#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ebz s GLN 2 N 0.00 1.66 -0.34 0.54 0.74 -1.26 -5.11 119.66 115.89 3ebz s GLN 2 Ca 0.00 -0.38 -0.11 0.00 0.05 0.00 0.00 55.36 54.93 3ebz s GLN 2 Cb 0.00 -1.45 0.00 0.00 1.10 0.00 0.00 33.01 32.67 3ebz s GLN 2 CO 0.00 -0.04 0.19 -0.06 -0.55 0.00 0.00 175.29 174.82 3ebz s PHE 3 N 0.91 3.21 -1.49 1.67 0.40 -1.26 -4.98 117.98 116.43 3ebz s PHE 3 Ca -0.10 -0.64 0.30 0.00 -0.60 0.00 0.00 56.93 55.89 3ebz s PHE 3 Cb -0.15 -2.41 1.49 0.00 0.51 0.00 0.00 43.02 42.46 3ebz s PHE 3 CO 0.01 -0.51 2.03 -1.13 0.70 0.00 0.00 175.22 176.32 3ebz n SER 4 N 5.01 0.08 0.00 1.36 3.41 -1.26 -4.92 113.62 117.30 3ebz n SER 4 Ca -0.13 -0.26 0.00 0.00 -0.26 0.00 0.00 58.87 58.22 3ebz n SER 4 Cb 0.48 -0.23 0.00 0.00 -0.26 0.00 0.00 64.21 64.20 3ebz n SER 4 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3ebz n LEU 5 N -1.22 0.50 0.20 1.04 4.77 -1.26 -4.84 117.00 116.20 3ebz n LEU 5 Ca 0.15 0.00 0.05 0.00 -0.03 0.00 0.00 56.01 56.18 3ebz n LEU 5 Cb 0.24 -1.38 0.40 0.00 -2.33 0.00 0.00 43.42 40.35 3ebz n LEU 5 CO 0.23 -0.46 0.73 -0.50 -1.33 0.00 0.00 177.39 176.06 3ebz h TRP 6 N 0.00 0.00 -2.08 -1.77 4.06 -2.03 -3.44 115.95 110.70 3ebz h TRP 6 Ca 0.00 0.00 -0.60 0.00 2.06 0.00 0.00 58.89 60.35 3ebz h TRP 6 Cb 0.42 0.00 -0.12 0.00 -1.00 0.00 0.00 29.16 28.45 3ebz h TRP 6 CO 0.26 0.35 -0.69 -1.59 -3.56 0.00 0.00 178.44 173.21 3ebz s LYS 7 N -3.90 1.89 0.25 0.49 -2.85 -1.26 -5.10 119.74 109.27 3ebz s LYS 7 Ca -0.01 -1.75 -0.31 0.00 -1.00 0.00 0.00 55.97 52.89 3ebz s LYS 7 Cb 0.13 -1.85 -0.12 0.00 -2.06 0.00 0.00 37.83 33.93 3ebz s LYS 7 CO 0.69 0.24 1.64 1.03 0.10 0.00 0.00 175.35 179.05 3ebz s ARG 8 N -3.61 4.13 -1.10 1.78 0.52 -1.26 -4.89 118.95 114.52 3ebz s ARG 8 Ca 0.32 2.58 -0.22 0.00 -0.52 0.00 0.00 55.73 57.89 3ebz s ARG 8 Cb -0.02 -3.05 0.04 0.00 0.52 0.00 0.00 34.95 32.44 3ebz s ARG 8 CO 0.17 -0.68 1.60 -1.25 0.02 0.00 0.00 175.30 175.16 3ebz s PRO 9 N 0.23 3.57 -0.11 3.54 0.04 -1.26 -4.93 135.00 136.07 3ebz s PRO 9 Ca 0.68 -1.31 0.02 0.00 0.04 0.00 0.00 61.00 60.44 3ebz s PRO 9 Cb -0.48 -5.38 -0.00 0.00 0.04 0.00 0.00 34.50 28.67 3ebz s PRO 9 CO 0.41 -2.40 -0.20 0.08 0.04 0.00 0.00 177.00 174.93 3ebz s VAL 10 N 5.46 2.41 0.26 -0.36 1.01 -1.26 -0.95 120.40 126.98 3ebz s VAL 10 Ca 0.51 -0.89 0.03 0.00 0.00 0.00 0.00 61.98 61.64 3ebz s VAL 10 Cb 0.01 -1.96 -0.06 0.00 0.00 0.00 0.00 36.38 34.37 3ebz s VAL 10 CO -0.03 0.55 0.03 0.68 0.00 0.00 0.00 175.10 176.32 3ebz s VAL 11 N 0.36 1.03 -0.15 2.92 -7.23 -0.51 -4.95 120.40 111.86 3ebz s VAL 11 Ca -0.16 -2.02 -0.15 0.00 -1.81 0.00 0.00 61.98 57.84 3ebz s VAL 11 Cb -0.17 -2.51 -0.05 0.00 0.56 0.00 0.00 36.38 34.21 3ebz s VAL 11 CO 0.07 -0.19 0.33 -0.89 -0.31 0.00 0.00 175.10 174.11 3ebz s THR 12 N -3.42 5.29 0.28 5.32 2.01 -1.26 -0.96 115.64 122.89 3ebz s THR 12 Ca 0.32 0.62 0.12 0.00 0.31 0.00 0.00 61.69 63.06 3ebz s THR 12 Cb 0.07 -3.67 -0.05 0.00 0.01 0.00 0.00 72.50 68.86 3ebz s THR 12 CO 0.11 0.37 -0.18 0.00 -0.69 0.00 0.00 174.62 174.24 3ebz s ALA 13 N 0.52 2.79 -0.19 7.40 0.00 0.42 -4.55 121.76 128.15 3ebz s ALA 13 Ca 0.18 -1.88 0.00 0.00 0.00 0.00 0.00 51.96 50.26 3ebz s ALA 13 Cb -0.13 -0.27 0.02 0.00 0.00 0.00 0.00 23.12 22.73 3ebz s ALA 13 