.00 177.26 175.11 2dbm n TYR 58 N -0.28 0.00 -3.74 -2.53 4.01 -1.25 -5.05 117.16 108.31 2dbm n TYR 58 Ca 0.09 -0.45 -0.13 0.00 -0.16 0.00 0.00 57.90 57.24 2dbm n TYR 58 Cb 0.12 -0.10 -0.10 0.00 -0.31 0.00 0.00 39.34 38.95 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 -1.26 0.01 0.35 -0.72 -7.23 -1.20 -2.58 120.40 107.78 2dbm s VAL 59 Ca 0.15 -0.06 -0.24 0.00 -1.81 0.00 0.00 61.98 60.02 2dbm s VAL 59 Cb 0.13 -0.57 -0.10 0.00 0.56 0.00 0.00 36.38 36.41 2dbm s VAL 59 CO 0.01 -0.03 0.93 -1.61 -0.31 0.00 0.00 175.10 174.09 2dbm s GLU 60 N -0.02 4.45 -0.59 4.82 0.41 0.66 -4.86 118.70 123.57 2dbm s GLU 60 Ca -0.02 1.23 -0.08 0.00 -0.41 0.00 0.00 54.97 55.69 2dbm s GLU 60 Cb -0.03 -2.60 0.15 0.00 -1.78 0.00 0.00 34.13 29.87 2dbm s GLU 60 CO 0.01 0.18 0.45 0.42 -0.49 0.00 0.00 175.26 175.84 2dbm s ILE 61 N -1.80 4.28 -0.02 -1.63 -1.09 -1.26 -2.59 121.20 117.09 2dbm s ILE 61 Ca 0.54 -2.32 -0.15 0.00 -2.23 0.00 0.00 60.65 56.49 2dbm s ILE 61 Cb -0.15 -3.77 -0.33 0.00 -1.58 0.00 0.00 42.46 36.63 2dbm s ILE 61 CO 0.20 -0.86 0.82 -0.07 -1.23 0.00 0.00 174.94 173.81 2dbm h LEU 62 N 7.84 0.69 -8.27 2.97 3.38 -1.96 -3.45 115.31 116.51 2dbm h LEU 62 Ca -0.08 -0.93 -0.67 0.00 0.09 0.00 0.00 57.88 56.30 2dbm h LEU 62 Cb 1.03 -0.23 -0.32 0.00 0.09 0.00 0.00 40.66 41.23 2dbm h LEU 62 CO 0.78 1.71 -0.81 -0.69 0.09 0.00 0.00 178.44 179.52 2dbm s VAL 63 N -2.57 2.55 -0.05 1.22 1.01 -1.25 -5.05 120.40 116.27 2dbm s VAL 63 Ca -0.13 -0.79 -0.30 0.00 0.00 0.00 0.00 61.98 60.76 2dbm s VAL 63 Cb 0.04 -2.09 -0.02 0.00 0.00 0.00 0.00 36.38 34.31 2dbm s VAL 63 CO 0.89 0.51 1.04 0.00 0.00 0.00 0.00 175.10 177.54 2dbm s ALA 64 N 1.07 3.33 0.86 5.51 0.00 -1.26 -4.50 121.76 126.76 2dbm s ALA 64 Ca -0.01 0.51 -0.15 0.00 0.00 0.00 0.00 51.96 52.31 2dbm s ALA 64 Cb -0.14 -3.41 -0.03 0.00 0.00 0.00 0.00 23.12 19.53 2dbm s ALA 64 CO -0.05 -0.48 0.19 1.28 0.00 0.00 0.00 175.76 176.70 2dbm n LEU 65 N 4.55 -1.16 -4.77 0.00 4.77 -1.26 -4.94 117.00 114.20 2dbm n LEU 65 Ca 0.08 0.41 -0.32 0.00 -0.03 0.00 0.00 56.01 56.15 2dbm n LEU 65 Cb 0.49 -1.11 0.07 0.00 -2.33 0.00 0.00 43.42 40.55 2dbm n LEU 65 CO 0.53 -3.98 0.72 -2.16 -1.33 0.00 0.00 177.39 171.16 2dbm s PRO 66 N -2.89 2.48 0.14 3.23 0.04 -1.26 -4.91 135.00 131.82 2dbm s PRO 66 Ca 0.56 1.26 -0.32 0.00 0.04 0.00 0.00 61.00 62.55 2dbm s PRO 66 Cb -0.27 -1.92 -0.18 0.00 0.04 0.00 0.00 34.50 32.18 2dbm s PRO 66 CO 0.67 -1.48 0.75 0.72 0.04 0.00 0.00 177.00 177.70 2dbm n HIS 67 N -3.06 0.04 -0.62 0.56 8.25 -1.26 -4.87 115.22 114.26 2dbm n HIS 67 Ca 0.10 0.97 -0.24 0.00 -0.26 0.00 0.00 57.72 58.29 2dbm n HIS 67 Cb 0.53 -2.03 0.14 0.00 1.12 0.00 0.00 29.99 29.74 2dbm n HIS 67 CO 0.00 0.00 0.00 0.43 0.64 0.00 0.00 176.34 177.41 2dbm n SER 68 N 1.82 -2.80 -3.79 0.41 7.64 -1.26 -5.04 113.62 110.60 2dbm n SER 68 Ca 0.18 -0.27 -0.13 0.00 1.01 0.00 0.00 58.87 59.66 2dbm n SER 68 Cb 0.20 -0.79 -0.09 0.00 -1.01 0.00 0.00 64.21 62.52 2dbm n SER 68 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2dbm s GLY 69 N -1.82 -0.11 0.06 0.23 0.00 -1.26 -5.02 107.32 99.39 2dbm s GLY 69 Ca 0.41 0.31 0.16 0.00 0.00 0.00 0.00 44.72 45.60 2dbm s GLY 69 CO 0.45 0.14 1.51 -1.55 0.00 0.00 0.00 173.10 173.65 2dbm n PRO 70 N 1.66 0.05 -0.29 2.90 -0.04 -1.26 -3.90 135.00 134.12 2dbm n PRO 70 Ca -0.20 0.30 -0.03 0.00 -0.04 0.00 0.00 63.50 63.53 2dbm n PRO 70 Cb 0.56 -1.59 0.00 0.00 -0.04 0.00 0.00 33.50 32.44 2dbm n PRO 70 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 2dbm n SER 71 N -1.67 -0.55 -3.96 3.54 3.41 -1.26 -4.44 113.62 108.69 2dbm n SER 71 Ca 0.03 1.27 -0.12 0.00 -0.26 0.00 0.00 58.87 59.79 2dbm n SER 71 Cb 0.18 -0.26 -0.13 0.00 -0.26 0.00 0.00 64.21 63.75 2dbm n SER 71 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2dbm s SER 72 N -5.29 0.36 0.00 4.04 1.04 -1.25 -5.34 113.70 107.26 2dbm s SER 72 Ca -0.10 -0.29 0.00 0.00 0.48 0.00 0.00 55.95 56.04 2dbm s SER 72 Cb 0.13 0.03 0.00 0.00 0.10 0.00 0.00 66.02 66.28 2dbm s SER 72 CO 0.50 -0.13 0.03 0.61 0.98 0.00 0.00 173.24 175.24