#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 6.09 0.37 1.61 0.15 -1.26 -5.00 113.70 115.67 2dbm s SER 2 Ca 0.00 0.07 -0.20 0.00 0.70 0.00 0.00 55.95 56.52 2dbm s SER 2 Cb 0.00 -2.55 -0.10 0.00 -1.71 0.00 0.00 66.02 61.66 2dbm s SER 2 CO 0.00 -1.78 0.88 -0.44 1.20 0.00 0.00 173.24 173.10 2dbm s SER 3 N 4.43 6.97 0.00 5.45 0.01 -1.26 -4.79 113.70 124.50 2dbm s SER 3 Ca 0.48 1.59 0.00 0.00 1.31 0.00 0.00 55.95 59.33 2dbm s SER 3 Cb -0.10 -2.50 0.00 0.00 0.21 0.00 0.00 66.02 63.64 2dbm s SER 3 CO 0.22 -0.25 0.00 0.61 0.41 0.00 0.00 173.24 174.23 2dbm n GLY 4 N -0.28 0.62 3.38 3.44 0.00 -1.26 -4.97 105.19 106.12 2dbm n GLY 4 Ca 0.05 -0.73 -0.39 0.00 0.00 0.00 0.00 46.02 44.95 2dbm n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2dbm s SER 5 N -0.43 5.59 -0.30 1.61 0.01 -1.26 -5.03 113.70 113.90 2dbm s SER 5 Ca 0.00 -0.87 -0.02 0.00 1.31 0.00 0.00 55.95 56.38 2dbm s SER 5 Cb 0.00 -1.99 0.19 0.00 0.21 0.00 0.00 66.02 64.43 2dbm s SER 5 CO 0.00 -0.31 0.61 -0.44 0.41 0.00 0.00 173.24 173.51 2dbm s SER 6 N 1.55 -1.35 0.56 2.44 0.01 -1.26 -5.14 113.70 110.51 2dbm s SER 6 Ca 0.02 0.90 0.00 0.00 1.31 0.00 0.00 55.95 58.18 2dbm s SER 6 Cb -0.18 2.16 0.00 0.00 0.21 0.00 0.00 66.02 68.20 2dbm s SER 6 CO 0.06 -0.25 0.00 0.61 0.41 0.00 0.00 173.24 174.06 2dbm n GLY 7 N 5.43 0.78 3.68 3.44 0.00 -1.26 -4.52 105.19 112.74 2dbm n GLY 7 Ca -0.02 -0.82 -0.42 0.00 0.00 0.00 0.00 46.02 44.76 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 4.26 0.09 1.61 0.04 -1.26 -5.00 135.00 134.74 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 -3.64 -0.04 0.00 0.04 0.00 0.00 34.50 30.86 2dbm s PRO 8 CO 0.00 -0.64 0.04 0.00 0.04 0.00 0.00 177.00 176.44 2dbm s ARG 11 N -2.17 3.47 -0.29 0.00 3.52 -0.15 -0.53 118.95 122.81 2dbm s ARG 11 Ca -0.01 -0.48 -0.10 0.00 -0.13 0.00 0.00 55.73 55.02 2dbm s ARG 11 Cb -0.07 -2.74 -0.03 0.00 -1.56 0.00 0.00 34.95 30.55 2dbm s ARG 11 CO 0.01 0.24 0.16 0.00 -0.81 0.00 0.00 175.30 174.90 2dbm s ALA 12 N -2.20 3.38 -0.26 6.12 0.00 -1.14 0.03 121.76 127.69 2dbm s ALA 12 Ca 0.38 -1.21 0.22 0.00 0.00 0.00 0.00 51.96 51.35 2dbm s ALA 12 Cb -0.09 -2.39 0.05 0.00 0.00 0.00 0.00 23.12 20.69 2dbm s ALA 12 CO 0.34 -0.68 1.14 -0.07 0.00 0.00 0.00 