CO 0.05 0.26 -0.17 0.71 0.00 0.00 0.00 175.76 176.61 3ebz s TYR 14 N -2.51 2.82 -0.27 0.00 1.51 -0.09 -0.47 117.35 118.34 3ebz s TYR 14 Ca 0.30 -1.55 -0.04 0.00 -1.01 0.00 0.00 57.07 54.77 3ebz s TYR 14 Cb -0.04 -1.95 0.02 0.00 -0.11 0.00 0.00 41.96 39.87 3ebz s TYR 14 CO 0.15 -0.77 -0.01 0.42 -1.11 0.00 0.00 175.55 174.24 3ebz s ILE 15 N 1.32 3.30 -1.46 2.71 1.01 -0.11 -1.16 121.20 126.81 3ebz s ILE 15 Ca 0.05 -0.90 -0.12 0.00 0.00 0.00 0.00 60.65 59.68 3ebz s ILE 15 Cb -0.13 -2.69 0.08 0.00 0.01 0.00 0.00 42.46 39.73 3ebz s ILE 15 CO -0.11 0.15 0.72 -0.62 0.00 0.00 0.00 174.94 175.08 3ebz n GLU 16 N 4.74 -4.32 0.00 2.79 1.02 -0.54 -0.93 120.64 123.40 3ebz n GLU 16 Ca -0.16 0.55 0.00 0.00 -0.02 0.00 0.00 57.16 57.54 3ebz n GLU 16 Cb 0.47 -5.35 0.00 0.00 -0.02 0.00 0.00 31.44 26.54 3ebz n GLU 16 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3ebz n GLY 17 N -1.43 2.11 3.75 0.62 0.00 -1.26 -5.03 105.19 103.96 3ebz n GLY 17 Ca 0.01 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.67 3ebz n GLY 17 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3ebz s GLN 18 N -0.34 4.12 0.18 1.61 -0.21 -0.11 -4.94 119.66 119.96 3ebz s GLN 18 Ca 0.00 -0.03 -0.30 0.00 0.02 0.00 0.00 55.36 55.05 3ebz s GLN 18 Cb 0.00 -3.38 -0.08 0.00 1.00 0.00 0.00 33.01 30.55 3ebz s GLN 18 CO 0.00 0.35 1.15 -1.25 -2.12 0.00 0.00 175.29 173.42 3ebz s PRO 19 N 0.17 4.54 -0.00 2.91 0.04 -1.26 -0.93 135.00 140.46 3ebz s PRO 19 Ca 0.13 1.80 -0.03 0.00 0.04 0.00 0.00 61.00 62.95 3ebz s PRO 19 Cb -0.12 -3.26 -0.00 0.00 0.04 0.00 0.00 34.50 31.16 3ebz s PRO 19 CO 0.02 -0.02 0.06 0.14 0.04 0.00 0.00 177.00 177.24 3ebz s VAL 20 N -0.14 0.06 0.05 -0.36 -7.23 0.38 -4.96 120.40 108.20 3ebz s VAL 20 Ca 0.51 -0.48 -0.20 0.00 -1.81 0.00 0.00 61.98 60.00 3ebz s VAL 20 Cb -0.31 -0.24 -0.06 0.00 0.56 0.00 0.00 36.38 36.32 3ebz s VAL 20 CO 0.36 -0.26 0.59 -1.61 -0.31 0.00 0.00 175.10 173.86 3ebz s GLU 21 N -0.83 4.26 0.04 4.82 0.41 -1.26 -0.44 118.70 125.70 3ebz s GLU 21 Ca -0.09 0.75 0.03 0.00 -0.41 0.00 0.00 54.97 55.25 3ebz s GLU 21 Cb -0.05 -3.28 -0.02 0.00 -1.78 0.00 0.00 34.13 29.00 3ebz s GLU 21 CO 0.00 0.54 -0.09 0.14 -0.49 0.00 0.00 175.26 175.35 3ebz s VAL 22 N -0.77 0.71 -0.18 2.63 -7.23 -0.14 -4.46 120.40 110.96 3ebz s VAL 22 Ca 0.30 -0.97 -0.15 0.00 -1.81 0.00 0.00 61.98 59.35 3ebz s VAL 22 Cb -0.19 -0.71 -0.04 0.00 0.56 0.00 0.00 36.38 36.00 3ebz s VAL 22 CO 0.19 -0.21 0.37 -0.22 -0.31 0.00 0.00 175.10 174.92 3ebz s LEU 23 N -1.30 4.20 -0.53 1.32 2.96 0.29 -1.43 118.68 124.20 3ebz s LEU 23 Ca -0.05 0.55 -0.26 0.00 -0.22 0.00 0.00 54.13 54.15 3ebz s LEU 23 Cb -0.08 -2.49 0.03 0.00 0.50 0.00 0.00 46.19 44.15 3ebz s LEU 23 CO 0.01 -0.01 1.02 -0.76 -1.32 0.00 0.00 176.35 175.29 3ebz s LEU 24 N 0.94 3.87 -0.31 -0.68 1.43 -0.13 -1.13 118.68 122.67 3ebz s LEU 24 Ca 0.19 -0.04 0.02 0.00 -1.03 0.00 0.00 54.13 53.28 3ebz s LEU 24 Cb -0.14 -3.08 0.09 0.00 0.03 0.00 0.00 46.19 43.09 3ebz s LEU 24 CO 0.07 -1.25 0.04 -0.62 0.23 0.00 0.00 176.35 174.82 3ebz s ASP 25 N 2.68 4.41 0.46 2.29 -1.08 -0.20 -4.78 116.67 120.45 3ebz s ASP 25 Ca 0.37 -1.82 0.31 0.00 -0.52 0.00 0.00 52.55 50.89 3ebz s ASP 25 Cb -0.10 -1.35 1.42 0.00 -1.46 0.00 0.00 42.92 41.43 3ebz s ASP 25 CO 