#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 5.89 0.05 1.61 0.15 -1.26 -4.94 113.70 115.20 2dbm s SER 2 Ca 0.00 -1.62 -0.19 0.00 0.70 0.00 0.00 55.95 54.84 2dbm s SER 2 Cb 0.00 -2.08 -0.13 0.00 -1.71 0.00 0.00 66.02 62.09 2dbm s SER 2 CO 0.00 -0.67 1.36 -1.28 1.20 0.00 0.00 173.24 173.85 2dbm h SER 3 N 8.60 0.47 0.00 5.45 0.87 -2.11 -3.48 113.55 123.34 2dbm h SER 3 Ca -0.25 -0.48 0.00 0.00 -1.23 0.00 0.00 61.79 59.82 2dbm h SER 3 Cb 1.09 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 62.92 2dbm h SER 3 CO 0.87 0.86 0.00 0.61 -0.53 0.00 0.00 176.83 178.64 2dbm n GLY 4 N 0.21 2.26 3.30 5.77 0.00 -1.26 -4.99 105.19 110.47 2dbm n GLY 4 Ca -0.06 -0.74 -0.12 0.00 0.00 0.00 0.00 46.02 45.09 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 0.00 -0.45 -0.06 1.61 0.01 -1.26 -5.17 113.70 108.38 2dbm s SER 5 Ca 0.00 0.85 -0.10 0.00 1.31 0.00 0.00 55.95 58.00 2dbm s SER 5 Cb 0.00 0.82 0.02 0.00 0.21 0.00 0.00 66.02 67.07 2dbm s SER 5 CO 0.00 -0.16 0.25 -0.44 0.41 0.00 0.00 173.24 173.31 2dbm s SER 6 N 0.51 -0.20 0.00 2.44 0.01 -1.26 -5.17 113.70 110.03 2dbm s SER 6 Ca -0.02 0.28 0.00 0.00 1.31 0.00 0.00 55.95 57.52 2dbm s SER 6 Cb -0.04 0.42 0.00 0.00 0.21 0.00 0.00 66.02 66.61 2dbm s SER 6 CO -0.03 -0.23 0.00 0.61 0.41 0.00 0.00 173.24 174.00 2dbm n GLY 7 N 2.23 7.09 3.69 3.44 0.00 -1.26 -5.10 105.19 115.29 2dbm n GLY 7 Ca -0.17 -1.91 -0.42 0.00 0.00 0.00 0.00 46.02 43.52 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 1.18 4.28 0.04 1.61 0.04 -1.26 -4.99 135.00 135.90 2dbm s PRO 8 Ca 0.00 2.03 -0.00 0.00 0.04 0.00 0.00 61.00 63.06 2dbm s PRO 8 Cb 0.00 -3.53 -0.03 0.00 0.04 0.00 0.00 34.50 30.97 2dbm s PRO 8 CO 0.00 -0.58 -0.03 0.00 0.04 0.00 0.00 177.00 176.43 2dbm s ARG 11 N -3.43 2.49 -0.00 0.00 3.52 -1.14 -2.21 118.95 118.18 2dbm s ARG 11 Ca 0.17 -0.77 -0.27 0.00 -0.13 0.00 0.00 55.73 54.73 2dbm s ARG 11 Cb -0.01 -2.30 -0.04 0.00 -1.56 0.00 0.00 34.95 31.04 2dbm s ARG 11 CO 0.03 0.55 0.86 0.00 -0.81 0.00 0.00 175.30 175.94 2dbm s ALA 12 N -0.56 3.25 -0.27 6.12 0.00 -1.24 -1.76 121.76 127.30 2dbm s ALA 12 Ca 0.08 0.38 0.22 0.00 0.00 0.00 0.00 51.96 52.64 2dbm s ALA 12 Cb -0.11 -3.17 0.07 0.00 0.00 0.00 0.00 23.12 19.91 2dbm s ALA 12 CO 