175.76 176.49 2dbm h LEU 13 N 8.35 0.00 0.00 0.00 3.38 -1.78 0.14 115.31 125.41 2dbm h LEU 13 Ca -0.35 0.00 -0.33 0.00 0.09 0.00 0.00 57.88 57.30 2dbm h LEU 13 Cb 1.17 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 41.84 2dbm h LEU 13 CO 0.58 0.06 -0.21 -1.22 0.09 0.00 0.00 178.44 177.75 2dbm n TYR 14 N -2.79 -1.37 -3.49 1.13 4.02 -1.23 -4.88 117.16 108.55 2dbm n TYR 14 Ca -0.00 -2.51 -0.42 0.00 -0.01 0.00 0.00 57.90 54.95 2dbm n TYR 14 Cb 0.58 0.52 -0.09 0.00 -0.02 0.00 0.00 39.34 40.33 2dbm n TYR 14 CO 0.00 0.00 0.00 0.16 -1.01 0.00 0.00 176.86 176.01 2dbm s ASP 15 N -3.27 5.90 -0.16 7.72 -4.77 -1.26 -2.71 116.67 118.12 2dbm s ASP 15 Ca 0.32 -1.46 -0.11 0.00 -3.30 0.00 0.00 52.55 48.00 2dbm s ASP 15 Cb -0.00 -2.09 -0.05 0.00 -1.09 0.00 0.00 42.92 39.69 2dbm s ASP 15 CO 0.23 -0.61 0.21 0.12 0.70 0.00 0.00 175.17 175.81 2dbm s PHE 16 N 1.53 3.49 -0.10 2.11 5.36 -1.13 -5.00 117.98 124.23 2dbm s PHE 16 Ca 0.04 0.51 0.01 0.00 -0.96 0.00 0.00 56.93 56.52 2dbm s PHE 16 Cb -0.24 -2.19 -0.02 0.00 -0.34 0.00 0.00 43.02 40.23 2dbm s PHE 16 CO 0.04 0.39 -0.12 -1.21 -1.46 0.00 0.00 175.22 172.86 2dbm s GLU 17 N 0.01 3.06 -0.19 10.12 8.01 -1.26 -2.93 118.70 135.53 2dbm s GLU 17 Ca 0.13 -0.66 -0.29 0.00 0.01 0.00 0.00 54.97 54.16 2dbm s GLU 17 Cb -0.12 -2.56 -0.03 0.00 -4.31 0.00 0.00 34.13 27.10 2dbm s GLU 17 CO 0.02 0.39 1.58 -1.25 0.01 0.00 0.00 175.26 176.02 2dbm s PRO 18 N -0.11 3.91 -0.06 0.39 0.04 -1.26 -4.89 135.00 133.02 2dbm s PRO 18 Ca -0.01 1.75 0.05 0.00 0.04 0.00 0.00 61.00 62.82 2dbm s PRO 18 Cb -0.14 -4.00 -0.25 0.00 0.04 0.00 0.00 34.50 30.16 2dbm s PRO 18 CO 0.03 -1.15 0.61 0.93 0.04 0.00 0.00 177.00 177.46 2dbm h GLU 19 N 10.24 0.11 -5.41 4.56 4.39 -1.98 -3.48 114.58 123.01 2dbm h GLU 19 Ca -0.34 -0.19 -0.51 0.00 0.34 0.00 0.00 59.36 58.66 2dbm h GLU 19 Cb 1.15 0.07 -0.14 0.00 -0.10 0.00 0.00 28.75 29.74 2dbm h GLU 19 CO 0.99 0.80 -0.63 0.54 -1.16 0.00 0.00 179.01 179.55 2dbm s ASN 20 N -6.51 2.80 1.29 1.42 2.20 -1.26 -5.14 114.94 109.73 2dbm s ASN 20 Ca -0.11 -1.31 -0.18 0.00 -0.94 0.00 0.00 52.86 50.33 2dbm s ASN 20 Cb 0.07 -0.17 0.30 0.00 -2.00 0.00 0.00 41.25 39.45 2dbm s ASN 20 CO 0.81 -0.48 0.77 -0.62 -2.94 0.00 0.00 177.10 174.64 2dbm