0.24 -0.36 1.94 0.71 0.52 0.00 0.00 175.17 178.22 3ebz h THR 26 N 6.60 0.00 -0.04 1.71 1.35 -1.94 -2.85 112.91 117.74 3ebz h THR 26 Ca -0.10 -0.28 0.00 0.00 -0.55 0.00 0.00 66.41 65.48 3ebz h THR 26 Cb 1.03 1.15 0.00 0.00 -1.73 0.00 0.00 68.15 68.59 3ebz h THR 26 CO 0.49 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 176.37 3ebz n GLY 27 N -0.32 -0.42 3.39 5.82 0.00 -1.26 -4.79 105.19 107.62 3ebz n GLY 27 Ca 0.00 -0.30 -0.34 0.00 0.00 0.00 0.00 46.02 45.38 3ebz n GLY 27 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3ebz s ALA 28 N -1.95 2.87 0.19 4.61 0.00 -1.07 -5.01 121.76 121.40 3ebz s ALA 28 Ca 0.37 -1.01 -0.08 0.00 0.00 0.00 0.00 51.96 51.24 3ebz s ALA 28 Cb 0.19 -1.61 0.11 0.00 0.00 0.00 0.00 23.12 21.81 3ebz s ALA 28 CO 0.30 -0.12 1.66 -0.44 0.00 0.00 0.00 175.76 177.16 3ebz h ASP 29 N 7.45 1.03 -3.84 0.00 3.32 -1.87 0.07 116.42 122.58 3ebz h ASP 29 Ca -0.35 -0.28 -0.50 0.00 0.02 0.00 0.00 57.03 55.91 3ebz h ASP 29 Cb 1.18 -0.28 -0.13 0.00 0.22 0.00 0.00 39.33 40.32 3ebz h ASP 29 CO 0.60 1.07 -0.53 -1.81 -1.72 0.00 0.00 179.24 176.85 3ebz s ASP 30 N -6.57 2.31 -0.06 6.45 1.01 -1.26 -2.35 116.67 116.19 3ebz s ASP 30 Ca -0.11 -1.63 0.02 0.00 0.71 0.00 0.00 52.55 51.54 3ebz s ASP 30 Cb 0.14 0.43 -0.03 0.00 1.01 0.00 0.00 42.92 44.47 3ebz s ASP 30 CO 0.85 -0.90 -0.11 -0.44 0.21 0.00 0.00 175.17 174.78 3ebz s SER 31 N -3.51 4.30 -0.03 0.27 0.01 -1.26 -3.44 113.70 110.03 3ebz s SER 31 Ca 0.30 -0.13 -0.01 0.00 1.31 0.00 0.00 55.95 57.42 3ebz s SER 31 Cb 0.04 -1.02 0.03 0.00 0.21 0.00 0.00 66.02 65.28 3ebz s SER 31 CO 0.17 0.34 0.06 -0.63 0.41 0.00 0.00 173.24 173.59 3ebz s ILE 32 N -0.71 -0.07 0.04 1.44 1.01 -0.46 -0.74 121.20 121.70 3ebz s ILE 32 Ca 0.11 0.24 0.03 0.00 0.00 0.00 0.00 60.65 61.03 3ebz s ILE 32 Cb -0.11 -0.12 -0.02 0.00 0.01 0.00 0.00 42.46 42.22 3ebz s ILE 32 CO 0.01 0.10 -0.09 0.68 0.00 0.00 0.00 174.94 175.64 3ebz s VAL 33 N 1.25 0.69 0.28 2.92 -7.23 -0.13 -0.44 120.40 117.74 3ebz s VAL 33 Ca -0.07 -0.92 0.08 0.00 -1.81 0.00 0.00 61.98 59.26 3ebz s VAL 33 Cb -0.13 -0.68 -0.04 0.00 0.56 0.00 0.00 36.38 36.09 3ebz s VAL 33 CO -0.04 -0.19 0.15 0.00 -0.31 0.00 0.00 175.10 174.71 3ebz s ALA 34 N -1.02 3.49 0.00 1.32 0.00 -1.25 -2.38 121.76 121.92 3ebz s ALA 34 Ca -0.05 -1.56 0.00 0.00 0.00 0.00 0.00 51.96 50.35 3ebz s ALA 34 Cb -0.08 -1.07 0.00 0.00 0.00 0.00 0.00 23.12 21.97 3ebz s ALA 34 CO 0.01 0.20 0.00 0.41 0.00 0.00 0.00 175.76 176.37 3ebz n GLY 35 N -1.12 0.94 3.19 0.00 0.00 -1.26 -5.00 105.19 101.93 3ebz n GLY 35 Ca -0.06 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.66 3ebz n GLY 35 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 3ebz s ILE 36 N -3.34 1.86 -0.25 -0.61 -4.36 -1.26 -5.10 121.20 108.13 3ebz s ILE 36 Ca 0.00 -0.91 -0.19 0.00 -0.26 0.00 0.00 60.65 59.28 3ebz s ILE 36 Cb 0.00 -1.61 -0.02 0.00 1.25 0.00 0.00 42.46 42.08 3ebz s ILE 36 CO 0.00 0.52 0.59 -0.70 0.24 0.00 0.00 174.94 175.58 3ebz s GLU 37 N 0.32 4.11 0.00 0.37 2.56 -1.26 -4.95 118.70 119.85 3ebz s GLU 37 Ca -0.16 0.47 0.08 0.00 0.00 0.00 0.00 54.97 55.37 3ebz s GLU 37 Cb -0.17 -3.64 0.04 0.00 2.00 0.00 0.00 34.13 32.36 3ebz s GLU 37 CO 0.07 -0.37 0.70 1.28 -0.56 0.00 0.00 175.26 176.38 3ebz n LEU 38 N 5.58 