#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3ebk n GLU 8 N 0.00 1.03 -0.01 3.52 2.13 -1.26 -4.42 120.64 121.64 3ebk n GLU 8 Ca 0.00 -0.07 0.10 0.00 0.66 0.00 0.00 57.16 57.84 3ebk n GLU 8 Cb 0.00 -1.30 -0.14 0.00 0.27 0.00 0.00 31.44 30.27 3ebk n GLU 8 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 3ebk n ASP 9 N -2.13 0.59 0.20 4.31 8.00 -1.26 -4.45 116.55 121.81 3ebk n ASP 9 Ca -0.09 -0.39 0.07 0.00 0.71 0.00 0.00 54.79 55.09 3ebk n ASP 9 Cb 0.54 1.55 0.40 0.00 -0.02 0.00 0.00 41.12 43.59 3ebk n ASP 9 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3ebk s PHE 11 N -3.68 2.99 -0.44 0.00 0.08 -1.26 -4.90 117.98 110.76 3ebk s PHE 11 Ca -0.00 1.53 0.08 0.00 0.12 0.00 0.00 56.93 58.66 3ebk s PHE 11 Cb 0.11 -3.42 -0.07 0.00 -0.57 0.00 0.00 43.02 39.08 3ebk s PHE 11 CO 0.67 -1.45 0.37 0.54 -0.10 0.00 0.00 175.22 175.25 3ebk n ARG 12 N -0.07 4.01 -4.26 0.44 1.74 -1.26 -5.04 116.66 112.21 3ebk n ARG 12 Ca 0.05 -0.11 -0.15 0.00 -0.77 0.00 0.00 57.85 56.86 3ebk n ARG 12 Cb 0.47 -0.89 -0.10 0.00 -1.02 0.00 0.00 32.46 30.91 3ebk n ARG 12 CO 0.00 0.00 0.00 -1.01 -1.52 0.00 0.00 177.63 175.10 3ebk s HIS 13 N -1.60 1.34 -0.15 -1.55 3.76 -1.26 -5.13 115.29 110.70 3ebk s HIS 13 Ca 0.04 -0.71 -0.15 0.00 -0.15 0.00 0.00 55.06 54.08 3ebk s HIS 13 Cb 0.06 -0.67 -0.04 0.00 1.11 0.00 0.00 32.58 33.03 3ebk s HIS 13 CO 0.29 0.13 0.35 -2.00 -0.85 0.00 0.00 174.74 172.66 3ebk s GLU 14 N -3.62 4.28 0.43 1.40 2.12 -1.26 -5.06 118.70 116.98 3ebk s GLU 14 Ca 0.17 0.21 -0.24 0.00 0.36 0.00 0.00 54.97 55.47 3ebk s GLU 14 Cb 0.01 -3.43 -0.08 0.00 0.26 0.00 0.00 34.13 30.90 3ebk s GLU 14 CO 0.02 0.22 1.13 0.45 -0.54 0.00 0.00 175.26 176.54 3ebk s SER 15 N 0.49 6.43 0.00 -1.70 0.15 -1.26 -4.94 113.70 112.87 3ebk s SER 15 Ca 0.19 2.23 0.28 0.00 0.70 0.00 0.00 55.95 59.36 3ebk s SER 15 Cb -0.14 -2.60 1.11 0.00 -1.71 0.00 0.00 66.02 62.68 3ebk s SER 15 CO 0.06 -0.73 1.78 0.18 1.20 0.00 0.00 173.24 175.72 3ebk n LEU 16 N -0.24 1.09 -3.17 3.45 4.77 0.28 -4.25 117.00 118.94 3ebk n LEU 16 Ca 0.06 -0.33 -0.20 0.00 -0.03 0.00 0.00 56.01 55.51 3ebk n LEU 16 Cb 0.48 -0.05 -0.04 0.00 -2.33 0.00 0.00 43.42 41.48 3ebk n LEU 16 CO 0.47 0.19 -0.20 1.33 -1.33 0.00 0.00 177.39 177.85 3ebk n VAL 17 N -0.28 0.09 0.27 4.08 0.24 -1.26 -4.93 118.33 116.55 3ebk n VAL 17 Ca 0.18 -4.59 0.11 0.00 -2.04 0.00 0.00 64.34 57.99 3ebk n VAL 17 Cb 0.32 -0.70 0.50 0.00 -1.47 0.00 0.00 33.84 32.48 3ebk n VAL 17 CO 0.00 0.00 0.00 -0.81 -2.14 0.00 0.00 176.83 173.88 3ebk n PRO 18 N 0.44 0.15 -0.98 7.34 -0.04 -1.26 -1.79 135.00 138.86 3ebk n PRO 18 Ca 0.25 0.52 -0.12 0.00 -0.04 0.00 0.00 63.50 64.11 3ebk n PRO 18 Cb 0.61 -1.87 0.21 0.00 -0.04 0.00 0.00 33.50 32.40 3ebk n PRO 18 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 3ebk n ASN 19 N -2.17 3.28 -3.95 3.54 3.02 -1.26 -3.16 115.26 114.56 3ebk n ASN 19 Ca 0.00 -3.62 -0.53 0.00 -0.03 0.00 0.00 54.58 50.40 3ebk n ASN 19 Cb 0.12 -0.72 -0.07 0.00 -0.61 0.00 0.00 39.78 38.50 3ebk n ASN 19 CO 0.00 0.00 0.00 -0.11 -2.62 0.00 0.00 177.26 174.53 3ebk n LEU 20 N -1.01 0.31 -4.48 3.41 7.94 -0.74 -4.85 117.00 117.58 3ebk n LEU 20 Ca 0.44 1.01 -0.43 0.00 -1.11 0.00 0.00 56.01 55.92 3ebk n LEU 20 Cb 1.32 -0.78 -0.04 0.00 0.53 0.00 0.00 43.42 44.45 3ebk n LEU 20 CO 0.38 -1.37 0.82 -0.62 -1.11 0.00 0.00 177.39 175.49 3ebk s ASP 21 N 0.79 6.19 0.19 1.96 -1.08 -1.26 -4.70 116.67 118.76 3ebk s ASP 21 Ca 0.82 -0.81 -0.12 0.00 -0.52 0.00 0.00 52.55 51.92 3ebk s ASP 21 Cb -1.16 -2.44 0.20 0.00 -1.46 0.00 0.00 42.92 38.06 3ebk s ASP 21 CO 0.56 -1.48 1.74 0.22 0.52 0.00 0.00 175.17 176.73 3ebk h TYR 22 N 9.61 0.29 0.00 -5.34 3.20 -1.90 -0.78 116.97 122.04 3ebk h TYR 22 Ca -0.28 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.61 3ebk h TYR 22 Cb 1.07 -0.05 -0.00 0.00 1.54 0.00 0.00 36.73 39.28 3ebk h TYR 22 CO 0.99 0.07 -0.04 0.93 -1.64 0.00 0.00 178.16 178.47 3ebk h GLU 23 N 0.33 0.00 0.00 1.82 5.08 -1.96 0.81 114.58 120.67 3ebk h GLU 23 Ca 0.26 0.00 -0.11 0.00 -1.00 0.00 0.00 59.36 58.51 3ebk h GLU 23 Cb 0.30 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.53 3ebk h GLU 23 CO -0.28 0.04 -0.84 0.00 -1.00 0.00 0.00 179.01 176.93 3ebk h ARG 24 N 0.00 0.00 0.00 2.33 3.08 -1.75 -3.29 114.38 114.75 3ebk h ARG 24 Ca -0.00 0.00 -0.19 0.00 0.07 0.00 0.00 59.98 59.86 3ebk h ARG 24 Cb 0.08 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.10 3ebk h ARG 24 CO 0.01 0.33 -0.92 0.35 -1.07 0.00 0.00 179.97 178.66 3ebk h PHE 25 N 0.00 0.00 -2.91 3.04 3.57 0.11 -3.45 116.94 117.29 3ebk h PHE 25 Ca -0.06 0.00 -0.58 0.00 3.53 0.00 0.00 57.97 60.86 3ebk h PHE 25 Cb 1.38 0.00 0.18 0.00 2.79 0.00 0.00 35.95 40.29 3ebk h PHE 25 CO 0.00 0.92 -0.49 -2.13 -2.23 0.00 0.00 178.31 174.37 3ebk n ARG 26 N -3.44 0.41 0.00 1.11 0.63 0.16 -4.86 116.66 110.66 3ebk n ARG 26 Ca -0.00 0.16 0.00 0.00 -0.92 0.00 0.00 57.85 57.09 3ebk n ARG 26 Cb 0.87 -1.65 0.00 0.00 0.45 0.00 0.00 32.46 32.13 3ebk n ARG 26 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3ebk n GLY 27 N 1.86 0.61 3.83 5.14 0.00 -0.19 -4.96 105.19 111.46 3ebk n GLY 27 Ca 0.11 -2.14 -0.36 0.00 0.00 0.00 0.00 46.02 43.62 3ebk n GLY 27 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3ebk s SER 28 N -4.00 6.11 -0.01 1.61 0.01 -1.26 -0.68 113.70 115.48 3ebk s SER 28 Ca 0.00 0.39 0.01 0.00 1.31 0.00 0.00 55.95 57.66 3ebk s SER 28 Cb 0.00 -1.93 0.01 0.00 0.21 0.00 0.00 66.02 64.31 3ebk s SER 28 CO 0.00 0.40 -0.02 0.26 0.41 0.00 0.00 173.24 174.29 3ebk s TRP 29 N -0.98 0.25 -0.15 2.43 0.52 0.98 -0.23 118.94 121.75 3ebk s TRP 29 Ca 0.14 -0.03 -0.04 0.00 0.02 0.00 0.00 56.10 56.20 3ebk s TRP 29 Cb -0.12 -0.21 -0.03 0.00 -1.15 0.00 0.00 33.47 31.96 3ebk s TRP 29 CO 0.04 -0.04 -0.03 -1.50 0.02 0.00 0.00 176.95 175.44 3ebk s ILE 30 N 0.23 4.00 -0.45 2.03 2.07 0.32 -0.41 121.20 129.00 3ebk s ILE 30 Ca -0.02 -0.32 -0.25 0.00 -1.41 0.00 0.00 60.65 58.65 3ebk s ILE 30 Cb -0.04 -2.75 0.03 0.00 0.13 0.00 0.00 42.46 39.82 3ebk s ILE 30 CO -0.01 0.50 0.90 -0.63 -1.91 0.00 0.00 174.94 173.79 3ebk s ILE 31 N 0.26 4.51 0.02 2.00 1.01 0.31 -0.75 121.20 128.57 3ebk s ILE 31 Ca -0.02 0.73 -0.05 0.00 0.00 0.00 0.00 60.65 61.31 3ebk s ILE 31 Cb -0.14 -4.41 -0.29 0.00 0.01 0.00 0.00 42.46 37.64 3ebk s ILE 31 CO 0.03 -0.79 0.94 0.00 0.00 0.00 0.00 174.94 175.11 3ebk h ALA 32 N 9.01 0.18 -2.25 9.38 0.00 -1.30 -3.39 119.26 130.89 3ebk h ALA 32 Ca -0.24 -1.03 0.12 0.00 0.00 0.00 0.00 54.91 53.76 3ebk h ALA 32 Cb 1.08 0.21 -0.15 0.00 0.00 0.00 0.00 17.79 18.93 3ebk h ALA 32 CO 1.01 1.05 0.51 0.00 0.00 0.00 0.00 179.25 181.82 3ebk s ALA 33 N -2.62 -1.82 0.28 0.00 0.00 -1.17 -0.48 121.76 115.95 3ebk s ALA 33 Ca -0.08 0.95 -0.19 0.00 0.00 0.00 0.00 51.96 52.64 3ebk s ALA 33 Cb 0.07 0.42 0.07 0.00 0.00 0.00 0.00 23.12 23.67 3ebk s ALA 33 CO 0.87 -0.72 0.91 0.20 0.00 0.00 0.00 175.76 177.02 3ebk s GLY 34 N -2.52 0.23 0.00 0.00 0.00 -0.32 -1.04 107.32 103.68 3ebk s GLY 34 Ca 0.06 -0.53 0.27 0.00 0.00 0.00 0.00 44.72 44.51 3ebk s GLY 34 CO -0.08 1.05 1.64 -1.30 0.00 0.00 0.00 173.10 174.41 3ebk n THR 35 N -0.61 0.00 -3.54 0.90 -2.24 -0.66 -0.00 114.28 108.13 3ebk n THR 35 Ca -0.06 -0.10 -0.38 0.00 -2.27 0.00 0.00 64.05 61.25 3ebk n THR 35 Cb 0.60 0.24 -0.09 0.00 -2.10 0.00 0.00 70.33 68.97 3ebk n THR 35 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 3ebk s SER 36 N -2.54 6.18 0.41 3.42 0.15 -1.26 -4.89 113.70 115.16 3ebk s SER 36 Ca 0.24 0.19 0.20 0.00 0.70 0.00 0.00 55.95 57.28 3ebk s SER 36 Cb 0.19 -2.15 0.84 0.00 -1.71 0.00 0.00 66.02 63.19 3ebk s SER 36 CO 0.52 -0.04 1.81 1.05 1.20 0.00 0.00 173.24 177.78 3ebk h GLU 37 N 7.84 0.00 -0.15 5.44 4.11 -1.91 -3.01 114.58 126.89 3ebk h GLU 37 Ca -0.36 0.00 -0.12 0.00 0.07 0.00 0.00 59.36 58.95 3ebk h GLU 37 Cb 1.17 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.41 3ebk h GLU 37 CO 0.64 0.31 -0.45 0.00 0.07 0.00 0.00 179.01 179.58 3ebk h ALA 38 N 1.69 0.95 0.00 1.06 0.00 -1.90 -2.70 119.26 118.35 3ebk h ALA 38 Ca -0.00 -0.45 0.00 0.00 0.00 0.00 0.00 54.91 54.46 3ebk h ALA 38 Cb 0.76 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.46 3ebk h ALA 38 CO 0.04 0.64 0.00 1.28 0.00 0.00 0.00 179.25 181.21 3ebk n LEU 39 N -4.00 0.44 0.09 0.00 4.77 -1.14 -2.60 117.00 114.56 3ebk n LEU 39 Ca -0.02 0.61 0.08 0.00 -0.03 0.00 0.00 56.01 56.65 3ebk n LEU 39 Cb 0.52 -0.55 0.37 0.00 -2.33 0.00 0.00 43.42 41.43 3ebk n LEU 39 CO 0.44 -0.46 0.74 0.35 -1.33 0.00 0.00 177.39 177.12 3ebk n THR 40 N -1.99 1.21 0.21 -5.08 -2.24 -1.02 -1.61 114.28 103.76 3ebk n THR 40 Ca 0.03 0.47 0.06 0.00 -2.27 0.00 0.00 64.05 62.34 3ebk n THR 40 Cb 0.21 -1.41 0.47 0.00 -2.10 0.00 0.00 70.33 67.50 3ebk n THR 40 CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 3ebk h GLN 41 N 0.00 0.00 -4.39 -0.78 4.20 -1.71 -3.40 115.11 109.04 3ebk h GLN 41 Ca 0.00 0.00 -0.72 0.00 0.06 0.00 0.00 58.65 57.99 3ebk h GLN 41 Cb 0.14 0.00 -0.27 0.00 0.30 0.00 0.00 27.48 27.65 3ebk h GLN 41 CO 0.00 0.28 -0.42 0.71 -0.67 0.00 0.00 178.83 178.73 3ebk s TYR 42 N -4.08 3.32 0.15 2.96 2.02 -0.63 -4.37 117.35 116.72 3ebk s TYR 42 Ca -0.02 -1.43 -0.11 0.00 -0.37 0.00 0.00 57.07 55.15 3ebk s TYR 42 Cb 0.13 -3.10 -0.07 0.00 -0.40 0.00 0.00 41.96 38.53 3ebk s TYR 42 CO 0.67 -0.86 0.49 0.15 -1.57 0.00 0.00 175.55 174.43 3ebk s LYS 43 N 1.47 3.82 -1.32 -0.62 1.02 -0.29 -4.38 119.74 119.44 3ebk s LYS 43 Ca 0.04 0.27 -0.13 0.00 0.02 0.00 0.00 55.97 56.17 3ebk s LYS 43 Cb -0.24 -2.85 0.01 0.00 -0.52 0.00 0.00 37.83 34.23 3ebk s LYS 43 CO 0.03 0.45 0.49 0.00 -0.92 0.00 0.00 175.35 175.40 3ebk s TRP 45 N -3.82 3.17 -0.14 0.00 -0.11 -1.26 -4.63 118.94 112.15 3ebk s TRP 45 Ca 0.23 0.83 0.01 0.00 1.22 0.00 0.00 56.10 58.38 3ebk s TRP 45 Cb -0.10 -3.78 0.02 0.00 -1.50 0.00 0.00 33.47 28.11 3ebk s TRP 45 CO 0.92 -2.78 -0.16 0.42 -4.62 0.00 0.00 176.95 170.73 3ebk s ILE 46 N 1.14 1.67 -0.16 5.86 1.01 0.44 -0.53 121.20 130.62 3ebk s ILE 46 Ca 0.67 -0.72 -0.07 0.00 0.00 0.00 0.00 60.65 60.53 3ebk s ILE 46 Cb -0.39 -1.53 -0.04 0.00 0.01 0.00 0.00 42.46 40.51 3ebk s ILE 46 CO 0.31 0.47 0.09 -1.81 0.00 0.00 0.00 174.94 174.00 3ebk s ASP 47 N 1.19 5.86 -0.31 3.58 1.01 0.45 -1.23 116.67 127.23 3ebk s ASP 47 Ca -0.01 0.20 0.02 0.00 0.71 0.00 0.00 52.55 53.47 3ebk s ASP 47 Cb -0.14 -1.96 0.09 0.00 1.01 0.00 0.00 42.92 41.92 3ebk s ASP 47 CO -0.06 0.24 0.03 -0.60 0.21 0.00 0.00 175.17 174.99 3ebk s ARG 48 N -0.04 1.37 -0.10 8.23 3.52 0.42 -0.01 118.95 132.34 3ebk s ARG 48 Ca 0.07 -1.51 -0.21 0.00 -0.13 0.00 0.00 