0.01 -0.13 1.17 -0.07 0.00 0.00 0.00 175.76 176.74 2dbm h LEU 13 N 6.50 0.00 0.00 0.00 3.38 -1.24 -2.44 115.31 121.51 2dbm h LEU 13 Ca -0.42 0.00 -0.12 0.00 0.09 0.00 0.00 57.88 57.43 2dbm h LEU 13 Cb 1.21 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.93 2dbm h LEU 13 CO 0.74 0.07 -0.03 -1.22 0.09 0.00 0.00 178.44 178.09 2dbm n TYR 14 N -2.81 -1.19 -3.87 1.13 4.01 -1.26 -4.85 117.16 108.32 2dbm n TYR 14 Ca 0.00 -1.26 -0.35 0.00 -0.16 0.00 0.00 57.90 56.13 2dbm n TYR 14 Cb 0.58 0.36 -0.05 0.00 -0.31 0.00 0.00 39.34 39.92 2dbm n TYR 14 CO 0.00 0.00 0.00 -0.51 -0.46 0.00 0.00 176.86 175.89 2dbm s ASP 15 N -2.21 6.40 -0.04 7.72 1.01 -1.26 -2.14 116.67 126.16 2dbm s ASP 15 Ca 0.15 0.44 -0.01 0.00 0.71 0.00 0.00 52.55 53.84 2dbm s ASP 15 Cb -0.01 -2.05 0.03 0.00 1.01 0.00 0.00 42.92 41.90 2dbm s ASP 15 CO 0.11 0.33 0.07 0.12 0.21 0.00 0.00 175.17 176.01 2dbm s PHE 16 N -1.18 -0.04 -0.03 4.23 5.36 -1.17 -4.97 117.98 120.18 2dbm s PHE 16 Ca 0.21 0.26 -0.02 0.00 -0.96 0.00 0.00 56.93 56.42 2dbm s PHE 16 Cb -0.12 -0.19 -0.04 0.00 -0.34 0.00 0.00 43.02 42.33 2dbm s PHE 16 CO 0.11 -0.12 0.08 -1.21 -1.46 0.00 0.00 175.22 172.63 2dbm s GLU 17 N 1.14 3.13 0.17 10.12 0.41 -1.26 -2.43 118.70 129.98 2dbm s GLU 17 Ca -0.09 -0.41 -0.30 0.00 -0.41 0.00 0.00 54.97 53.76 2dbm s GLU 17 Cb -0.12 -2.91 -0.08 0.00 -1.78 0.00 0.00 34.13 29.23 2dbm s GLU 17 CO -0.04 0.68 1.32 -1.25 -0.49 0.00 0.00 175.26 175.48 2dbm s PRO 18 N -1.51 4.37 -0.18 0.39 0.04 -1.26 -4.91 135.00 131.94 2dbm s PRO 18 Ca 0.20 2.04 0.07 0.00 0.04 0.00 0.00 61.00 63.36 2dbm s PRO 18 Cb -0.12 -3.22 -0.16 0.00 0.04 0.00 0.00 34.50 31.05 2dbm s PRO 18 CO 0.11 -0.30 -0.07 0.39 0.04 0.00 0.00 177.00 177.17 2dbm n GLU 19 N 3.03 0.92 -4.42 4.56 1.02 -1.26 -5.01 120.64 119.48 2dbm n GLU 19 Ca 0.08 0.06 -0.27 0.00 -0.02 0.00 0.00 57.16 57.01 2dbm n GLU 19 Cb 0.43 -1.40 -0.12 0.00 -0.02 0.00 0.00 31.44 30.33 2dbm n GLU 19 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 2dbm s ASN 20 N -5.49 3.45 0.20 1.62 0.01 -1.26 -5.08 114.94 108.39 2dbm s ASN 20 Ca -0.18 -0.86 -0.32 0.00 -0.71 0.00 0.00 52.86 50.79 2dbm s ASN 20 Cb 0.06 -0.26 -0.15 0.00 0.41 0.00 0.00 41.25 41.31 2dbm s ASN 20 CO 0.54 0.12 1.15 -0.62 -1.51 