1.51 0.00 2.70 4.77 -1.26 -5.12 117.00 125.18 3ebz n LEU 38 Ca -0.02 -0.92 0.00 0.00 -0.03 0.00 0.00 56.01 55.04 3ebz n LEU 38 Cb 0.49 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.58 3ebz n LEU 38 CO 0.42 0.30 0.00 0.61 -1.33 0.00 0.00 177.39 177.39 3ebz n GLY 39 N 0.59 -0.69 0.32 -0.72 0.00 -1.26 -4.72 105.19 98.71 3ebz n GLY 39 Ca 0.04 -2.16 0.12 0.00 0.00 0.00 0.00 46.02 44.02 3ebz n GLY 39 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3ebz n ASN 40 N 0.00 1.46 -4.24 1.61 3.02 -1.26 -4.71 115.26 111.14 3ebz n ASN 40 Ca 0.00 -1.15 -0.43 0.00 -0.03 0.00 0.00 54.58 52.97 3ebz n ASN 40 Cb 0.00 0.40 -0.04 0.00 -0.61 0.00 0.00 39.78 39.53 3ebz n ASN 40 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 3ebz s ASN 41 N -2.58 6.41 0.26 6.41 0.01 -1.26 -4.99 114.94 119.20 3ebz s ASN 41 Ca 0.19 -3.07 0.02 0.00 -0.71 0.00 0.00 52.86 49.28 3ebz s ASN 41 Cb 0.18 -2.08 -0.03 0.00 0.41 0.00 0.00 41.25 39.73 3ebz s ASN 41 CO 0.60 -0.41 0.22 -0.72 -1.51 0.00 0.00 177.10 175.27 3ebz s TYR 42 N -0.41 1.36 -0.09 2.20 -0.85 -1.26 -4.72 117.35 113.58 3ebz s TYR 42 Ca 0.22 -1.47 0.01 0.00 -0.52 0.00 0.00 57.07 55.32 3ebz s TYR 42 Cb -0.12 -0.57 0.02 0.00 0.38 0.00 0.00 41.96 41.67 3ebz s TYR 42 CO -0.08 -0.77 -0.13 0.45 -1.52 0.00 0.00 175.55 173.51 3ebz s SER 43 N -3.24 2.16 0.22 -0.18 0.15 -0.42 -4.90 113.70 107.49 3ebz s SER 43 Ca 0.39 -0.36 -0.30 0.00 0.70 0.00 0.00 55.95 56.38 3ebz s SER 43 Cb 0.05 -0.95 -0.08 0.00 -1.71 0.00 0.00 66.02 63.32 3ebz s SER 43 CO 0.18 -0.00 1.10 -2.16 1.20 0.00 0.00 173.24 173.56 3ebz s PRO 44 N 1.01 4.62 0.07 5.44 0.04 -1.26 -0.22 135.00 144.70 3ebz s PRO 44 Ca -0.07 1.74 -0.11 0.00 0.04 0.00 0.00 61.00 62.60 3ebz s PRO 44 Cb -0.15 -3.24 0.01 0.00 0.04 0.00 0.00 34.50 31.16 3ebz s PRO 44 CO -0.01 0.14 0.25 -1.59 0.04 0.00 0.00 177.00 175.83 3ebz s LYS 45 N -0.79 0.83 -0.10 4.56 -2.85 -0.63 -4.93 119.74 115.83 3ebz s LYS 45 Ca 0.47 -0.72 0.01 0.00 -1.00 0.00 0.00 55.97 54.73 3ebz s LYS 45 Cb -0.30 0.35 -0.02 0.00 -2.06 0.00 0.00 37.83 35.80 3ebz s LYS 45 CO 0.37 -0.27 -0.12 0.42 0.10 0.00 0.00 175.35 175.85 3ebz s ILE 46 N -3.19 3.20 0.11 3.79 1.01 -1.26 0.07 121.20 124.93 3ebz s ILE 46 Ca -0.00 -0.63 0.11 0.00 0.00 0.00 0.00 60.65 60.12 3ebz s ILE 46 Cb 0.02 -2.32 -0.04 0.00 0.01 0.00 0.00 42.46 40.13 3ebz s ILE 46 CO -0.07 0.55 -0.27 0.68 0.00 0.00 0.00 174.94 175.83 3ebz s VAL 47 N -0.12 2.22 0.07 2.92 -7.23 -0.56 -4.98 120.40 112.72 3ebz s VAL 47 Ca -0.01 -1.66 0.09 0.00 -1.81 0.00 0.00 61.98 58.59 3ebz s VAL 47 Cb -0.14 -1.95 -0.03 0.00 0.56 0.00 0.00 36.38 34.82 3ebz s VAL 47 CO 0.03 0.16 -0.26 -0.83 -0.31 0.00 0.00 175.10 173.89 3ebz s GLY 48 N -1.85 1.41 0.00 2.32 0.00 -1.26 -0.92 107.32 107.02 3ebz s GLY 48 Ca 0.13 -1.30 0.00 0.00 0.00 0.00 0.00 44.72 43.55 3ebz s GLY 48 CO 0.05 -1.23 0.00 0.61 0.00 0.00 0.00 173.10 172.53 3ebz n GLY 49 N 1.49 3.35 3.72 0.20 0.00 -0.04 -5.00 105.19 108.92 3ebz n GLY 49 Ca -0.17 -0.65 -0.42 0.00 0.00 0.00 0.00 46.02 44.77 3ebz n GLY 49 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3ebz s ILE 50 N -1.84 2.88 0.00 -0.61 1.01 -1.26 -2.42 121.20 118.96 3ebz s ILE 50 Ca 0.00 0.64 0.00 0.00 0.00 0.00 0.00 60.65 61.29 3ebz s ILE 50 Cb 0.00 -3.41 0.00 0.00 