55.73 53.95 3ebk s ARG 48 Cb -0.12 -2.80 -0.04 0.00 -1.56 0.00 0.00 34.95 30.44 3ebk s ARG 48 CO 0.01 -0.87 0.60 -0.06 -0.81 0.00 0.00 175.30 174.16 3ebk s PHE 49 N 1.16 3.53 0.07 5.12 0.08 0.15 -1.45 117.98 126.63 3ebk s PHE 49 Ca 0.07 1.07 -0.07 0.00 0.12 0.00 0.00 56.93 58.11 3ebk s PHE 49 Cb -0.19 -2.70 -0.01 0.00 -0.57 0.00 0.00 43.02 39.56 3ebk s PHE 49 CO -0.12 0.09 0.15 -1.54 -0.10 0.00 0.00 175.22 173.70 3ebk s SER 50 N 0.77 0.17 0.85 1.36 1.04 -0.05 -1.03 113.70 116.81 3ebk s SER 50 Ca 0.32 -0.65 0.00 0.00 0.48 0.00 0.00 55.95 56.10 3ebk s SER 50 Cb -0.16 0.30 0.00 0.00 0.10 0.00 0.00 66.02 66.26 3ebk s SER 50 CO 0.14 -0.66 0.00 -1.22 0.98 0.00 0.00 173.24 172.48 3ebk n TYR 51 N 0.16 0.00 0.11 5.02 4.01 -1.26 -1.43 117.16 123.76 3ebk n TYR 51 Ca -0.16 0.00 -0.19 0.00 -0.16 0.00 0.00 57.90 57.39 3ebk n TYR 51 Cb 0.61 0.03 -0.13 0.00 -0.31 0.00 0.00 39.34 39.55 3ebk n TYR 51 CO 0.00 0.00 0.00 -0.44 -0.46 0.00 0.00 176.86 175.96 3ebk h ASP 52 N 6.92 0.64 0.00 7.72 3.32 -2.01 -3.43 116.42 129.58 3ebk h ASP 52 Ca 0.00 -0.63 -0.11 0.00 0.02 0.00 0.00 57.03 56.30 3ebk h ASP 52 Cb 0.00 -0.21 -0.11 0.00 0.22 0.00 0.00 39.33 39.23 3ebk h ASP 52 CO 0.00 1.47 -0.24 -0.90 -1.72 0.00 0.00 179.24 177.85 3ebk n ASP 53 N -3.67 -0.88 -4.88 6.45 5.75 -1.22 -4.96 116.55 113.15 3ebk n ASP 53 Ca -0.11 -1.71 -0.34 0.00 -0.01 0.00 0.00 54.79 52.62 3ebk n ASP 53 Cb 1.00 0.28 -0.05 0.00 -1.03 0.00 0.00 41.12 41.33 3ebk n ASP 53 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 3ebk s ALA 54 N 0.01 3.82 -0.03 2.12 0.00 -0.52 -0.49 121.76 126.67 3ebk s ALA 54 Ca 0.01 -0.54 -0.01 0.00 0.00 0.00 0.00 51.96 51.42 3ebk s ALA 54 Cb 0.04 -2.11 0.03 0.00 0.00 0.00 0.00 23.12 21.08 3ebk s ALA 54 CO -0.01 0.64 0.07 -1.17 0.00 0.00 0.00 175.76 175.29 3ebk s LEU 55 N -1.92 1.11 -0.12 0.00 2.96 -0.69 -0.87 118.68 119.15 3ebk s LEU 55 Ca 0.30 0.14 0.01 0.00 -0.22 0.00 0.00 54.13 54.36 3ebk s LEU 55 Cb -0.13 0.12 0.02 0.00 0.50 0.00 0.00 46.19 46.69 3ebk s LEU 55 CO 0.18 -0.11 -0.15 -0.69 -1.32 0.00 0.00 176.35 174.25 3ebk s VAL 56 N 0.90 1.54 -0.08 1.68 1.01 -0.53 -1.18 120.40 123.73 3ebk s VAL 56 Ca -0.07 -0.65 0.04 0.00 0.00 0.00 0.00 61.98 61.30 3ebk s VAL 56 Cb -0.10 -1.41 -0.01 0.00 0.00 0.00 0.00 36.38 34.86 3ebk s VAL 56 CO -0.03 0.45 -0.21 -0.44 0.00 0.00 0.00 175.10 174.87 3ebk s SER 57 N 1.12 3.41 -0.01 3.32 0.01 0.22 -0.44 113.70 121.33 3ebk s SER 57 Ca -0.03 -0.44 0.02 0.00 1.31 0.00 0.00 55.95 56.81 3ebk s SER 57 Cb -0.14 -1.11 -0.00 0.00 0.21 0.00 0.00 66.02 64.98 3ebk s SER 57 CO -0.04 0.23 -0.07 -0.54 0.41 0.00 0.00 173.24 173.23 3ebk s LYS 58 N -0.05 0.61 0.25 12.44 1.02 -0.36 -0.69 119.74 132.96 3ebk s LYS 58 Ca -0.06 -0.24 -0.14 0.00 0.02 0.00 0.00 55.97 55.55 3ebk s LYS 58 Cb -0.15 -0.60 -0.00 0.00 -0.52 0.00 0.00 37.83 36.57 3ebk s LYS 58 CO 0.05 0.13 0.50 1.52 -0.92 0.00 0.00 175.35 176.63 3ebk s TYR 59 N -0.04 0.29 0.33 3.18 -0.85 -0.71 -0.42 117.35 119.12 3ebk s TYR 59 Ca 0.01 -0.66 0.03 0.00 -0.52 0.00 0.00 57.07 55.93 3ebk s TYR 59 Cb -0.04 0.25 -0.01 0.00 0.38 0.00 0.00 41.96 42.54 3ebk s TYR 59 CO -0.00 -1.01 0.09 0.25 -1.52 0.00 0.00 175.55 173.36 3ebk n THR 60 N -0.39 0.00 -1.87 -3.49 -2.24 -0.75 -1.35 114.28 104.20 3ebk n THR 60 Ca -0.02 -1.81 -0.29 0.00 -2.27 0.00 0.00 64.05 59.65 3ebk n THR 60 Cb 0.62 0.60 0.10 0.00 -2.10 0.00 0.00 70.33 69.54 3ebk n THR 60 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3ebk s ASP 61 N -2.95 4.39 0.00 3.42 -1.08 0.25 -1.14 116.67 119.56 3ebk s ASP 61 Ca 0.13 0.79 0.16 0.00 -0.52 0.00 0.00 52.55 53.11 3ebk s ASP 61 Cb 0.01 -1.28 0.85 0.00 -1.46 0.00 0.00 42.92 41.04 3ebk s ASP 61 CO 0.09 -1.98 1.45 -1.20 0.52 0.00 0.00 175.17 174.05 3ebk n SER 62 N -3.37 0.00 -0.60 -0.34 7.64 -1.26 -2.02 113.62 113.68 3ebk n SER 62 Ca 0.08 -0.06 0.08 0.00 1.01 0.00 0.00 58.87 59.98 3ebk n SER 62 Cb 0.61 -0.23 0.20 0.00 -1.01 0.00 0.00 64.21 63.78 3ebk n SER 62 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3ebk n GLN 63 N -1.23 2.56 -0.90 1.43 6.02 -1.26 -4.94 117.38 119.06 3ebk n GLN 63 Ca 0.09 -2.55 0.00 0.00 -0.01 0.00 0.00 57.00 54.53 3ebk n GLN 63 Cb 0.11 -1.61 0.00 0.00 1.02 0.00 0.00 30.24 29.77 3ebk n GLN 63 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3ebk n GLY 64 N -0.54 0.79 4.02 1.08 0.00 -0.86 -5.00 105.19 104.68 3ebk n GLY 64 Ca 0.17 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.98 3ebk n GLY 64 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3ebk s LYS 65 N -0.21 2.02 -1.00 1.61 1.02 -1.26 -4.65 119.74 117.27 3ebk s LYS 65 Ca 0.00 -1.50 -0.07 0.00 0.02 0.00 0.00 55.97 54.43 3ebk s LYS 65 Cb 0.00 -2.53 0.01 0.00 -0.52 0.00 0.00 37.83 34.79 3ebk s LYS 65 CO 0.00 -1.13 0.88 -1.71 -0.92 0.00 0.00 175.35 172.47 3ebk n ASN 66 N -2.49 -5.24 -4.66 2.83 5.15 -1.26 0.86 115.26 110.45 3ebk n ASN 66 Ca 0.16 -0.40 -0.56 0.00 -0.60 0.00 0.00 54.58 53.18 3ebk n ASN 66 Cb 0.61 -3.85 -0.07 0.00 -0.53 0.00 0.00 39.78 35.94 3ebk n ASN 66 CO 0.00 0.00 0.00 0.54 1.40 0.00 0.00 177.26 179.20 3ebk n ARG 67 N -3.83 1.02 -4.23 1.20 5.12 -1.26 -4.28 116.66 110.39 3ebk n ARG 67 Ca 0.01 0.37 -0.17 0.00 -1.93 0.00 0.00 57.85 56.12 3ebk n ARG 67 Cb 0.54 -2.02 -0.15 0.00 -1.16 0.00 0.00 32.46 29.68 3ebk n