0.00 0.00 177.10 176.79 2dbm n GLU 21 N 0.28 1.28 0.00 -0.60 1.02 -1.26 -1.73 120.64 119.63 2dbm n GLU 21 Ca -0.13 0.45 0.00 0.00 -0.02 0.00 0.00 57.16 57.47 2dbm n GLU 21 Cb 0.56 -1.94 0.00 0.00 -0.02 0.00 0.00 31.44 30.04 2dbm n GLU 21 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2dbm n GLY 22 N 1.88 2.99 2.59 0.62 0.00 -1.26 -5.03 105.19 106.98 2dbm n GLY 22 Ca 0.14 -0.81 -0.39 0.00 0.00 0.00 0.00 46.02 44.96 2dbm n GLY 22 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2dbm n GLU 23 N 0.00 0.00 -3.55 1.61 -0.58 -0.70 -4.26 120.64 113.16 2dbm n GLU 23 Ca 0.00 0.00 -0.41 0.00 -0.42 0.00 0.00 57.16 56.33 2dbm n GLU 23 Cb 0.00 -0.87 -0.07 0.00 -0.57 0.00 0.00 31.44 29.93 2dbm n GLU 23 CO 0.00 0.00 0.00 -1.17 -0.48 0.00 0.00 177.13 175.48 2dbm s LEU 24 N 1.59 5.85 0.12 -4.62 2.96 -1.04 -4.80 118.68 118.75 2dbm s LEU 24 Ca 0.54 -2.51 -0.31 0.00 -0.22 0.00 0.00 54.13 51.64 2dbm s LEU 24 Cb -0.78 -2.01 -0.08 0.00 0.50 0.00 0.00 46.19 43.81 2dbm s LEU 24 CO 0.43 -0.54 1.47 -0.83 -1.32 0.00 0.00 176.35 175.56 2dbm s GLY 25 N 1.78 1.80 0.35 7.98 0.00 -1.26 -4.73 107.32 113.24 2dbm s GLY 25 Ca 0.14 1.19 0.03 0.00 0.00 0.00 0.00 44.72 46.07 2dbm s GLY 25 CO -0.04 2.49 0.22 1.97 0.00 0.00 0.00 173.10 177.73 2dbm n PHE 26 N 4.19 -0.62 -3.75 1.90 1.16 -1.02 -4.99 117.46 114.34 2dbm n PHE 26 Ca 0.13 -1.51 -0.13 0.00 -1.87 0.00 0.00 57.45 54.07 2dbm n PHE 26 Cb 0.41 -0.27 -0.13 0.00 -1.61 0.00 0.00 39.48 37.87 2dbm n PHE 26 CO 0.00 0.00 0.00 0.15 -1.87 0.00 0.00 176.76 175.04 2dbm s LYS 27 N -3.39 0.17 -0.53 3.97 3.01 -1.26 -3.04 119.74 118.66 2dbm s LYS 27 Ca 0.16 0.43 -0.40 0.00 -1.01 0.00 0.00 55.97 55.15 2dbm s LYS 27 Cb -0.01 -0.10 -0.18 0.00 -1.01 0.00 0.00 37.83 36.53 2dbm s LYS 27 CO 0.10 -0.14 2.22 -1.91 0.51 0.00 0.00 175.35 176.14 2dbm n GLU 28 N 4.00 0.22 0.00 1.68 2.13 -0.91 0.26 120.64 128.02 2dbm n GLU 28 Ca -0.23 0.06 0.00 0.00 0.66 0.00 0.00 57.16 57.64 2dbm n GLU 28 Cb 0.53 -1.71 0.00 0.00 0.27 0.00 0.00 31.44 30.53 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 7.18 3.06 3.69 8.31 0.00 -0.92 -4.96 105.19 121.54 2dbm n GLY 29 Ca 0.53 -1.12 -0.42 0.00 0.00 0.00 0.00 46.02 45.01 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 