0.01 0.00 0.00 42.46 39.06 3ebz s ILE 50 CO 0.00 0.05 0.00 0.61 0.00 0.00 0.00 174.94 175.60 3ebz n GLY 51 N 3.59 1.23 0.00 6.18 0.00 -1.26 -4.91 105.19 110.02 3ebz n GLY 51 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 3ebz n GLY 51 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3ebz n GLY 52 N -2.00 0.41 3.14 -0.02 0.00 -1.02 -5.11 105.19 100.60 3ebz n GLY 52 Ca 0.00 -1.34 -0.13 0.00 0.00 0.00 0.00 46.02 44.55 3ebz n GLY 52 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3ebz s PHE 53 N -2.55 0.90 0.02 1.61 0.08 -1.26 -0.86 117.98 115.92 3ebz s PHE 53 Ca 0.00 -0.71 0.01 0.00 0.12 0.00 0.00 56.93 56.35 3ebz s PHE 53 Cb 0.00 -0.51 -0.02 0.00 -0.57 0.00 0.00 43.02 41.92 3ebz s PHE 53 CO 0.00 -0.08 -0.05 0.96 -0.10 0.00 0.00 175.22 175.95 3ebz s ILE 54 N -2.61 0.32 0.24 0.64 -4.36 -0.10 -4.99 121.20 110.34 3ebz s ILE 54 Ca 0.04 -0.70 -0.30 0.00 -0.26 0.00 0.00 60.65 59.43 3ebz s ILE 54 Cb -0.02 -0.37 -0.09 0.00 1.25 0.00 0.00 42.46 43.23 3ebz s ILE 54 CO -0.02 -0.26 1.29 0.20 0.24 0.00 0.00 174.94 176.40 3ebz s ASN 55 N -1.02 6.90 0.22 4.36 0.01 -1.26 -1.50 114.94 122.65 3ebz s ASN 55 Ca -0.08 2.47 0.02 0.00 -0.71 0.00 0.00 52.86 54.56 3ebz s ASN 55 Cb -0.07 -2.62 -0.05 0.00 0.41 0.00 0.00 41.25 38.92 3ebz s ASN 55 CO -0.00 -0.49 0.04 0.42 -1.51 0.00 0.00 177.10 175.56 3ebz s THR 56 N -0.35 0.70 -0.18 1.60 -4.23 0.11 -4.36 115.64 108.93 3ebz s THR 56 Ca 0.53 -2.00 -0.00 0.00 -1.18 0.00 0.00 61.69 59.04 3ebz s THR 56 Cb -0.37 -2.40 0.01 0.00 1.34 0.00 0.00 72.50 71.07 3ebz s THR 56 CO 0.42 -0.23 -0.15 -0.54 -0.54 0.00 0.00 174.62 173.58 3ebz s LYS 57 N -3.96 3.15 -0.21 3.99 1.02 0.48 -1.61 119.74 122.60 3ebz s LYS 57 Ca 0.31 -0.76 -0.13 0.00 0.02 0.00 0.00 55.97 55.41 3ebz s LYS 57 Cb 0.07 -2.68 -0.04 0.00 -0.52 0.00 0.00 37.83 34.66 3ebz s LYS 57 CO 0.09 -0.12 0.29 -2.00 -0.92 0.00 0.00 175.35 172.69 3ebz s GLU 58 N 1.15 4.14 -0.09 1.68 2.12 0.70 -0.80 118.70 127.59 3ebz s GLU 58 Ca 0.01 -0.00 0.00 0.00 0.36 0.00 0.00 54.97 55.34 3ebz s GLU 58 Cb -0.14 -3.53 -0.02 0.00 0.26 0.00 0.00 34.13 30.70 3ebz s GLU 58 CO -0.06 0.03 -0.09 0.71 -0.54 0.00 0.00 175.26 175.30 3ebz s TYR 59 N 1.14 2.87 0.17 5.30 1.51 0.07 -1.30 117.35 127.11 3ebz s TYR 59 Ca 0.14 -0.24 0.02 0.00 -1.01 0.00 0.00 57.07 55.98 3ebz s TYR 59 Cb -0.14 -1.77 -0.04 0.00 -0.11 0.00 0.00 41.96 39.90 3ebz s TYR 59 CO 0.06 0.10 0.32 0.15 -1.11 0.00 0.00 175.55 175.07 3ebz s LYS 60 N -0.29 3.46 -1.21 -0.62 1.02 -1.26 -1.28 119.74 119.55 3ebz s LYS 60 Ca 0.03 -0.52 -0.01 0.00 0.02 0.00 0.00 55.97 55.49 3ebz s LYS 60 Cb -0.13 -2.92 -0.01 0.00 -0.52 0.00 0.00 37.83 34.25 3ebz s LYS 60 CO 0.03 0.48 0.91 0.09 -0.92 0.00 0.00 175.35 175.94 3ebz n ASN 61 N -0.61 -2.28 -4.78 2.83 3.02 -1.20 -4.92 115.26 107.32 3ebz n ASN 61 Ca -0.06 -0.68 -0.38 0.00 -0.03 0.00 0.00 54.58 53.43 3ebz n ASN 61 Cb 0.54 -4.84 -0.06 0.00 -0.61 0.00 0.00 39.78 34.81 3ebz n ASN 61 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3ebz s VAL 62 N -3.44 5.15 -0.09 2.41 1.01 0.48 -4.70 120.40 121.22 3ebz s VAL 62 Ca 0.05 0.80 -0.30 0.00 0.00 0.00 0.00 61.98 62.53 3ebz s VAL 62 Cb -0.01 -3.72 -0.04 0.00 0.00 0.00 0.00 36.38 32.62 3ebz s VAL 62 CO 0.75 0.47 1.40 -0.70 0.00 0.00 0.00 