ARG 67 CO 0.00 0.00 0.00 0.99 -1.93 0.00 0.00 177.63 176.69 3ebk s THR 68 N 2.18 0.53 -0.04 0.55 2.01 -0.45 -5.02 115.64 115.39 3ebk s THR 68 Ca 0.93 -0.26 0.03 0.00 0.31 0.00 0.00 61.69 62.70 3ebk s THR 68 Cb -1.06 -0.47 0.01 0.00 0.01 0.00 0.00 72.50 70.98 3ebk s THR 68 CO 0.59 0.16 -0.12 -0.89 -0.69 0.00 0.00 174.62 173.67 3ebk s THR 69 N 0.01 1.09 0.02 -0.82 2.01 -1.26 -1.74 115.64 114.95 3ebk s THR 69 Ca 0.00 -0.50 0.04 0.00 0.31 0.00 0.00 61.69 61.54 3ebk s THR 69 Cb -0.05 -0.97 -0.02 0.00 0.01 0.00 0.00 72.50 71.48 3ebk s THR 69 CO -0.00 0.33 -0.13 0.27 -0.69 0.00 0.00 174.62 174.40 3ebk s ILE 70 N 0.32 1.00 0.09 1.82 -4.36 0.13 -5.00 121.20 115.21 3ebk s ILE 70 Ca -0.07 -0.76 0.09 0.00 -0.26 0.00 0.00 60.65 59.64 3ebk s ILE 70 Cb -0.12 -0.88 -0.03 0.00 1.25 0.00 0.00 42.46 42.68 3ebk s ILE 70 CO 0.02 0.11 -0.24 -0.13 0.24 0.00 0.00 174.94 174.95 3ebk s ARG 71 N -0.74 1.35 0.07 0.37 0.52 -1.26 -0.61 118.95 118.66 3ebk s ARG 71 Ca 0.03 -1.17 -0.02 0.00 -0.52 0.00 0.00 55.73 54.05 3ebk s ARG 71 Cb -0.06 -1.65 0.01 0.00 0.52 0.00 0.00 34.95 33.76 3ebk s ARG 71 CO 0.00 0.40 0.12 0.41 0.02 0.00 0.00 175.30 176.26 3ebk n GLY 72 N 1.27 2.36 3.16 -3.53 0.00 -0.33 -2.46 105.19 105.66 3ebk n GLY 72 Ca -0.18 -1.24 -0.25 0.00 0.00 0.00 0.00 46.02 44.35 3ebk n GLY 72 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 3ebk s ARG 73 N -2.08 1.40 0.37 1.61 3.52 -0.64 -1.71 118.95 121.41 3ebk s ARG 73 Ca 0.04 -0.62 0.08 0.00 -0.13 0.00 0.00 55.73 55.10 3ebk s ARG 73 Cb -0.01 -1.35 -0.03 0.00 -1.56 0.00 0.00 34.95 32.00 3ebk s ARG 73 CO 0.03 0.37 0.29 0.95 -0.81 0.00 0.00 175.30 176.13 3ebk s THR 74 N -0.41 3.10 -0.22 4.11 -4.23 0.35 -1.11 115.64 117.24 3ebk s THR 74 Ca 0.07 -1.43 -0.04 0.00 -1.18 0.00 0.00 61.69 59.10 3ebk s THR 74 Cb -0.07 -3.08 0.11 0.00 1.34 0.00 0.00 72.50 70.81 3ebk s THR 74 CO -0.01 -0.11 0.38 -0.75 -0.54 0.00 0.00 174.62 173.60 3ebk s LYS 75 N -4.01 0.32 -0.06 3.99 2.47 -0.95 -4.75 119.74 116.75 3ebk s LYS 75 Ca 0.43 0.72 -0.01 0.00 -1.56 0.00 0.00 55.97 55.55 3ebk s LYS 75 Cb -0.04 -0.17 -0.03 0.00 -1.46 0.00 0.00 37.83 36.13 3ebk s LYS 75 CO 0.26 -0.48 0.02 -0.06 0.16 0.00 0.00 175.35 175.25 3ebk s PHE 76 N 2.56 3.20 -0.36 4.03 0.08 -1.26 -1.20 117.98 125.03 3ebk s PHE 76 Ca 0.07 0.20 0.00 0.00 0.12 0.00 0.00 56.93 57.32 3ebk s PHE 76 Cb -0.14 -1.77 0.14 0.00 -0.57 0.00 0.00 43.02 40.67 3ebk s PHE 76 CO -0.14 0.50 0.21 -1.21 -0.10 0.00 0.00 175.22 174.48 3ebk s GLU 77 N -1.12 0.62 7.10 0.44 2.02 0.16 -4.98 118.70 122.93 3ebk s GLU 77 Ca 0.16 -1.38 0.00 0.00 0.02 0.00 0.00 54.97 53.77 3ebk s GLU 77 Cb -0.11 -1.42 0.00 0.00 0.10 0.00 0.00 34.13 32.69 3ebk s GLU 77 CO 0.05 -1.20 0.00 0.41 0.02 0.00 0.00 175.26 174.55 3ebk n GLY 78 N 4.03 2.57 0.18 -1.39 0.00 -1.26 -1.60 105.19 107.72 3ebk n GLY 78 Ca 0.11 -0.32 0.14 0.00 0.00 0.00 0.00 46.02 45.95 3ebk n GLY 78 CO 0.00 0.00 0.00 3.45 0.00 0.00 0.00 173.32 176.77 3ebk h ASN 79 N 1.49 0.00 -3.44 1.61 -1.07 -1.66 -3.40 115.58 109.11 3ebk h ASN 79 Ca 0.00 0.00 -0.54 0.00 0.07 0.00 0.00 56.30 55.83 3ebk h ASN 79 Cb 0.00 0.00 -0.03 0.00 -2.07 0.00 0.00 38.32 36.22 3ebk h ASN 79 CO 0.00 0.00 0.10 -0.54 0.07 0.00 0.00 177.43 177.06 3ebk s LYS 80 N -3.36 4.38 -0.11 4.14 1.02 -0.62 -0.70 119.74 124.49 3ebk s LYS 80 Ca 0.05 0.96 -0.15 0.00 0.02 0.00 0.00 55.97 56.85 3ebk s LYS 80 Cb 0.09 -3.17 0.04 0.00 -0.52 0.00 0.00 37.83 34.27 3ebk s LYS 80 CO 0.51 0.55 0.39 -0.59 -0.92 0.00 0.00 175.35 175.30 3ebk s PHE 81 N -1.22 -0.38 0.11 3.18 -0.71 -0.17 0.36 117.98 119.13 3ebk s PHE 81 Ca 0.35 0.85 0.05 0.00 -1.04 0.00 0.00 56.93 57.14 3ebk s PHE 81 Cb -0.21 0.15 -0.04 0.00 -1.21 0.00 0.00 43.02 41.72 3ebk s PHE 81 CO 0.23 -0.29 0.03 0.95 -1.34 0.00 0.00 175.22 174.80 3ebk s THR 82 N -0.31 4.14 -0.08 -4.49 -4.23 -0.34 0.34 115.64 110.65 3ebk s THR 82 Ca -0.05 -1.00 0.03 0.00 -1.18 0.00 0.00 61.69 59.50 3ebk s THR 82 Cb -0.03 -3.00 0.01 0.00 1.34 0.00 0.00 72.50 70.81 3ebk s THR 82 CO 0.02 0.07 -0.19 -0.63 -0.54 0.00 0.00 174.62 173.35 3ebk s ILE 83 N -1.42 1.67 -0.35 2.99 1.01 -0.77 -2.25 121.20 122.09 3ebk s ILE 83 Ca 0.27 -0.79 -0.01 0.00 0.00 0.00 0.00 60.65 60.12 3ebk s ILE 83 Cb -0.11 -1.47 0.08 0.00 0.01 0.00 0.00 42.46 40.97 3ebk s ILE 83 CO 0.20 0.47 0.08 -0.62 0.00 0.00 0.00 174.94 175.07 3ebk s ASP 84 N 0.47 4.99 0.47 3.58 2.15 -0.27 -2.20 116.67 125.85 3ebk s ASP 84 Ca -0.17 -1.72 -0.07 0.00 0.43 0.00 0.00 52.55 51.02 3ebk s ASP 84 Cb -0.17 -1.74 -0.05 0.00 -0.30 0.00 0.00 42.92 40.67 3ebk s ASP 84 CO 0.07 -0.39 0.80 -0.31 -0.17 0.00 0.00 175.17 175.17 3ebk s TYR 85 N 1.14 3.54 1.21 -5.34 2.02 -1.26 -1.62 117.35 117.04 3ebk s TYR 85 Ca 0.03 0.92 -0.19 0.00 -0.37 0.00 0.00 57.07 57.45 3ebk s TYR 85 Cb -0.21 -2.38 0.29 0.00 -0.40 0.00 0.00 41.96 39.27 3ebk s TYR 85 CO -0.04 -0.26 1.10 -0.80 -1.57 0.00 0.00 175.55 173.99 3ebk s ASN 86 N -3.82 0.82 0.36 2.29 -0.87 -1.03 -4.71 114.94 107.99 3ebk s ASN 86 Ca 0.49 0.66 0.18 0.00 -1.57 0.00 0.00 52.86 52.61 3ebk s ASN 86 Cb -0.10 -0.92 1.24 0.00 -0.02 0.00 0.00 41.25 41.45 3ebk s ASN 86 CO 0.41 -4.19 1.57 -0.67 -2.57 0.00 0.00 177.10 171.66 3ebk n ASP 87 N -4.81 0.26 -4.62 -1.22 2.03 -1.26 -3.49 116.55 103.45 3ebk n ASP 87 Ca 0.13 1.66 -0.43 0.00 