n GLU 21 N -0.70 -3.38 -3.86 3.55 4.71 -1.26 -3.89 120.64 115.81 2dbm n GLU 21 Ca -0.04 -0.98 -0.24 0.00 -0.01 0.00 0.00 57.16 55.88 2dbm n GLU 21 Cb 0.65 -1.95 -0.00 0.00 -1.01 0.00 0.00 31.44 29.14 2dbm n GLU 21 CO 0.00 0.00 0.00 0.41 0.09 0.00 0.00 177.13 177.63 2dbm n GLY 22 N 1.64 -0.29 2.96 0.62 0.00 -1.26 -4.98 105.19 103.89 2dbm n GLY 22 Ca 0.07 0.16 -0.14 0.00 0.00 0.00 0.00 46.02 46.11 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 -6.35 0.13 -0.45 1.61 2.02 -1.25 -3.56 118.70 110.84 2dbm s GLU 23 Ca 0.03 0.48 -0.15 0.00 0.02 0.00 0.00 54.97 55.34 2dbm s GLU 23 Cb -0.01 -0.16 0.06 0.00 0.10 0.00 0.00 34.13 34.11 2dbm s GLU 23 CO 0.86 -0.19 0.37 -1.17 0.02 0.00 0.00 175.26 175.15 2dbm s LEU 24 N 1.44 5.45 0.27 1.80 2.96 -0.64 -4.63 118.68 125.33 2dbm s LEU 24 Ca -0.07 -1.18 -0.29 0.00 -0.22 0.00 0.00 54.13 52.37 2dbm s LEU 24 Cb -0.11 -2.18 -0.09 0.00 0.50 0.00 0.00 46.19 44.31 2dbm s LEU 24 CO -0.07 -0.58 0.97 -0.83 -1.32 0.00 0.00 176.35 174.52 2dbm s GLY 25 N 2.30 3.05 0.41 7.98 0.00 -1.26 -4.30 107.32 115.50 2dbm s GLY 25 Ca 0.04 0.66 0.04 0.00 0.00 0.00 0.00 44.72 45.46 2dbm s GLY 25 CO 0.08 1.21 0.05 -0.11 0.00 0.00 0.00 173.10 174.32 2dbm s PHE 26 N -1.26 2.04 0.03 1.90 -0.12 -1.15 -5.02 117.98 114.39 2dbm s PHE 26 Ca 0.44 -0.96 0.04 0.00 -0.05 0.00 0.00 56.93 56.40 2dbm s PHE 26 Cb -0.26 -1.47 -0.02 0.00 -0.63 0.00 0.00 43.02 40.65 2dbm s PHE 26 CO 0.32 0.11 -0.12 0.21 -0.05 0.00 0.00 175.22 175.69 2dbm s LYS 27 N -3.80 0.81 -0.13 1.99 2.20 -1.26 -2.83 119.74 116.72 2dbm s LYS 27 Ca 0.25 -0.65 -0.40 0.00 -0.36 0.00 0.00 55.97 54.81 2dbm s LYS 27 Cb 0.06 -0.78 -0.18 0.00 -1.51 0.00 0.00 37.83 35.42 2dbm s LYS 27 CO 0.13 0.19 1.40 -1.91 -0.36 0.00 0.00 175.35 174.80 2dbm n GLU 28 N 2.07 0.61 0.00 4.03 2.13 -1.10 -0.12 120.64 128.26 2dbm n GLU 28 Ca -0.18 0.22 0.00 0.00 0.66 0.00 0.00 57.16 57.86 2dbm n GLU 28 Cb 0.55 -1.80 0.00 0.00 0.27 0.00 0.00 31.44 30.46 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 2.87 2.47 3.69 8.31 0.00 0.50 -4.93 105.19 118.10 2dbm n GLY 29 Ca 0.23 -0.60 -0.44 0.00 0.00 0.00 0.00 46.02 45.20 2dbm n GLY 29 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 2dbm n ASP 30 N 1.40 3.55 -4.68 1.61 9.92 