175.10 177.02 3ebz s GLU 63 N -0.25 4.24 -0.04 2.72 2.12 -1.26 -0.89 118.70 125.34 3ebz s GLU 63 Ca 0.23 1.88 0.03 0.00 0.36 0.00 0.00 54.97 57.47 3ebz s GLU 63 Cb -0.15 -3.76 0.00 0.00 0.26 0.00 0.00 34.13 30.48 3ebz s GLU 63 CO 0.10 -0.69 -0.13 0.42 -0.54 0.00 0.00 175.26 174.42 3ebz s ILE 64 N 3.26 1.13 -0.16 -3.70 1.09 0.47 -1.47 121.20 121.83 3ebz s ILE 64 Ca 0.62 -0.53 0.01 0.00 -1.10 0.00 0.00 60.65 59.66 3ebz s ILE 64 Cb -0.27 -1.00 0.02 0.00 -1.06 0.00 0.00 42.46 40.14 3ebz s ILE 64 CO 0.22 0.34 -0.19 -1.61 -0.10 0.00 0.00 174.94 173.60 3ebz s GLU 65 N 0.29 2.78 -0.12 2.79 2.02 -0.31 -0.59 118.70 125.56 3ebz s GLU 65 Ca -0.07 -0.76 -0.27 0.00 0.02 0.00 0.00 54.97 53.89 3ebz s GLU 65 Cb -0.12 -2.38 0.07 0.00 0.10 0.00 0.00 34.13 31.80 3ebz s GLU 65 CO 0.02 -0.15 0.65 0.54 0.02 0.00 0.00 175.26 176.34 3ebz s VAL 66 N 1.18 0.00 -1.53 2.63 0.11 -0.09 -0.92 120.40 121.78 3ebz s VAL 66 Ca 0.01 -0.03 -0.09 0.00 -2.93 0.00 0.00 61.98 58.93 3ebz s VAL 66 Cb -0.14 -0.95 0.07 0.00 -1.53 0.00 0.00 36.38 33.83 3ebz s VAL 66 CO -0.09 -0.02 0.67 0.18 -3.33 0.00 0.00 175.10 172.51 3ebz n LEU 67 N 1.57 -2.13 -1.82 2.54 4.77 -1.26 -0.82 117.00 119.85 3ebz n LEU 67 Ca -0.17 -0.96 -0.18 0.00 -0.03 0.00 0.00 56.01 54.66 3ebz n LEU 67 Cb 0.56 -2.25 -0.06 0.00 -2.33 0.00 0.00 43.42 39.34 3ebz n LEU 67 CO 0.17 0.39 -0.20 0.59 -1.33 0.00 0.00 177.39 177.01 3ebz n ASN 68 N -2.84 -5.02 -4.33 -1.43 3.02 -1.26 -4.99 115.26 98.41 3ebz n ASN 68 Ca -0.11 0.32 -0.24 0.00 -0.03 0.00 0.00 54.58 54.53 3ebz n ASN 68 Cb 0.59 -4.39 -0.12 0.00 -0.61 0.00 0.00 39.78 35.24 3ebz n ASN 68 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 3ebz s LYS 69 N -4.04 1.26 -0.12 3.52 1.02 0.00 -5.13 119.74 116.26 3ebz s LYS 69 Ca 0.00 -1.32 0.02 0.00 0.02 0.00 0.00 55.97 54.68 3ebz s LYS 69 Cb 0.00 -1.49 -0.01 0.00 -0.52 0.00 0.00 37.83 35.81 3ebz s LYS 69 CO 0.00 0.33 -0.18 0.21 -0.92 0.00 0.00 175.35 174.79 3ebz s LYS 70 N -2.35 3.22 0.16 1.68 2.20 -1.26 -0.92 119.74 122.47 3ebz s LYS 70 Ca 0.13 -0.78 -0.00 0.00 -0.36 0.00 0.00 55.97 54.96 3ebz s LYS 70 Cb -0.08 -2.48 -0.04 0.00 -1.51 0.00 0.00 37.83 33.71 3ebz s LYS 70 CO 0.06 0.18 0.05 0.14 -0.36 0.00 0.00 175.35 175.42 3ebz s VAL 71 N 0.39 0.30 -0.16 4.02 -7.23 0.25 -4.99 120.40 112.97 3ebz s VAL 71 Ca -0.14 -1.95 -0.00 0.00 -1.81 0.00 0.00 61.98 58.08 3ebz s VAL 71 Cb -0.17 -2.16 -0.01 0.00 0.56 0.00 0.00 36.38 34.60 3ebz s VAL 71 CO 0.07 -0.38 -0.14 -0.13 -0.31 0.00 0.00 175.10 174.21 3ebz s ARG 72 N -4.02 3.27 0.21 4.82 0.52 -1.26 -0.39 118.95 122.10 3ebz s ARG 72 Ca 0.27 -0.72 -0.16 0.00 -0.52 0.00 0.00 55.73 54.60 3ebz s ARG 72 Cb 0.07 -2.67 0.02 0.00 0.52 0.00 0.00 34.95 32.89 3ebz s ARG 72 CO 0.04 0.04 0.50 0.00 0.02 0.00 0.00 175.30 175.90 3ebz s ALA 73 N 0.78 -0.72 0.02 2.13 0.00 -0.07 -4.78 121.76 119.13 3ebz s ALA 73 Ca -0.05 -0.43 -0.30 0.00 0.00 0.00 0.00 51.96 51.18 3ebz s ALA 73 Cb -0.15 0.89 -0.04 0.00 0.00 0.00 0.00 23.12 23.82 3ebz s ALA 73 CO 0.01 -0.82 1.02 0.99 0.00 0.00 0.00 175.76 176.96 3ebz s THR 74 N -3.92 4.66 -0.03 0.00 2.01 -1.26 -0.39 115.64 116.72 3ebz s THR 74 Ca 0.13 1.94 0.02 0.00 0.31 0.00 0.00 61.69 64.09 3ebz s THR 74 Cb -0.01 -4.24 0.01 0.00 0.01 0.00 0.00 72.50 68.26 3ebz s