0.52 0.00 0.00 54.79 56.67 3ebk n ASP 87 Cb 0.59 -0.77 -0.02 0.00 -0.72 0.00 0.00 41.12 40.20 3ebk n ASP 87 CO 0.00 0.00 0.00 -0.75 -1.92 0.00 0.00 177.20 174.53 3ebk s LYS 88 N -5.60 3.87 0.00 -0.67 2.20 -1.26 -2.95 119.74 115.33 3ebk s LYS 88 Ca -0.10 0.77 0.00 0.00 -0.36 0.00 0.00 55.97 56.29 3ebk s LYS 88 Cb 0.33 -3.83 0.00 0.00 -1.51 0.00 0.00 37.83 32.82 3ebk s LYS 88 CO 0.78 -1.14 0.00 0.41 -0.36 0.00 0.00 175.35 175.03 3ebk n GLY 89 N 4.40 1.11 0.43 5.54 0.00 -1.24 -4.61 105.19 110.82 3ebk n GLY 89 Ca 0.11 0.00 0.24 0.00 0.00 0.00 0.00 46.02 46.37 3ebk n GLY 89 CO 0.00 0.00 0.00 1.70 0.00 0.00 0.00 173.32 175.02 3ebk h LYS 90 N 2.89 0.09 0.00 1.61 3.64 -1.57 -0.03 116.57 123.21 3ebk h LYS 90 Ca 0.00 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 3ebk h LYS 90 Cb 0.00 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 31.80 3ebk h LYS 90 CO 0.00 0.06 0.00 0.00 -2.27 0.00 0.00 179.45 177.24 3ebk n ALA 91 N -2.65 1.27 0.74 5.00 0.00 -1.26 -1.86 120.51 121.76 3ebk n ALA 91 Ca 0.16 0.17 0.08 0.00 0.00 0.00 0.00 53.44 53.85 3ebk n ALA 91 Cb 0.80 -1.35 -0.05 0.00 0.00 0.00 0.00 19.45 18.85 3ebk n ALA 91 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 3ebk n PHE 92 N -2.28 0.00 -2.28 0.00 3.72 -0.03 -1.11 117.46 115.49 3ebk n PHE 92 Ca -0.00 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 56.98 3ebk n PHE 92 Cb 0.11 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.62 3ebk n PHE 92 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 3ebk s SER 93 N -2.23 6.92 -0.10 4.37 0.01 -0.78 -4.81 113.70 117.09 3ebk s SER 93 Ca 0.10 2.14 -0.32 0.00 1.31 0.00 0.00 55.95 59.18 3ebk s SER 93 Cb 0.13 -2.58 0.13 0.00 0.21 0.00 0.00 66.02 63.91 3ebk s SER 93 CO 0.54 -0.61 1.42 0.00 0.41 0.00 0.00 173.24 175.00 3ebk s ALA 94 N 1.53 -2.64 0.25 1.44 0.00 -0.94 -4.68 121.76 116.72 3ebk s ALA 94 Ca 0.62 0.68 -0.26 0.00 0.00 0.00 0.00 51.96 53.00 3ebk s ALA 94 Cb -0.32 0.50 -0.09 0.00 0.00 0.00 0.00 23.12 23.20 3ebk s ALA 94 CO 0.28 -1.11 0.88 -2.14 0.00 0.00 0.00 175.76 173.67 3ebk s PRO 95 N -2.00 4.62 0.12 0.00 0.02 -1.26 -1.85 135.00 134.65 3ebk s PRO 95 Ca 0.21 1.28 0.01 0.00 0.02 0.00 0.00 61.00 62.52 3ebk s PRO 95 Cb 0.05 -3.06 -0.04 0.00 0.02 0.00 0.00 34.50 31.47 3ebk s PRO 95 CO -0.06 0.44 -0.01 0.71 -0.33 0.00 0.00 177.00 177.74 3ebk s TYR 96 N -1.36 0.95 -0.10 6.54 2.02 0.15 -2.60 117.35 122.95 3ebk s TYR 96 Ca 0.43 -1.03 -0.04 0.00 -0.37 0.00 0.00 57.07 56.06 3ebk s TYR 96 Cb -0.22 -0.55 0.05 0.00 -0.40 0.00 0.00 41.96 40.84 3ebk s TYR 96 CO 0.26 -0.27 0.22 0.45 -1.57 0.00 0.00 175.55 174.65 3ebk s SER 97 N -3.07 0.05 -0.28 2.29 0.15 0.14 -1.00 113.70 111.96 3ebk s SER 97 Ca 0.18 0.48 -0.29 0.00 0.70 0.00 0.00 55.95 57.02 3ebk s SER 97 Cb 0.06 0.43 0.01 0.00 -1.71 0.00 0.00 66.02 64.81 3ebk s SER 97 CO -0.01 -0.19 1.18 -0.69 1.20 0.00 0.00 173.24 174.72 3ebk s VAL 98 N 1.67 4.37 0.02 4.45 1.01 0.12 -0.85 120.40 131.19 3ebk s VAL 98 Ca -0.05 1.58 0.07 0.00 0.00 0.00 0.00 61.98 63.58 3ebk s VAL 98 Cb -0.11 -4.26 -0.23 0.00 0.00 0.00 0.00 36.38 31.78 3ebk s VAL 98 CO -0.08 -0.40 0.92 -0.07 0.00 0.00 0.00 175.10 175.47 3ebk h LEU 99 N 10.24 0.08 -7.00 3.92 3.38 -0.78 -3.42 115.31 121.74 3ebk h LEU 99 Ca -0.23 -0.13 -0.02 0.00 0.09 0.00 0.00 57.88 57.60 3ebk h LEU 99 Cb 1.08 -0.03 -0.20 0.00 0.09 0.00 0.00 40.66 41.60 3ebk h LEU 99 CO 1.02 1.11 0.30 0.00 0.09 0.00 0.00 178.44 180.95 3ebk s ALA 100 N -2.64 -1.82 -0.18 1.53 0.00 -1.04 -0.56 121.76 117.05 3ebk s ALA 100 Ca -0.04 1.45 -0.32 0.00 0.00 0.00 0.00 51.96 53.06 3ebk s ALA 100 Cb 0.08 -0.32 0.14 0.00 0.00 0.00 0.00 23.12 23.03 3ebk s ALA 100 CO 0.83 -0.35 1.15 -0.08 0.00 0.00 0.00 175.76 177.31 3ebk s THR 101 N -1.03 0.00 -0.33 0.00 -1.32 -1.26 -0.25 115.64 111.44 3ebk s THR 101 Ca -0.07 0.00 0.07 0.00 -1.21 0.00 0.00 61.69 60.48 3ebk s THR 101 Cb -0.01 -1.00 0.18 0.00 -1.51 0.00 0.00 72.50 70.16 3ebk s THR 101 CO 0.07 0.00 1.13 -0.90 -2.21 0.00 0.00 174.62 172.71 3ebk n ASP 102 N 0.24 2.50 0.00 8.08 5.75 -1.11 -5.00 116.55 127.01 3ebk n ASP 102 Ca -0.04 -2.21 0.00 0.00 -0.01 0.00 0.00 54.79 52.53 3ebk n ASP 102 Cb 0.59 -0.17 0.00 0.00 -1.03 0.00 0.00 41.12 40.51 3ebk n ASP 102 CO 0.00 0.00 0.00 -1.22 -0.11 0.00 0.00 177.20 175.87 3ebk n TYR 103 N -0.28 0.00 0.09 2.11 4.02 -1.26 -4.37 117.16 117.47 3ebk n TYR 103 Ca 0.07 0.00 -0.05 0.00 -0.01 0.00 0.00 57.90 57.91 3ebk n TYR 103 Cb 0.41 0.00 -0.01 0.00 -0.02 0.00 0.00 39.34 39.71 3ebk n TYR 103 CO 0.00 0.00 0.00 0.93 -1.01 0.00 0.00 176.86 176.78 3ebk h GLU 104 N 0.00 0.02 0.00 -0.72 4.39 -1.94 -3.43 114.58 112.90 3ebk h GLU 104 Ca 0.00 -0.03 0.00 0.00 0.34 0.00 0.00 59.36 59.67 3ebk h GLU 104 Cb 0.00 0.01 0.00 0.00 -0.10 0.00 0.00 28.75 28.66 3ebk h GLU 104 CO 0.00 0.87 -0.83 0.09 -1.16 0.00 0.00 179.01 177.99 3ebk n ASN 105 N -3.53 1.96 -4.10 1.42 4.13 -1.26 -4.71 115.26 109.16 3ebk n ASN 105 Ca -0.01 0.00 -0.11 0.00 1.68 0.00 0.00 54.58 56.15 3ebk n ASN 105 Cb 0.82 0.00 -0.08 0.00 -1.54 0.00 0.00 39.78 38.98 3ebk n ASN 105 CO 0.00 0.00 0.00 -0.72 0.28 0.00 0.00 177.26 176.82 3ebk s TYR 106 N -1.90 0.77 -0.02 3.10 -0.85 -1.26 -0.13 117.35 117.06 3ebk s TYR 106 Ca 0.00 -1.07 -0.24 0.00 -0.52 0.00 0.00 57.07 55.24 3ebk s TYR 