0.00 6.56 -0.14 1.61 1.01 0.14 -4.66 116.67 121.19 2dbm s ASP 30 Ca 0.00 2.53 -0.27 0.00 0.71 0.00 0.00 52.55 55.52 2dbm s ASP 30 Cb 0.00 -2.56 -0.01 0.00 1.01 0.00 0.00 42.92 41.36 2dbm s ASP 30 CO 0.00 -0.93 0.92 -0.63 0.21 0.00 0.00 175.17 174.74 2dbm s ILE 31 N 2.89 4.84 -0.36 0.77 -1.09 -1.26 -3.70 121.20 123.29 2dbm s ILE 31 Ca 0.76 1.83 -0.14 0.00 -2.23 0.00 0.00 60.65 60.87 2dbm s ILE 31 Cb -0.41 -4.22 -0.00 0.00 -1.58 0.00 0.00 42.46 36.25 2dbm s ILE 31 CO 0.34 0.02 0.29 -0.63 -1.23 0.00 0.00 174.94 173.73 2dbm s ILE 32 N 2.05 5.25 0.78 2.92 1.09 -0.94 -4.95 121.20 127.40 2dbm s ILE 32 Ca 0.43 -0.29 -0.15 0.00 -1.10 0.00 0.00 60.65 59.54 2dbm s ILE 32 Cb -0.17 -3.81 0.02 0.00 -1.06 0.00 0.00 42.46 37.44 2dbm s ILE 32 CO 0.15 -0.13 0.87 0.41 -0.10 0.00 0.00 174.94 176.14 2dbm n THR 33 N 5.17 1.97 -4.92 2.92 -1.04 -1.26 -3.21 114.28 113.91 2dbm n THR 33 Ca -0.11 -0.30 -0.32 0.00 -2.04 0.00 0.00 64.05 61.27 2dbm n THR 33 Cb 0.49 -0.98 -0.16 0.00 -1.82 0.00 0.00 70.33 67.85 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 -2.96 2.32 0.01 -4.42 1.43 -1.11 -3.95 118.68 110.01 2dbm s LEU 34 Ca 0.69 -0.49 0.00 0.00 -1.03 0.00 0.00 54.13 53.30 2dbm s LEU 34 Cb -0.31 -1.49 0.00 0.00 0.03 0.00 0.00 46.19 44.41 2dbm s LEU 34 CO 0.54 0.14 0.00 0.35 0.23 0.00 0.00 176.35 177.61 2dbm n THR 35 N 3.68 0.11 -3.88 5.49 -2.24 0.16 -4.79 114.28 112.81 2dbm n THR 35 Ca -0.19 0.04 -0.08 0.00 -2.27 0.00 0.00 64.05 61.54 2dbm n THR 35 Cb 0.53 -1.39 -0.01 0.00 -2.10 0.00 0.00 70.33 67.35 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 -5.09 -0.06 -0.06 3.42 0.01 -1.20 -5.03 114.94 106.93 2dbm s ASN 36 Ca 0.00 -0.89 0.04 0.00 -0.71 0.00 0.00 52.86 51.29 2dbm s ASN 36 Cb 0.00 0.74 0.00 0.00 0.41 0.00 0.00 41.25 42.40 2dbm s ASN 36 CO 0.00 -1.42 -0.17 -1.58 -1.51 0.00 0.00 177.10 172.42 2dbm s GLN 37 N -3.37 2.04 -0.24 -0.60 0.74 -1.26 0.03 119.66 117.00 2dbm s GLN 37 Ca 0.16 -0.61 -0.05 0.00 0.05 0.00 0.00 55.36 54.90 2dbm s GLN 37 Cb -0.04 -1.68 -0.13 0.00 1.10 0.00 0.00 33.01 32.26 2dbm s GLN 37 CO 0.10 0.17 -0.26 -0.89 -0.55 0.00 0.00 175.29 173.85 2dbm n ILE 38 N 3.42 1.34 -3.47 -2.34 -0.00 -1.26 -4.99 119.36 112.07 2dbm n ILE 38 Ca -0.20 -0.43 -0.22 0.00 -0.00 