THR 74 CO 0.01 0.17 -0.07 -0.63 -0.69 0.00 0.00 174.62 173.40 3ebz s ILE 75 N 0.91 0.64 0.02 1.82 -1.09 -0.41 -4.53 121.20 118.57 3ebz s ILE 75 Ca 0.53 -0.27 -0.08 0.00 -2.23 0.00 0.00 60.65 58.59 3ebz s ILE 75 Cb -0.23 -0.59 -0.05 0.00 -1.58 0.00 0.00 42.46 40.01 3ebz s ILE 75 CO 0.29 0.21 0.31 -0.04 -1.23 0.00 0.00 174.94 174.48 3ebz s MET 76 N 0.30 3.65 0.07 2.79 -1.94 0.08 -0.75 119.30 123.51 3ebz s MET 76 Ca -0.04 0.03 0.05 0.00 -1.71 0.00 0.00 55.69 54.02 3ebz s MET 76 Cb -0.09 -3.07 -0.04 0.00 2.01 0.00 0.00 34.83 33.65 3ebz s MET 76 CO 0.00 0.63 -0.04 0.95 -0.01 0.00 0.00 175.02 176.55 3ebz s THR 77 N -1.30 3.75 0.00 2.05 -4.23 0.02 -0.95 115.64 114.97 3ebz s THR 77 Ca 0.28 -1.02 0.00 0.00 -1.18 0.00 0.00 61.69 59.78 3ebz s THR 77 Cb -0.14 -2.74 0.00 0.00 1.34 0.00 0.00 72.50 70.96 3ebz s THR 77 CO 0.16 0.18 0.00 0.61 -0.54 0.00 0.00 174.62 175.03 3ebz n GLY 78 N 0.84 -0.96 2.36 3.99 0.00 -1.00 -0.39 105.19 110.03 3ebz n GLY 78 Ca -0.13 -1.05 -0.39 0.00 0.00 0.00 0.00 46.02 44.45 3ebz n GLY 78 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3ebz n ASP 79 N 0.00 8.46 -4.80 1.61 2.03 -1.26 -3.94 116.55 118.65 3ebz n ASP 79 Ca 0.00 -2.67 -0.37 0.00 0.52 0.00 0.00 54.79 52.27 3ebz n ASP 79 Cb 0.00 -1.53 -0.06 0.00 -0.72 0.00 0.00 41.12 38.81 3ebz n ASP 79 CO 0.00 0.00 0.00 0.28 -1.92 0.00 0.00 177.20 175.56 3ebz s THR 80 N 1.69 4.42 -0.18 5.18 -1.32 -1.26 -4.95 115.64 119.22 3ebz s THR 80 Ca 0.66 1.54 0.29 0.00 -1.21 0.00 0.00 61.69 62.97 3ebz s THR 80 Cb 0.18 -3.97 0.35 0.00 -1.51 0.00 0.00 72.50 67.55 3ebz s THR 80 CO -0.07 0.27 1.84 1.55 -2.21 0.00 0.00 174.62 176.00 3ebz h PRO 81 N 3.59 0.00 -3.80 7.08 0.13 -1.98 -3.43 132.00 133.58 3ebz h PRO 81 Ca -0.47 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 64.50 3ebz h PRO 81 Cb 1.20 0.00 -0.21 0.00 0.13 0.00 0.00 31.00 32.12 3ebz h PRO 81 CO 0.65 0.00 -0.61 -1.50 -0.23 0.00 0.00 178.00 176.31 3ebz s ILE 82 N -3.46 0.10 -0.07 -3.56 2.07 -1.26 -5.11 121.20 109.91 3ebz s ILE 82 Ca 0.04 -0.86 -0.24 0.00 -1.41 0.00 0.00 60.65 58.18 3ebz s ILE 82 Cb 0.08 -0.39 -0.04 0.00 0.13 0.00 0.00 42.46 42.25 3ebz s ILE 82 CO 0.56 -0.47 0.72 0.20 -1.91 0.00 0.00 174.94 174.03 3ebz s ASN 83 N -1.51 7.00 -0.11 4.50 0.01 -1.26 -4.80 114.94 118.77 3ebz s ASN 83 Ca -0.14 1.20 0.02 0.00 -0.71 0.00 0.00 52.86 53.23 3ebz s ASN 83 Cb -0.08 -2.42 0.01 0.00 0.41 0.00 0.00 41.25 39.17 3ebz s ASN 83 CO -0.00 -0.14 -0.16 -0.63 -1.51 0.00 0.00 177.10 174.65 3ebz s ILE 84 N 0.88 1.60 -0.46 0.60 1.01 0.42 -0.55 121.20 124.70 3ebz s ILE 84 Ca 0.38 -0.71 -0.14 0.00 0.00 0.00 0.00 60.65 60.18 3ebz s ILE 84 Cb -0.18 -1.45 0.07 0.00 0.01 0.00 0.00 42.46 40.91 3ebz s ILE 84 CO 0.18 0.46 0.36 -0.36 0.00 0.00 0.00 174.94 175.59 3ebz s PHE 85 N 0.95 3.26 0.00 3.97 2.99 -0.28 -1.36 117.98 127.51 3ebz s PHE 85 Ca -0.07 -1.05 0.00 0.00 0.00 0.00 0.00 56.93 55.81 3ebz s PHE 85 Cb -0.15 -3.11 0.00 0.00 0.00 0.00 0.00 43.02 39.76 3ebz s PHE 85 CO -0.01 -0.81 0.00 0.41 -0.00 0.00 0.00 175.22 174.81 3ebz n GLY 86 N 5.14 0.60 0.27 4.36 0.00 -1.22 -1.04 105.19 113.31 3ebz n GLY 86 Ca -0.12 -1.92 0.11 0.00 0.00 0.00 0.00 46.02 44.09 3ebz n GLY 86 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3ebz h ARG 87 N 