106 Cb 0.00 -0.23 0.05 0.00 0.38 0.00 0.00 41.96 42.17 3ebk s TYR 106 CO 0.00 -0.78 0.54 0.00 -1.52 0.00 0.00 175.55 173.79 3ebk s ALA 107 N -4.08 -1.38 -0.12 9.51 0.00 -0.78 -2.73 121.76 122.18 3ebk s ALA 107 Ca 0.30 0.89 0.03 0.00 0.00 0.00 0.00 51.96 53.18 3ebk s ALA 107 Cb 0.04 0.08 0.00 0.00 0.00 0.00 0.00 23.12 23.24 3ebk s ALA 107 CO 0.09 -0.35 -0.23 0.42 0.00 0.00 0.00 175.76 175.69 3ebk s ILE 108 N -1.43 2.07 0.04 0.00 1.01 0.65 -1.59 121.20 121.95 3ebk s ILE 108 Ca -0.11 -1.00 0.06 0.00 0.00 0.00 0.00 60.65 59.60 3ebk s ILE 108 Cb -0.02 -1.80 -0.02 0.00 0.01 0.00 0.00 42.46 40.63 3ebk s ILE 108 CO 0.06 0.56 -0.17 -0.69 0.00 0.00 0.00 174.94 174.70 3ebk s VAL 109 N 0.54 1.32 0.12 2.92 1.01 -0.35 -0.03 120.40 125.94 3ebk s VAL 109 Ca -0.14 -1.08 0.09 0.00 0.00 0.00 0.00 61.98 60.86 3ebk s VAL 109 Cb -0.17 -1.18 -0.04 0.00 0.00 0.00 0.00 36.38 34.99 3ebk s VAL 109 CO 0.04 0.08 -0.20 -0.70 0.00 0.00 0.00 175.10 174.32 3ebk s GLU 110 N -1.17 1.71 0.12 2.72 2.12 -0.03 -0.01 118.70 124.16 3ebk s GLU 110 Ca 0.04 -1.22 -0.26 0.00 0.36 0.00 0.00 54.97 53.89 3ebk s GLU 110 Cb -0.08 -2.07 0.07 0.00 0.26 0.00 0.00 34.13 32.31 3ebk s GLU 110 CO 0.01 0.47 1.02 0.20 -0.54 0.00 0.00 175.26 176.42 3ebk s GLY 111 N -2.16 -0.27 -0.37 -1.50 0.00 -0.29 0.24 107.32 102.97 3ebk s GLY 111 Ca 0.17 0.24 0.11 0.00 0.00 0.00 0.00 44.72 45.24 3ebk s GLY 111 CO 0.09 0.03 1.08 0.00 0.00 0.00 0.00 173.10 174.30 3ebk s PRO 113 N -3.46 4.03 0.52 0.00 0.04 -1.26 -4.61 135.00 130.25 3ebk s PRO 113 Ca 0.41 1.66 0.16 0.00 0.04 0.00 0.00 61.00 63.26 3ebk s PRO 113 Cb 0.41 -2.54 1.26 0.00 0.04 0.00 0.00 34.50 33.67 3ebk s PRO 113 CO -0.08 -0.29 2.14 0.00 0.04 0.00 0.00 177.00 178.81 3ebk h ALA 114 N 2.41 1.98 0.00 8.56 0.00 -1.73 -1.06 119.26 129.41 3ebk h ALA 114 Ca -0.49 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.41 3ebk h ALA 114 Cb 1.23 -0.00 -0.00 0.00 0.00 0.00 0.00 17.79 19.02 3ebk h ALA 114 CO 0.62 0.01 -0.01 0.00 0.00 0.00 0.00 179.25 179.87 3ebk h ALA 115 N 1.99 1.52 -0.54 0.00 0.00 -1.47 0.21 119.26 120.97 3ebk h ALA 115 Ca -0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 3ebk h ALA 115 Cb 0.02 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 3ebk h ALA 115 CO 0.00 0.02 0.03 0.00 0.00 0.00 0.00 179.25 179.30 3ebk n ALA 116 N -2.33 3.84 -3.37 0.00 0.00 -0.51 -4.33 120.51 113.81 3ebk n ALA 116 Ca -0.03 -2.05 -0.22 0.00 0.00 0.00 0.00 53.44 51.15 3ebk n ALA 116 Cb 0.10 -1.07 0.06 0.00 0.00 0.00 0.00 19.45 18.54 3ebk n ALA 116 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 3ebk n ASN 117 N 0.34 -5.98 0.00 0.00 3.02 0.06 -3.09 115.26 109.61 3ebk n ASN 117 Ca 0.28 -0.44 0.00 0.00 -0.03 0.00 0.00 54.58 54.39 3ebk n ASN 117 Cb 1.18 -4.65 0.00 0.00 -0.61 0.00 0.00 39.78 35.69 3ebk n ASN 117 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3ebk n GLY 118 N -1.79 2.80 3.47 7.41 0.00 -0.60 -5.00 105.19 111.48 3ebk n GLY 118 Ca -0.02 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.86 3ebk n GLY 118 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 3ebk s HIS 119 N -2.00 -0.60 -0.09 1.61 5.65 -1.18 -4.16 115.29 114.52 3ebk s HIS 119 Ca 0.00 1.36 -0.30 0.00 0.25 0.00 0.00 55.06 56.37 3ebk s HIS 119 Cb 0.00 0.24 0.07 0.00 -1.18 0.00 0.00 32.58 31.71 3ebk s HIS 119 CO 0.00 -0.37 0.69 0.54 -0.65 0.00 0.00 174.74 174.95 3ebk s VAL 120 N -0.13 0.00 -0.10 0.89 0.11 -0.22 -4.68 120.40 116.27 3ebk s VAL 120 Ca -0.03 0.00 0.02 0.00 -2.93 0.00 0.00 61.98 59.03 3ebk s VAL 120 Cb -0.03 -1.00 0.02 0.00 -1.53 0.00 0.00 36.38 33.83 3ebk s VAL 120 CO 0.03 0.00 -0.14 -0.63 -3.33 0.00 0.00 175.10 171.03 3ebk s ILE 121 N -0.92 1.37 0.19 7.04 1.01 -1.26 -1.14 121.20 127.49 3ebk s ILE 121 Ca -0.09 -0.57 0.04 0.00 0.00 0.00 0.00 60.65 60.03 3ebk s ILE 121 Cb -0.01 -1.27 -0.05 0.00 0.01 0.00 0.00 42.46 41.15 3ebk s ILE 121 CO 0.08 0.42 -0.05 -0.72 0.00 0.00 0.00 174.94 174.67 3ebk s TYR 122 N 0.99 1.40 -0.11 3.97 1.13 0.98 -1.65 117.35 124.07 3ebk s TYR 122 Ca -0.07 -0.85 0.02 0.00 -1.41 0.00 0.00 57.07 54.76 3ebk s TYR 122 Cb -0.15 -0.77 -0.01 0.00 -1.10 0.00 0.00 41.96 39.93 3ebk s TYR 122 CO -0.01 0.01 -0.19 0.08 -2.51 0.00 0.00 175.55 172.92 3ebk s VAL 123 N -3.39 2.51 0.05 -3.49 1.01 -0.21 -1.21 120.40 115.68 3ebk s VAL 123 Ca 0.23 -0.86 0.06 0.00 0.00 0.00 0.00 61.98 61.40 3ebk s VAL 123 Cb 0.04 -2.00 -0.03 0.00 0.00 0.00 0.00 36.38 34.39 3ebk s VAL 123 CO 0.05 0.55 -0.16 0.00 0.00 0.00 0.00 175.10 175.53 3ebk s GLN 124 N 0.31 0.99 0.04 2.72 -2.07 -0.62 -0.80 119.66 120.23 3ebk s GLN 124 Ca -0.15 -0.87 0.07 0.00 -1.82 0.00 0.00 55.36 52.59 3ebk s GLN 124 Cb -0.17 -1.05 -0.03 0.00 -1.09 0.00 0.00 33.01 30.67 3ebk s GLN 124 CO 0.07 0.25 -0.16 -0.51 -1.32 0.00 0.00 175.29 173.62 3ebk s LEU 125 N -1.35 2.71 0.23 2.60 2.01 0.07 -1.86 118.68 123.08 3ebk s LEU 125 Ca 0.02 -0.39 -0.31 0.00 0.01 0.00 0.00 54.13 53.46 3ebk s LEU 125 Cb -0.09 -1.58 -0.10 0.00 0.01 0.00 0.00 46.19 44.43 3ebk s LEU 125 CO 0.02 0.25 1.53 -0.60 1.01 0.00 0.00 176.35 178.56 3ebk s ARG 126 N -1.50 4.22 -0.29 1.70 3.52 0.82 -0.52 118.95 126.89 3ebk s ARG 126 Ca 0.15 2.39 -0.10 0.00 -0.13 0.00 0.00 55.73 58.04 3ebk s ARG 126 Cb -0.11 -3.11 -0.03 0.00 -1.56 0.00 0.00 34.95 30.14 3ebk s ARG 