0.00 0.00 62.75 61.90 2dbm n ILE 38 Cb 0.53 -1.58 0.03 0.00 -0.00 0.00 0.00 39.64 38.62 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 -3.64 2.40 0.05 4.38 2.03 -1.26 -5.03 116.55 115.48 2dbm n ASP 39 Ca -0.45 -2.68 0.12 0.00 0.52 0.00 0.00 54.79 52.30 2dbm n ASP 39 Cb 0.89 -0.23 0.22 0.00 -0.72 0.00 0.00 41.12 41.28 2dbm n ASP 39 CO 0.00 0.00 0.00 -1.84 -1.92 0.00 0.00 177.20 173.44 2dbm n GLU 40 N -2.00 0.22 0.00 -0.67 0.00 -1.26 -3.96 120.64 112.97 2dbm n GLU 40 Ca 0.07 0.07 0.00 0.00 0.00 0.00 0.00 57.16 57.30 2dbm n GLU 40 Cb 0.60 -1.64 0.00 0.00 0.00 0.00 0.00 31.44 30.40 2dbm n GLU 40 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.13 177.22 2dbm n ASN 41 N -1.97 0.92 -4.45 -1.84 3.02 -1.26 -5.07 115.26 104.62 2dbm n ASN 41 Ca 0.04 -1.37 -0.23 0.00 -0.03 0.00 0.00 54.58 52.99 2dbm n ASN 41 Cb 0.41 0.00 -0.10 0.00 -0.61 0.00 0.00 39.78 39.48 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 -0.37 2.13 0.33 3.10 0.52 -1.25 -1.32 118.94 122.08 2dbm s TRP 42 Ca 0.00 -0.46 0.04 0.00 0.02 0.00 0.00 56.10 55.70 2dbm s TRP 42 Cb 0.00 -1.02 -0.03 0.00 -1.15 0.00 0.00 33.47 31.26 2dbm s TRP 42 CO 0.00 0.56 0.16 0.71 0.02 0.00 0.00 176.95 178.40 2dbm s TYR 43 N -2.69 1.67 0.01 -1.98 2.02 -0.69 -4.05 117.35 111.64 2dbm s TYR 43 Ca 0.29 -1.37 0.03 0.00 -0.37 0.00 0.00 57.07 55.64 2dbm s TYR 43 Cb -0.02 -0.92 -0.01 0.00 -0.40 0.00 0.00 41.96 40.61 2dbm s TYR 43 CO 0.13 -0.50 -0.10 -2.00 -1.57 0.00 0.00 175.55 171.52 2dbm s GLU 44 N -3.76 0.71 0.08 -0.62 -6.30 0.10 -2.45 118.70 106.46 2dbm s GLU 44 Ca 0.34 -0.46 -0.12 0.00 -2.50 0.00 0.00 54.97 52.23 2dbm s GLU 44 Cb 0.04 -0.67 0.04 0.00 0.00 0.00 0.00 34.13 33.55 2dbm s GLU 44 CO 0.18 0.17 0.55 0.41 0.02 0.00 0.00 175.26 176.59 2dbm n GLY 45 N 2.46 0.85 3.30 -1.50 0.00 -1.23 -0.66 105.19 108.40 2dbm n GLY 45 Ca -0.16 -1.02 -0.33 0.00 0.00 0.00 0.00 46.02 44.51 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 -2.02 3.27 -0.10 1.61 -1.94 -1.26 -3.66 119.30 115.21 2dbm s MET 46 Ca 0.12 -0.72 -0.04 0.00 -1.71 0.00 0.00 55.69 53.34 2dbm s MET 46 Cb -0.01 -2.66 0.05 0.00 2.01 0.00 0.00 34.83 34.22 2dbm s MET 46 CO 0.02 0.05 0.19 -1.17 -0.01 0.00 0.00 175.02 174.11 2dbm s LEU 47 N 0.75 0.05 -1.57 -0.03 2.96 -0.69 -4.15 118.68 116.00 2dbm s LEU 47 Ca -0.06 0.42 -0.04 0.00 -0.22 0.00 0.00 54.13 54.23 2dbm s LEU 47 Cb -0.15 0.46 0.01 0.00 0.50 0.00 0.00 46.19 47.00 2dbm s LEU 47 CO 0.01 -0.22 0.42 1.41 -1.32 0.00 0.00 176.35 176.65 2dbm n HIS 48 N 5.02 -1.70 -1.36 5.38 8.25 -1.26 -0.90 115.22 128.65 2dbm n HIS 48 Ca -0.11 0.37 -0.11 0.00 -0.26 0.00 0.00 57.72 57.61 2dbm n HIS 48 Cb 0.50 -4.15 -0.04 0.00 1.12 0.00 0.00 29.99 27.41 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 -1.34 1.15 3.17 -1.41 0.00 -1.26 -5.00 105.19 100.50 2dbm n GLY 49 Ca -0.14 -0.53 -0.29 0.00 0.00 0.00 0.00 46.02 45.06 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 -2.41 2.17 -0.38 1.61 3.76 -0.08 -5.11 115.29 114.85 2dbm s HIS 50 Ca 0.00 -0.80 -0.11 0.00 -0.15 0.00 0.00 55.06 54.01 2dbm s HIS 50 Cb 0.00 -1.46 0.04 0.00 1.11 0.00 0.00 32.58 32.26 2dbm s HIS 50 CO 0.00 -0.32 0.21 -1.54 -0.85 0.00 0.00 174.74 172.24 2dbm s SER 51 N 0.28 5.71 0.33 1.40 1.04 -1.26 -1.71 113.70 119.49 2dbm s SER 51 Ca -0.13 -1.07 -0.04 0.00 0.48 0.00 0.00 55.95 55.19 2dbm s SER 51 Cb -0.16 -2.01 0.00 0.00 0.10 0.00 0.00 66.02 63.95 2dbm s SER 51 CO 0.06 -0.41 0.48 -0.83 0.98 0.00 0.00 173.24 173.52 2dbm s GLY 52 N 1.62 1.35 0.04 7.32 0.00 -1.24 -5.01 107.32 111.40 2dbm s GLY 52 Ca 0.02 -1.43 -0.00 0.00 0.00 0.00 0.00 44.72 43.30 2dbm s GLY 52 CO 0.06 -0.95 0.17 -1.36 0.00 0.00 0.00 173.10 171.02 2dbm s PHE 53 N -3.15 3.45 0.04 1.90 0.08 -1.26 -3.57 117.98 115.48 2dbm s PHE 53 Ca 0.29 0.25 0.01 0.00 0.12 0.00 0.00 56.93 57.61 2dbm s PHE 53 Cb -0.00 -1.76 -0.03 0.00 -0.57 0.00 0.00 43.02 40.66 2dbm s PHE 53 CO 0.19 0.59 -0.06 -0.59 -0.10 0.00 0.00 175.22 175.25 2dbm s PHE 54 N -1.40 0.59 0.58 0.36 -0.71 -1.03 -2.48 117.98 113.89 2dbm s PHE 54 Ca 0.31 -0.58 -0.18 0.00 -1.04 0.00 0.00 56.93 55.43 2dbm s PHE 54 Cb -0.13 -0.36 -0.04 0.00 -1.21 0.00 0.00 43.02 41.28 2dbm s PHE 54 CO 0.23 -0.13 1.12 -1.25 -1.34 0.00 0.00 175.22 173.85 2dbm s PRO 55 N -1.92 3.18 0.04 1.99 0.04 -1.26 -1.70 135.00 135.38 2dbm s PRO 55 Ca -0.08 1.54 0.22 0.00 0.04 0.00 0.00 61.00 62.72 2dbm s PRO 55 Cb -0.07 -1.99 -0.12 0.00 0.04 0.00 0.00 34.50 32.36 2dbm s PRO 55 CO -0.01 -0.98 0.84 -0.89 0.04 0.00 0.00 177.00 