0.83 -4.39 116.55 124.77 2dbm n ASP 30 Ca 0.00 1.05 -0.40 0.00 -0.53 0.00 0.00 54.79 54.91 2dbm n ASP 30 Cb 0.00 -1.48 -0.05 0.00 -0.64 0.00 0.00 41.12 38.95 2dbm n ASP 30 CO 0.00 0.00 0.00 -0.63 0.13 0.00 0.00 177.20 176.70 2dbm s ILE 31 N 1.57 4.97 -0.33 0.53 -1.09 -1.26 -2.88 121.20 122.71 2dbm s ILE 31 Ca 0.79 1.46 -0.13 0.00 -2.23 0.00 0.00 60.65 60.54 2dbm s ILE 31 Cb -0.60 -4.06 -0.02 0.00 -1.58 0.00 0.00 42.46 36.21 2dbm s ILE 31 CO 0.37 0.13 0.26 -0.63 -1.23 0.00 0.00 174.94 173.84 2dbm s ILE 32 N 1.61 5.26 1.01 2.92 1.09 0.31 -4.92 121.20 128.48 2dbm s ILE 32 Ca 0.36 -0.10 -0.11 0.00 -1.10 0.00 0.00 60.65 59.69 2dbm s ILE 32 Cb -0.17 -3.72 0.18 0.00 -1.06 0.00 0.00 42.46 37.70 2dbm s ILE 32 CO 0.14 0.01 0.99 0.41 -0.10 0.00 0.00 174.94 176.39 2dbm n THR 33 N 5.13 0.00 -4.43 2.92 -1.04 -1.25 -2.05 114.28 113.56 2dbm n THR 33 Ca -0.12 -0.17 -0.24 0.00 -2.04 0.00 0.00 64.05 61.48 2dbm n THR 33 Cb 0.50 -0.95 -0.17 0.00 -1.82 0.00 0.00 70.33 67.90 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 -6.10 1.54 0.00 -4.42 1.43 -0.69 -3.86 118.68 106.57 2dbm s LEU 34 Ca 0.66 -0.28 0.00 0.00 -1.03 0.00 0.00 54.13 53.48 2dbm s LEU 34 Cb -0.23 -0.79 0.00 0.00 0.03 0.00 0.00 46.19 45.20 2dbm s LEU 34 CO 0.61 -0.00 0.00 0.35 0.23 0.00 0.00 176.35 177.54 2dbm n THR 35 N 4.02 0.00 -3.92 5.49 -2.24 0.34 -4.67 114.28 113.29 2dbm n THR 35 Ca -0.21 0.00 -0.09 0.00 -2.27 0.00 0.00 64.05 61.48 2dbm n THR 35 Cb 0.51 -0.79 -0.04 0.00 -2.10 0.00 0.00 70.33 67.91 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 -4.41 -0.16 -0.08 3.42 0.01 -0.83 -5.01 114.94 107.88 2dbm s ASN 36 Ca 0.00 -0.77 0.02 0.00 -0.71 0.00 0.00 52.86 51.39 2dbm s ASN 36 Cb 0.00 0.61 0.01 0.00 0.41 0.00 0.00 41.25 42.29 2dbm s ASN 36 CO 0.00 -1.17 -0.12 -1.58 -1.51 0.00 0.00 177.10 172.72 2dbm s GLN 37 N -3.97 1.76 -0.23 -0.60 0.74 -1.26 0.11 119.66 116.20 2dbm s GLN 37 Ca 0.17 -0.41 -0.09 0.00 0.05 0.00 0.00 55.36 55.08 2dbm s GLN 37 Cb -0.02 -1.50 -0.18 0.00 1.10 0.00 0.00 33.01 32.41 2dbm s GLN 37 CO 0.06 -0.03 -0.06 -0.89 -0.55 0.00 0.00 175.29 173.83 2dbm n ILE 38 N 4.03 1.57 -3.42 -2.34 -0.00 -1.26 -4.98 119.36 112.95 2dbm n ILE 38 Ca -0.21 -0.42 -0.18 0.00 -0.00 0.00 0.00 62.75 61.94 