126 CO 0.06 -0.54 0.17 1.41 -0.81 0.00 0.00 175.30 175.59 3ebk s MET 127 N 0.21 3.72 -0.15 5.12 -2.45 0.67 -4.80 119.30 121.63 3ebk s MET 127 Ca 0.65 -0.47 -0.13 0.00 -1.25 0.00 0.00 55.69 54.49 3ebk s MET 127 Cb -0.44 -3.61 0.04 0.00 1.25 0.00 0.00 34.83 32.07 3ebk s MET 127 CO 0.39 -0.26 0.39 -0.08 1.05 0.00 0.00 175.02 176.51 3ebk s THR 128 N 1.70 -0.00 -0.93 10.11 -1.32 -1.26 -4.25 115.64 119.69 3ebk s THR 128 Ca 0.06 0.01 0.08 0.00 -1.21 0.00 0.00 61.69 60.63 3ebk s THR 128 Cb -0.16 -0.54 0.07 0.00 -1.51 0.00 0.00 72.50 70.35 3ebk s THR 128 CO 0.09 0.00 1.24 0.18 -2.21 0.00 0.00 174.62 173.92 3ebk n LEU 129 N 2.95 0.06 0.23 9.08 4.77 -1.26 -0.24 117.00 132.59 3ebk n LEU 129 Ca -0.14 0.52 0.11 0.00 -0.03 0.00 0.00 56.01 56.47 3ebk n LEU 129 Cb 0.57 -0.52 0.43 0.00 -2.33 0.00 0.00 43.42 41.57 3ebk n LEU 129 CO 0.13 -0.43 0.81 -0.09 -1.33 0.00 0.00 177.39 176.48 3ebk h ARG 130 N 0.00 0.00 0.00 3.23 2.43 -2.01 -3.30 114.38 114.73 3ebk h ARG 130 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 3ebk h ARG 130 Cb 0.11 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.66 3ebk h ARG 130 CO 0.00 0.18 -0.38 0.54 -1.51 0.00 0.00 179.97 178.80 3ebk n ARG 131 N -3.28 3.83 -3.51 0.20 1.74 0.31 -4.98 116.66 110.97 3ebk n ARG 131 Ca 0.01 0.00 -0.42 0.00 -0.77 0.00 0.00 57.85 56.67 3ebk n ARG 131 Cb 0.44 -0.65 -0.09 0.00 -1.02 0.00 0.00 32.46 31.14 3ebk n ARG 131 CO 0.00 0.00 0.00 0.12 -1.52 0.00 0.00 177.63 176.23 3ebk s PHE 132 N -1.26 3.27 -0.40 -1.55 5.36 0.67 -5.01 117.98 119.07 3ebk s PHE 132 Ca 0.00 -1.09 -0.04 0.00 -0.96 0.00 0.00 56.93 54.84 3ebk s PHE 132 Cb 0.00 -2.90 0.10 0.00 -0.34 0.00 0.00 43.02 39.88 3ebk s PHE 132 CO 0.00 -0.76 0.19 -1.58 -1.46 0.00 0.00 175.22 171.61 3ebk s HIS 133 N 1.56 3.51 -0.34 10.12 5.65 -1.26 -4.59 115.29 129.94 3ebk s HIS 133 Ca 0.03 -2.21 -0.27 0.00 0.25 0.00 0.00 55.06 52.86 3ebk s HIS 133 Cb -0.22 -3.07 -0.06 0.00 -1.18 0.00 0.00 32.58 28.04 3ebk s HIS 133 CO 0.06 -0.94 2.31 -2.30 -0.65 0.00 0.00 174.74 173.22 3ebk n PRO 134 N 4.65 1.56 0.02 2.88 -0.02 -1.26 -5.09 135.00 137.74 3ebk n PRO 134 Ca -0.05 0.29 -0.19 0.00 -2.02 0.00 0.00 63.50 61.53 3ebk n PRO 134 Cb 0.42 -3.34 -0.14 0.00 -0.02 0.00 0.00 33.50 30.42 3ebk n PRO 134 CO 0.00 0.00 0.00 1.57 1.98 0.00 0.00 175.50 179.05 3ebk h LYS 135 N 17.14 0.22 0.00 -0.52 -0.00 -2.04 -3.57 116.57 127.81 3ebk h LYS 135 Ca -0.34 -0.38 0.00 0.00 -0.00 0.00 0.00 60.65 59.93 3ebk h LYS 135 Cb 1.25 0.14 0.00 0.00 -0.00 0.00 0.00 32.23 33.63 3ebk h LYS 135 CO 1.05 1.18 0.00 -0.11 -0.00 0.00 0.00 179.45 181.57 3ebk n LEU 142 N -4.20 -1.27 -0.16 7.07 7.94 -1.26 -5.35 117.00 119.77 3ebk n LEU 142 Ca -0.15 0.29 -0.03 0.00 -1.11 0.00 0.00 56.01 55.02 3ebk n LEU 142 Cb 0.76 1.48 0.19 0.00 0.53 0.00 0.00 43.42 46.38 3ebk n LEU 142 CO 0.44 -0.19 1.03 1.56 -1.11 0.00 0.00 177.39 179.12 3ebk h GLN 143 N 0.00 0.90 -0.36 1.96 7.50 -1.94 0.66 115.11 123.83 3ebk h GLN 143 Ca 0.00 -0.15 -0.06 0.00 0.50 0.00 0.00 58.65 58.94 3ebk h GLN 143 Cb 0.00 -0.15 -0.01 0.00 0.05 0.00 0.00 27.48 27.37 3ebk h GLN 143 CO 0.00 0.75 -0.00 0.45 -1.50 0.00 0.00 178.83 178.53 3ebk h HIS 144 N 0.88 0.70 -0.16 2.96 3.86 -1.99 -1.33 115.15 120.07 3ebk h HIS 144 Ca 0.20 -0.12 0.03 0.00 -1.16 0.00 0.00 60.37 59.32 3ebk h HIS 144 Cb 0.21 -0.18 -0.03 0.00 1.06 0.00 0.00 27.41 28.47 3ebk h HIS 144 CO 0.01 0.74 -0.02 -0.92 0.86 0.00 0.00 177.93 178.61 3ebk h TYR 145 N 0.46 -0.05 -0.05 2.45 3.20 -1.79 -1.85 116.97 119.34 3ebk h TYR 145 Ca 0.10 0.01 0.01 0.00 3.14 0.00 0.00 58.73 61.99 3ebk h TYR 145 Cb 0.47 0.04 -0.01 0.00 1.54 0.00 0.00 36.73 38.78 3ebk h TYR 145 CO 0.04 -0.05 0.00 1.15 -1.64 0.00 0.00 178.16 177.67 3ebk h THR 146 N 0.03 0.97 -0.71 1.81 2.02 -0.73 -1.01 112.91 115.29 3ebk h THR 146 Ca 0.08 -0.01 0.04 0.00 0.77 0.00 0.00 66.41 67.29 3ebk h THR 146 Cb 0.11 0.95 -0.05 0.00 -1.74 0.00 0.00 68.15 67.41 3ebk h THR 146 CO -0.15 0.00 0.43 0.25 0.37 0.00 0.00 175.52 176.43 3ebk h LEU 147 N 0.02 0.70 -0.65 2.58 5.85 -1.13 0.11 115.31 122.80 3ebk h LEU 147 Ca 0.02 0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.71 3ebk h LEU 147 Cb 0.02 -0.14 -0.03 0.00 0.37 0.00 0.00 40.66 40.88 3ebk h LEU 147 CO -0.03 0.48 0.26 0.44 -0.34 0.00 0.00 178.44 179.24 3ebk h ASP 148 N 0.84 0.91 -0.01 1.25 3.32 -1.06 0.12 116.42 121.78 3ebk h ASP 148 Ca 0.29 -0.18 -0.13 0.00 0.02 0.00 0.00 57.03 57.03 3ebk h ASP 148 Cb 0.05 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.36 3ebk h ASP 148 CO -0.12 0.84 -0.41 1.56 -1.72 0.00 0.00 179.24 179.38 3ebk h GLN 149 N 0.92 0.53 -0.08 3.56 1.08 -0.65 -0.49 115.11 119.99 3ebk h GLN 149 Ca 0.22 -0.27 -0.00 0.00 -1.45 0.00 0.00 58.65 57.14 3ebk h GLN 149 Cb 0.22 0.01 -0.00 0.00 -0.05 0.00 0.00 27.48 27.65 3ebk h GLN 149 CO -0.02 0.85 0.03 0.28 -0.95 0.00 0.00 178.83 179.03 3ebk h VAL 150 N 0.44 1.14 -0.69 -0.54 2.07 -0.39 -2.48 116.25 115.79 3ebk h VAL 150 Ca 0.04 -0.42 0.01 0.00 0.82 0.00 0.00 66.70 67.14 3ebk h VAL 150 Cb 0.91 1.28 -0.03 0.00 -1.52 0.00 0.00 31.29 31.93 3ebk h VAL 150 CO 0.08 0.12 0.46 0.78 0.02 0.00 0.00 177.57 179.03 3ebk h ASN 151 N -0.04 0.80 0.13 0.57 -0.26 -0.60 0.11 115.58 116.29 3ebk h ASN 151 Ca 0.03 -0.02 -0.01 0.00 -0.56 0.00 0.00 56.30 55.73 3ebk