176.00 2dbm n ILE 56 N -1.66 0.17 1.46 0.56 5.41 -0.43 -4.03 119.36 120.83 2dbm n ILE 56 Ca 0.11 -0.35 0.07 0.00 1.00 0.00 0.00 62.75 63.58 2dbm n ILE 56 Cb 0.51 0.13 0.42 0.00 -0.71 0.00 0.00 39.64 40.00 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 -2.13 0.00 -0.00 4.38 3.02 -1.26 -2.76 115.26 116.51 2dbm n ASN 57 Ca -0.00 -1.01 -0.00 0.00 -0.03 0.00 0.00 54.58 53.53 2dbm n ASN 57 Cb 0.49 0.00 -0.01 0.00 -0.61 0.00 0.00 39.78 39.65 2dbm n ASN 57 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 2dbm n TYR 58 N -0.80 0.00 -4.35 3.10 4.01 -1.26 -5.05 117.16 112.80 2dbm n TYR 58 Ca 0.11 0.00 -0.24 0.00 -0.16 0.00 0.00 57.90 57.61 2dbm n TYR 58 Cb 0.05 -0.04 -0.08 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 -2.05 2.90 -0.07 -0.72 -7.23 -1.11 -0.66 120.40 111.46 2dbm s VAL 59 Ca -0.00 -2.06 0.04 0.00 -1.81 0.00 0.00 61.98 58.15 2dbm s VAL 59 Cb 0.00 -2.69 -0.01 0.00 0.56 0.00 0.00 36.38 34.24 2dbm s VAL 59 CO 0.05 -0.32 -0.20 -0.70 -0.31 0.00 0.00 175.10 173.62 2dbm s GLU 60 N -3.65 2.71 -0.61 4.82 -6.30 -0.72 -4.81 118.70 110.15 2dbm s GLU 60 Ca 0.32 -0.81 -0.23 0.00 -2.50 0.00 0.00 54.97 51.75 2dbm s GLU 60 Cb -0.04 -2.31 0.05 0.00 0.00 0.00 0.00 34.13 31.84 2dbm s GLU 60 CO 0.18 0.40 0.96 0.42 0.02 0.00 0.00 175.26 177.24 2dbm s ILE 61 N -0.18 4.34 0.04 -3.70 -1.09 -1.26 -2.87 121.20 116.48 2dbm s ILE 61 Ca -0.02 -0.03 -0.16 0.00 -2.23 0.00 0.00 60.65 58.21 2dbm s ILE 61 Cb -0.14 -4.61 -0.30 0.00 -1.58 0.00 0.00 42.46 35.83 2dbm s ILE 61 CO 0.03 -1.30 1.07 -0.07 -1.23 0.00 0.00 174.94 173.45 2dbm h LEU 62 N 11.20 0.82 -8.12 2.97 3.38 -1.97 -3.43 115.31 120.17 2dbm h LEU 62 Ca -0.27 -0.84 -0.67 0.00 0.09 0.00 0.00 57.88 56.19 2dbm h LEU 62 Cb 1.07 -0.26 -0.33 0.00 0.09 0.00 0.00 40.66 41.23 2dbm h LEU 62 CO 1.14 1.58 -0.77 -0.69 0.09 0.00 0.00 178.44 179.78 2dbm s VAL 63 N -2.92 2.69 0.12 1.22 1.01 -1.25 -5.05 120.40 116.21 2dbm s VAL 63 Ca -0.10 -1.05 -0.31 0.00 0.00 0.00 0.00 61.98 60.52 2dbm s VAL 63 Cb 0.05 -2.34 -0.09 0.00 0.00 0.00 0.00 36.38 33.99 2dbm s VAL 63 CO 0.92 0.24 1.63 0.00 0.00 0.00 0.00 175.10 177.89 2dbm s ALA 64 N 1.30 3.74 0.75 5.51 0.00 -1.26 -4.54 121.76 127.25 2dbm s ALA 64 Ca 0.00 1.30 -0.16 0.00 0.00 0.00 0.00 