0.00 0.00 -0.42 1.61 3.08 -0.90 -0.76 114.38 116.99 3ebz h ARG 87 Ca 0.00 0.00 -0.03 0.00 0.07 0.00 0.00 59.98 60.02 3ebz h ARG 87 Cb 0.00 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.03 3ebz h ARG 87 CO 0.00 0.04 0.12 -2.95 -1.07 0.00 0.00 179.97 176.10 3ebz h ASN 88 N 0.00 0.56 0.17 7.04 -1.07 -1.73 -0.70 115.58 119.85 3ebz h ASN 88 Ca -0.00 -0.08 -0.28 0.00 0.07 0.00 0.00 56.30 56.01 3ebz h ASN 88 Cb 0.07 -0.14 0.02 0.00 -2.07 0.00 0.00 38.32 36.20 3ebz h ASN 88 CO 0.00 0.55 -1.33 0.40 0.07 0.00 0.00 177.43 177.12 3ebz h ILE 89 N 0.60 1.21 -0.78 6.14 2.04 -1.51 -3.19 117.51 122.01 3ebz h ILE 89 Ca 0.14 -2.54 0.05 0.00 1.00 0.00 0.00 64.86 63.51 3ebz h ILE 89 Cb 0.20 2.95 -0.05 0.00 -0.74 0.00 0.00 36.82 39.18 3ebz h ILE 89 CO -0.01 0.77 0.48 -0.07 0.00 0.00 0.00 178.15 179.32 3ebz h LEU 90 N -0.12 0.77 -1.00 1.44 3.38 -0.94 -1.06 115.31 117.77 3ebz h LEU 90 Ca -0.26 0.01 -0.07 0.00 0.09 0.00 0.00 57.88 57.65 3ebz h LEU 90 Cb 1.90 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 42.48 3ebz h LEU 90 CO 0.17 0.51 -0.08 0.71 0.09 0.00 0.00 178.44 179.84 3ebz h THR 91 N 0.91 1.24 0.00 0.22 1.35 -1.29 -0.81 112.91 114.53 3ebz h THR 91 Ca 0.33 -1.03 -0.05 0.00 -0.55 0.00 0.00 66.41 65.11 3ebz h THR 91 Cb 0.10 1.04 -0.01 0.00 -1.73 0.00 0.00 68.15 67.56 3ebz h THR 91 CO -0.15 0.35 -0.26 0.00 -0.25 0.00 0.00 175.52 175.21 3ebz h ALA 92 N 1.33 1.44 0.00 6.62 0.00 -1.26 -2.27 119.26 125.12 3ebz h ALA 92 Ca 0.11 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.78 3ebz h ALA 92 Cb 0.49 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.24 3ebz h ALA 92 CO 0.03 0.33 -0.28 1.28 0.00 0.00 0.00 179.25 180.60 3ebz n LEU 93 N -4.04 0.51 0.00 0.00 4.77 -0.51 -4.93 117.00 112.80 3ebz n LEU 93 Ca -0.02 0.34 0.00 0.00 -0.03 0.00 0.00 56.01 56.30 3ebz n LEU 93 Cb 0.33 -0.31 0.00 0.00 -2.33 0.00 0.00 43.42 41.10 3ebz n LEU 93 CO 0.36 -0.03 0.00 0.61 -1.33 0.00 0.00 177.39 177.00 3ebz n GLY 94 N 1.41 0.52 3.84 -0.72 0.00 -0.80 -5.06 105.19 104.36 3ebz n GLY 94 Ca 0.05 -0.85 -0.32 0.00 0.00 0.00 0.00 46.02 44.90 3ebz n GLY 94 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 3ebz s MET 95 N -3.13 4.05 0.06 1.61 0.00 -0.37 -5.02 119.30 116.50 3ebz s MET 95 Ca 0.00 0.92 0.01 0.00 0.00 0.00 0.00 55.69 56.62 3ebz s MET 95 Cb 0.00 -2.22 -0.04 0.00 0.00 0.00 0.00 34.83 32.57 3ebz s MET 95 CO 0.00 -0.09 -0.05 -1.54 0.00 0.00 0.00 175.02 173.34 3ebz s SER 96 N -2.61 0.76 -0.22 1.11 1.04 -1.26 -4.64 113.70 107.87 3ebz s SER 96 Ca 0.59 -0.87 -0.05 0.00 0.48 0.00 0.00 55.95 56.10 3ebz s SER 96 Cb -0.10 0.12 -0.02 0.00 0.10 0.00 0.00 66.02 66.13 3ebz s SER 96 CO 0.22 -0.45 0.00 -0.22 0.98 0.00 0.00 173.24 173.78 3ebz s LEU 97 N -2.57 3.17 0.02 2.42 2.96 -1.26 -5.09 118.68 118.33 3ebz s LEU 97 Ca 0.03 -0.27 0.06 0.00 -0.22 0.00 0.00 54.13 53.73 3ebz s LEU 97 Cb 0.02 -1.82 -0.02 0.00 0.50 0.00 0.00 46.19 44.87 3ebz s LEU 97 CO -0.05 0.01 -0.18 0.20 -1.32 0.00 0.00 176.35 175.00 3ebz s ASN 98 N 1.35 2.11 0.00 3.68 -0.87 -1.26 -5.28 114.94 114.67 3ebz s ASN 98 Ca 0.04 -0.41 0.00 0.00 -1.57 0.00 0.00 52.86 50.93 3ebz s ASN 98 Cb -0.15 -0.20 0.00 0.00 -0.02 0.00 0.00 41.25 40.89 3ebz s ASN 98 CO 0.01 0.16 0.51 -0.11 -2.57 0.00 0.00 177.10 175.10