2dbm n ILE 38 Cb 0.51 -1.75 0.03 0.00 -0.00 0.00 0.00 39.64 38.43 2dbm n ILE 38 CO 0.00 0.00 0.00 0.47 -0.00 0.00 0.00 176.55 177.02 2dbm n ASP 39 N -3.84 2.05 0.03 4.38 8.00 -1.26 -5.03 116.55 120.88 2dbm n ASP 39 Ca -0.43 -2.37 0.12 0.00 0.71 0.00 0.00 54.79 52.82 2dbm n ASP 39 Cb 0.91 -0.19 0.18 0.00 -0.02 0.00 0.00 41.12 42.01 2dbm n ASP 39 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 2dbm n GLU 40 N -1.77 0.19 -0.06 -1.24 -0.58 -1.26 -3.99 120.64 111.93 2dbm n GLU 40 Ca 0.06 0.04 0.01 0.00 -0.42 0.00 0.00 57.16 56.85 2dbm n GLU 40 Cb 0.49 -1.61 0.02 0.00 -0.57 0.00 0.00 31.44 29.77 2dbm n GLU 40 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 2dbm n ASN 41 N -1.87 1.14 -4.38 1.62 3.02 -1.26 -5.07 115.26 108.45 2dbm n ASN 41 Ca 0.04 -1.78 -0.19 0.00 -0.03 0.00 0.00 54.58 52.61 2dbm n ASN 41 Cb 0.40 -0.07 -0.10 0.00 -0.61 0.00 0.00 39.78 39.40 2dbm n ASN 41 CO 0.00 0.00 0.00 0.26 -2.62 0.00 0.00 177.26 174.90 2dbm s TRP 42 N -0.78 1.78 0.32 3.10 0.52 -1.26 -0.81 118.94 121.82 2dbm s TRP 42 Ca 0.04 -0.73 0.03 0.00 0.02 0.00 0.00 56.10 55.46 2dbm s TRP 42 Cb 0.03 -0.99 -0.04 0.00 -1.15 0.00 0.00 33.47 31.33 2dbm s TRP 42 CO 0.00 0.21 0.14 0.71 0.02 0.00 0.00 176.95 178.03 2dbm s TYR 43 N -3.12 1.66 -0.20 -1.98 2.02 -0.90 -4.20 117.35 110.63 2dbm s TYR 43 Ca 0.27 -1.31 -0.03 0.00 -0.37 0.00 0.00 57.07 55.64 2dbm s TYR 43 Cb 0.03 -0.95 0.06 0.00 -0.40 0.00 0.00 41.96 40.71 2dbm s TYR 43 CO 0.10 -0.43 0.04 -2.00 -1.57 0.00 0.00 175.55 171.70 2dbm s GLU 44 N -3.82 0.61 0.17 -0.62 2.12 0.29 -2.81 118.70 114.64 2dbm s GLU 44 Ca 0.34 -0.45 0.03 0.00 0.36 0.00 0.00 54.97 55.26 2dbm s GLU 44 Cb 0.05 -2.07 -0.01 0.00 0.26 0.00 0.00 34.13 32.36 2dbm s GLU 44 CO 0.17 -0.68 0.16 0.41 -0.54 0.00 0.00 175.26 174.79 2dbm n GLY 45 N 5.06 3.31 3.63 -1.50 0.00 -1.24 -0.51 105.19 113.94 2dbm n GLY 45 Ca -0.08 -1.73 -0.33 0.00 0.00 0.00 0.00 46.02 43.87 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 -2.65 2.72 -0.26 1.61 -1.94 -1.26 -3.54 119.30 113.98 2dbm s MET 46 Ca 0.20 -0.61 -0.01 0.00 -1.71 0.00 0.00 55.69 53.55 2dbm s MET 46 Cb 0.01 -2.61 0.14 0.00 2.01 0.00 0.00 34.83 34.38 2dbm s MET 46 CO 0.14 0.63 0.40 -1.17 -0.01 0.00 0.00 175.02 175.02 