51.96 53.11 2dbm s ALA 64 Cb -0.16 -3.67 -0.03 0.00 0.00 0.00 0.00 23.12 19.26 2dbm s ALA 64 CO -0.06 -0.96 0.54 1.28 0.00 0.00 0.00 175.76 176.56 2dbm n LEU 65 N 4.86 0.87 0.28 0.00 4.77 -1.26 -4.87 117.00 121.64 2dbm n LEU 65 Ca 0.15 0.57 0.17 0.00 -0.03 0.00 0.00 56.01 56.87 2dbm n LEU 65 Cb 0.39 -1.23 0.70 0.00 -2.33 0.00 0.00 43.42 40.96 2dbm n LEU 65 CO 0.62 -3.11 1.00 1.55 -1.33 0.00 0.00 177.39 176.12 2dbm h PRO 66 N -0.50 0.00 -6.08 3.23 0.13 -1.99 -3.45 132.00 123.33 2dbm h PRO 66 Ca -0.45 0.00 -0.71 0.00 -0.87 0.00 0.00 66.00 63.96 2dbm h PRO 66 Cb 1.34 0.00 0.08 0.00 0.13 0.00 0.00 31.00 32.55 2dbm h PRO 66 CO 0.42 0.01 -0.10 1.58 -0.23 0.00 0.00 178.00 179.68 2dbm n HIS 67 N -3.11 0.40 -4.31 1.56 -0.00 -1.26 -4.96 115.22 103.54 2dbm n HIS 67 Ca 0.00 0.93 -0.24 0.00 0.46 0.00 0.00 57.72 58.88 2dbm n HIS 67 Cb 0.30 -2.09 -0.08 0.00 -0.12 0.00 0.00 29.99 28.00 2dbm n HIS 67 CO 0.00 0.00 0.00 -1.12 0.46 0.00 0.00 176.34 175.68 2dbm s SER 68 N -0.36 4.32 0.00 0.26 0.01 -1.26 -5.08 113.70 111.58 2dbm s SER 68 Ca 0.77 -0.82 0.00 0.00 1.31 0.00 0.00 55.95 57.21 2dbm s SER 68 Cb -1.04 -0.66 0.00 0.00 0.21 0.00 0.00 66.02 64.52 2dbm s SER 68 CO 0.56 -0.10 0.00 0.61 0.41 0.00 0.00 173.24 174.72 2dbm n GLY 69 N -0.91 0.64 3.76 3.44 0.00 -1.26 -5.07 105.19 105.79 2dbm n GLY 69 Ca -0.05 -2.12 -0.41 0.00 0.00 0.00 0.00 46.02 43.44 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 -0.92 4.45 0.17 1.61 0.04 -1.26 -5.03 135.00 134.06 2dbm s PRO 70 Ca 0.00 2.05 -0.23 0.00 0.04 0.00 0.00 61.00 62.86 2dbm s PRO 70 Cb 0.00 -3.14 0.07 0.00 0.04 0.00 0.00 34.50 31.47 2dbm s PRO 70 CO 0.00 -0.09 0.61 -1.54 0.04 0.00 0.00 177.00 176.02 2dbm s SER 71 N -0.36 -0.55 -0.66 6.66 1.04 -1.26 -5.09 113.70 113.48 2dbm s SER 71 Ca 0.50 -0.04 -0.36 0.00 0.48 0.00 0.00 55.95 56.53 2dbm s SER 71 Cb -0.37 0.61 -0.19 0.00 0.10 0.00 0.00 66.02 66.17 2dbm s SER 71 CO 0.45 -1.00 2.21 -0.24 0.98 0.00 0.00 173.24 175.65 2dbm n SER 72 N -0.39 0.51 0.00 7.02 2.88 -1.26 -5.31 113.62 117.08 2dbm n SER 72 Ca -0.16 0.43 0.00 0.00 -1.33 0.00 0.00 58.87 57.81 2dbm n SER 72 Cb 0.65 -0.84 0.00 0.00 -0.75 0.00 0.00 64.21 63.26 2dbm n SER 72 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42