2dbm s LEU 47 N -1.28 -0.73 -1.31 -0.03 2.96 0.66 -3.87 118.68 115.07 2dbm s LEU 47 Ca 0.17 0.12 -0.07 0.00 -0.22 0.00 0.00 54.13 54.13 2dbm s LEU 47 Cb -0.11 1.20 0.01 0.00 0.50 0.00 0.00 46.19 47.78 2dbm s LEU 47 CO 0.07 -0.31 0.91 1.41 -1.32 0.00 0.00 176.35 177.11 2dbm n HIS 48 N 5.37 -2.37 -1.11 5.38 8.25 -1.26 -1.71 115.22 127.77 2dbm n HIS 48 Ca -0.02 0.78 -0.04 0.00 -0.26 0.00 0.00 57.72 58.18 2dbm n HIS 48 Cb 0.50 -4.55 -0.02 0.00 1.12 0.00 0.00 29.99 27.04 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 -1.75 0.68 3.31 -1.41 0.00 -1.26 -5.03 105.19 99.74 2dbm n GLY 49 Ca -0.03 -0.75 -0.31 0.00 0.00 0.00 0.00 46.02 44.94 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 -2.11 2.31 -0.23 1.61 3.76 -0.69 -5.12 115.29 114.82 2dbm s HIS 50 Ca 0.00 -0.43 0.01 0.00 -0.15 0.00 0.00 55.06 54.49 2dbm s HIS 50 Cb 0.00 -1.47 0.06 0.00 1.11 0.00 0.00 32.58 32.28 2dbm s HIS 50 CO 0.00 -0.01 -0.08 -1.54 -0.85 0.00 0.00 174.74 172.26 2dbm s SER 51 N -0.73 3.91 0.37 1.40 1.04 -1.26 -0.25 113.70 118.18 2dbm s SER 51 Ca 0.10 -1.17 -0.04 0.00 0.48 0.00 0.00 55.95 55.32 2dbm s SER 51 Cb -0.10 -1.29 0.02 0.00 0.10 0.00 0.00 66.02 64.75 2dbm s SER 51 CO -0.00 -0.20 0.55 -0.83 0.98 0.00 0.00 173.24 173.73 2dbm s GLY 52 N 1.32 1.39 -0.19 7.32 0.00 -1.23 -4.84 107.32 111.09 2dbm s GLY 52 Ca -0.06 -1.44 -0.12 0.00 0.00 0.00 0.00 44.72 43.10 2dbm s GLY 52 CO -0.06 -0.90 0.22 -1.36 0.00 0.00 0.00 173.10 171.00 2dbm s PHE 53 N -2.75 3.42 0.15 1.90 0.08 -1.23 -3.70 117.98 115.85 2dbm s PHE 53 Ca 0.28 0.45 0.10 0.00 0.12 0.00 0.00 56.93 57.89 2dbm s PHE 53 Cb -0.02 -2.28 -0.04 0.00 -0.57 0.00 0.00 43.02 40.12 2dbm s PHE 53 CO 0.20 0.22 -0.23 -0.59 -0.10 0.00 0.00 175.22 174.72 2dbm s PHE 54 N 0.54 2.12 0.35 0.36 -0.71 -1.12 -1.62 117.98 117.90 2dbm s PHE 54 Ca 0.12 -0.39 -0.27 0.00 -1.04 0.00 0.00 56.93 55.35 2dbm s PHE 54 Cb -0.12 -1.10 -0.09 0.00 -1.21 0.00 0.00 43.02 40.49 2dbm s PHE 54 CO 0.02 0.37 1.21 -1.25 -1.34 0.00 0.00 175.22 174.23 2dbm s PRO 55 N -2.36 4.28 0.11 1.99 0.04 -1.26 -2.11 135.00 135.69 2dbm s PRO 55 Ca 0.15 1.99 0.19 0.00 0.04 0.00 0.00 61.00 63.37 2dbm s PRO 55 Cb -0.09 -2.93 -0.09 0.00 0.04 0.00 0.00 34.50 31.43 2dbm s PRO 55 CO 0.07 -0.17 0.89 -0.89 0.04 0.00 0.00 177.00 176.94 2dbm n ILE 56 N 0.58 0.91 1.52 0.56 5.41 0.01 -3.80 119.36 124.54 2dbm n ILE 56 Ca 0.02 -0.63 0.12 0.00 1.00 0.00 0.00 62.75 63.26 2dbm n ILE 56 Cb 0.44 -0.54 0.70 0.00 -0.71 0.00 0.00 39.64 39.53 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 -2.77 0.00 -0.00 4.38 4.13 -1.26 -2.45 115.26 117.28 2dbm n ASN 57 Ca -0.06 -0.78 0.01 0.00 1.68 0.00 0.00 54.58 55.44 2dbm n ASN 57 Cb 0.71 0.00 -0.02 0.00 -1.54 0.00 0.00 39.78 38.94 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 -0.99 0.00 -4.50 3.10 4.01 -1.25 -5.02 117.16 112.52 2dbm n TYR 58 Ca 0.18 0.00 -0.25 0.00 -0.16 0.00 0.00 57.90 57.67 2dbm n TYR 58 Cb 0.08 0.00 -0.13 0.00 -0.31 0.00 0.00 39.34 38.98 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 -1.24 1.74 0.09 -0.72 -7.23 -1.03 -2.23 120.40 109.78 2dbm s VAL 59 Ca 0.01 -1.37 -0.22 0.00 -1.81 0.00 0.00 61.98 58.59 2dbm s VAL 59 Cb 0.02 -1.54 -0.07 0.00 0.56 0.00 0.00 36.38 35.36 2dbm s VAL 59 CO 0.12 0.10 0.67 -0.70 -0.31 0.00 0.00 175.10 174.98 2dbm s GLU 60 N -1.52 4.39 -0.45 4.82 2.56 0.10 -4.84 118.70 123.77 2dbm s GLU 60 Ca 0.08 0.93 -0.13 0.00 0.00 0.00 0.00 54.97 55.84 2dbm s GLU 60 Cb -0.09 -3.28 0.07 0.00 2.00 0.00 0.00 34.13 32.83 2dbm s GLU 60 CO 0.03 0.52 0.34 0.42 -0.56 0.00 0.00 175.26 176.01 2dbm s ILE 61 N -0.81 4.87 -0.12 -3.70 -1.09 -1.26 -0.97 121.20 118.12 2dbm s ILE 61 Ca 0.33 -1.15 -0.09 0.00 -2.23 0.00 0.00 60.65 57.51 2dbm s ILE 61 Cb -0.21 -3.92 -0.26 0.00 -1.58 0.00 0.00 42.46 36.49 2dbm s ILE 61 CO 0.22 -0.53 0.40 -0.07 -1.23 0.00 0.00 174.94 173.73 2dbm h LEU 62 N 8.62 0.41 -8.02 2.97 3.38 -1.96 -3.45 115.31 117.26 2dbm h LEU 62 Ca -0.26 -0.92 -0.67 0.00 0.09 0.00 0.00 57.88 56.11 2dbm h LEU 62 Cb 1.10 -0.13 -0.34 0.00 0.09 0.00 0.00 40.66 41.38 2dbm h LEU 62 CO 0.82 1.82 -0.76 -0.69 0.09 0.00 0.00 178.44 179.72 2dbm s VAL 63 N -2.54 2.63 -0.11 1.22 1.01 -1.24 -5.05 120.40 116.33 2dbm s VAL 63 Ca -0.22 -1.32 -0.30 0.00 0.00 0.00 0.00 61.98 60.14 2dbm s VAL 63 Cb 0.06 -2.44 -0.03 0.00 0.00 0.00 0.00 36.38 33.97 2dbm s VAL 63 CO 0.77 0.06 1.31 0.00 0.00 0.00 0.00 175.10 177.23 2dbm s ALA 64 N 1.23 3.61 0.72 5.51 0.00 -1.26 -4.40 121.76 127.17 2dbm s ALA 64 Ca -0.04 0.60 -0.17 0.00 0.00 0.00 0.00 51.96 52.36 2dbm s ALA 64 Cb -0.18 -3.60 -0.08 0.00 0.00 0.00 0.00 23.12 19.25 2dbm s ALA 64 CO -0.04 -1.06 0.18 1.28 0.00 0.00 0.00 175.76 176.11 2dbm n LEU 65 N 6.15 -1.25 -4.56 0.00 4.77 -1.26 -4.76 117.00 116.10 2dbm n LEU 65 Ca 0.13 0.54 -0.27 0.00 -0.03 0.00 0.00 56.01 56.38 2dbm n LEU 65 Cb 0.45 -1.06 -0.05 0.00 -2.33 0.00 0.00 43.42 40.42 2dbm n LEU 65 CO 0.57 -3.95 1.35 -2.16 -1.33 0.00 0.00 177.39 171.87 2dbm s PRO 66 N -2.28 2.54 0.28 3.23 0.04 -1.26 -4.91 135.00 132.64 2dbm s PRO 66 Ca 0.59 -0.36 0.00 0.00 0.04 0.00 0.00 61.00 61.28 2dbm s PRO 66 Cb -0.35 -5.08 -0.00 0.00 0.04 0.00 0.00 34.50 29.11 2dbm s PRO 66 CO 0.64 -3.44 0.01 1.58 0.04 0.00 0.00 177.00 175.83 2dbm n HIS 67 N 14.06 0.58 -3.18 0.56 -0.00 -1.26 -5.10 115.22 120.88 2dbm n HIS 67 Ca 0.41 -1.41 -0.43 0.00 0.46 0.00 0.00 57.72 56.75 2dbm n HIS 67 Cb 0.47 -0.16 -0.07 0.00 -0.12 0.00 0.00 29.99 30.11 2dbm n HIS 67 CO 0.00 0.00 0.00 -1.54 0.46 0.00 0.00 176.34 175.26 2dbm s SER 68 N -2.54 6.24 0.00 0.26 1.04 -1.26 -4.96 113.70 112.48 2dbm s SER 68 Ca 0.02 -0.73 0.00 0.00 0.48 0.00 0.00 55.95 55.71 2dbm s SER 68 Cb 0.00 -2.28 0.00 0.00 0.10 0.00 0.00 66.02 63.84 2dbm s SER 68 CO 0.01 -0.80 0.00 0.61 0.98 0.00 0.00 173.24 174.04 2dbm n GLY 69 N 5.13 3.89 3.56 7.32 0.00 -1.26 -4.95 105.19 118.87 2dbm n GLY 69 Ca -0.06 -1.00 -0.27 0.00 0.00 0.00 0.00 46.02 44.70 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 -2.66 2.55 -1.79 1.61 0.04 -1.26 -3.95 135.00 129.54 2dbm s PRO 70 Ca 0.00 -0.25 -0.19 0.00 0.04 0.00 0.00 61.00 60.60 2dbm s PRO 70 Cb 0.00 -5.04 0.18 0.00 0.04 0.00 0.00 34.50 29.69 2dbm s PRO 70 CO 0.00 -3.36 0.57 -1.13 0.04 0.00 0.00 177.00 173.11 2dbm n SER 71 N 13.97 -1.79 -4.19 6.66 3.41 -1.26 -4.90 113.62 125.51 2dbm n SER 71 Ca 0.40 -1.19 -0.11 0.00 -0.26 0.00 0.00 58.87 57.70 2dbm n SER 71 Cb 0.47 -1.92 -0.10 0.00 -0.26 0.00 0.00 64.21 62.40 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 -3.44 0.59 0.00 4.04 1.04 -1.25 -5.07 113.70 109.61 2dbm s SER 72 Ca 0.69 -1.23 0.00 0.00 0.48 0.00 0.00 55.95 55.88 2dbm s SER 72 Cb -0.39 0.25 0.00 0.00 0.10 0.00 0.00 66.02 65.97 2dbm s SER 72 CO 1.00 -0.70 0.00 0.61 0.98 0.00 0.00 173.24 175.13