h ASN 151 Cb 0.17 -0.20 -0.00 0.00 -1.06 0.00 0.00 38.32 37.23 3ebk h ASN 151 CO -0.00 0.58 -0.06 1.56 -1.06 0.00 0.00 177.43 178.45 3ebk h GLN 152 N 0.94 0.00 -0.14 0.81 4.20 -0.93 -2.58 115.11 117.41 3ebk h GLN 152 Ca 0.25 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.96 3ebk h GLN 152 Cb -0.10 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.68 3ebk h GLN 152 CO -0.05 0.06 0.00 0.09 -0.67 0.00 0.00 178.83 178.26 3ebk n ASN 153 N -3.94 2.77 -0.16 1.46 3.02 -0.86 -4.80 115.26 112.74 3ebk n ASN 153 Ca -0.03 -2.56 -0.04 0.00 -0.03 0.00 0.00 54.58 51.93 3ebk n ASN 153 Cb 0.15 -0.31 0.03 0.00 -0.61 0.00 0.00 39.78 39.04 3ebk n ASN 153 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 3ebk h LYS 154 N 0.88 -0.08 -0.26 3.52 1.63 -0.39 -1.67 116.57 120.21 3ebk h LYS 154 Ca 0.00 0.01 0.05 0.00 -0.85 0.00 0.00 60.65 59.85 3ebk h LYS 154 Cb 0.92 0.02 -0.05 0.00 -0.60 0.00 0.00 32.23 32.53 3ebk h LYS 154 CO 0.06 -0.05 -0.05 -0.22 -3.45 0.00 0.00 179.45 175.74 3ebk h LYS 155 N -0.08 0.02 -0.21 1.90 3.64 -1.87 0.19 116.57 120.16 3ebk h LYS 155 Ca 0.24 -0.00 -0.01 0.00 -1.27 0.00 0.00 60.65 59.61 3ebk h LYS 155 Cb 0.45 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.26 3ebk h LYS 155 CO -0.56 0.01 0.09 0.00 -2.27 0.00 0.00 179.45 176.72 3ebk h ALA 156 N 1.25 0.27 0.17 5.00 0.00 -1.86 -0.31 119.26 123.78 3ebk h ALA 156 Ca 0.12 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 54.93 3ebk h ALA 156 Cb 0.18 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 3ebk h ALA 156 CO -0.25 -0.14 -0.19 0.82 0.00 0.00 0.00 179.25 179.49 3ebk h ILE 157 N 0.19 0.57 -0.85 0.00 2.04 -0.99 -1.45 117.51 117.03 3ebk h ILE 157 Ca 0.07 0.00 0.09 0.00 1.00 0.00 0.00 64.86 66.02 3ebk h ILE 157 Cb 0.17 0.57 -0.06 0.00 -0.74 0.00 0.00 36.82 36.76 3ebk h ILE 157 CO -0.01 0.00 0.55 -0.33 0.00 0.00 0.00 178.15 178.36 3ebk h GLU 158 N -0.41 0.81 -0.24 2.37 4.39 -0.53 0.37 114.58 121.34 3ebk h GLU 158 Ca 0.01 -0.05 -0.03 0.00 0.34 0.00 0.00 59.36 59.63 3ebk h GLU 158 Cb 0.39 -0.18 -0.01 0.00 -0.10 0.00 0.00 28.75 28.85 3ebk h GLU 158 CO -0.06 0.54 0.05 1.49 -1.16 0.00 0.00 179.01 179.86 3ebk h GLU 159 N 0.84 0.39 -0.27 2.33 4.57 -0.43 -0.37 114.58 121.64 3ebk h GLU 159 Ca 0.39 -0.10 -0.18 0.00 -1.18 0.00 0.00 59.36 58.29 3ebk h GLU 159 Cb 0.39 -0.05 -0.00 0.00 -0.16 0.00 0.00 28.75 28.93 3ebk h GLU 159 CO -0.15 0.51 -0.54 -0.44 -1.18 0.00 0.00 179.01 177.21 3ebk h ASP 160 N 0.21 0.89 -0.86 1.04 3.32 -0.84 -2.69 116.42 117.49 3ebk h ASP 160 Ca 0.07 -0.47 0.05 0.00 0.02 0.00 0.00 57.03 56.70 3ebk h ASP 160 Cb 0.30 -0.26 -0.06 0.00 0.22 0.00 0.00 39.33 39.54 3ebk h ASP 160 CO 0.00 1.25 0.54 -0.07 -1.72 0.00 0.00 179.24 179.24 3ebk h LEU 161 N 0.62 0.87 -1.23 1.55 4.07 -0.86 -0.18 115.31 120.15 3ebk h LEU 161 Ca 0.02 0.01 -0.01 0.00 0.08 0.00 0.00 57.88 57.97 3ebk h LEU 161 Cb 1.13 -0.18 -0.03 0.00 1.08 0.00 0.00 40.66 42.66 3ebk h LEU 161 CO 0.12 0.57 0.33 0.50 -1.08 0.00 0.00 178.44 178.88 3ebk h LYS 162 N 1.01 0.87 0.00 1.13 3.64 -0.91 -0.20 116.57 122.11 3ebk h LYS 162 Ca 0.36 -0.09 -0.00 0.00 -1.27 0.00 0.00 60.65 59.65 3ebk h LYS 162 Cb 0.11 -0.17 -0.00 0.00 -0.41 0.00 0.00 32.23 31.76 3ebk h LYS 162 CO -0.15 0.64 -0.00 1.25 -2.27 0.00 0.00 179.45 178.92 3ebk h HIS 163 N 0.87 0.00 -0.39 1.91 2.76 -0.70 -0.83 115.15 118.77 3ebk h HIS 163 Ca 0.22 0.00 -0.18 0.00 -2.20 0.00 0.00 60.37 58.21 3ebk h HIS 163 Cb 0.04 0.00 -0.11 0.00 1.55 0.00 0.00 27.41 28.89 3ebk h HIS 163 CO 0.01 0.00 -0.00 1.19 -1.30 0.00 0.00 177.93 177.82 3ebk n PHE 164 N -3.80 1.23 -3.69 5.26 3.72 -0.22 -4.95 117.46 115.01 3ebk n PHE 164 Ca -0.03 -1.50 -0.27 0.00 -0.05 0.00 0.00 57.45 55.60 3ebk n PHE 164 Cb 0.08 -0.50 0.05 0.00 -0.94 0.00 0.00 39.48 38.17 3ebk n PHE 164 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 176.76 176.80 3ebk n ASN 165 N -1.02 -5.54 -4.36 4.37 5.03 -0.32 -4.99 115.26 108.43 3ebk n ASN 165 Ca 0.34 -0.62 -0.18 0.00 0.87 0.00 0.00 54.58 54.98 3ebk n ASN 165 Cb 1.07 -4.40 -0.10 0.00 -1.02 0.00 0.00 39.78 35.32 3ebk n ASN 165 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 3ebk s LEU 166 N -7.22 2.17 0.00 3.41 1.43 -0.40 -5.01 118.68 113.07 3ebk s LEU 166 Ca 0.60 -1.26 0.02 0.00 -1.03 0.00 0.00 54.13 52.46 3ebk s LEU 166 Cb -0.28 -0.30 -0.01 0.00 0.03 0.00 0.00 46.19 45.63 3ebk s LEU 166 CO 0.74 -0.53 -0.07 -0.54 0.23 0.00 0.00 176.35 176.18 3ebk s LYS 167 N -3.87 0.53 0.31 1.70 1.02 -1.26 -3.16 119.74 115.00 3ebk s LYS 167 Ca 0.31 -0.32 0.02 0.00 0.02 0.00 0.00 55.97 56.01 3ebk s LYS 167 Cb 0.06 -0.48 0.59 0.00 -0.52 0.00 0.00 37.83 37.48 3ebk s LYS 167 CO 0.11 0.13 1.88 -0.92 -0.92 0.00 0.00 175.35 175.63 3ebk h TYR 168 N 5.75 1.02 0.00 3.18 3.20 -1.93 -1.22 116.97 126.97 3ebk h TYR 168 Ca -0.30 0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.59 3ebk h TYR 168 Cb 1.19 -0.33 -0.00 0.00 1.54 0.00 0.00 36.73 39.13 3ebk h TYR 168 CO 0.44 0.47 -0.04 1.05 -1.64 0.00 0.00 178.16 178.45 3ebk h GLU 169 N 0.95 0.00 -0.01 1.82 4.11 -2.03 -2.08 114.58 117.35 3ebk h GLU 169 Ca 0.43 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.86 3ebk h GLU 169 Cb 0.37 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.62 3ebk h GLU 169 CO -0.19 0.04 -0.04 -0.25 0.07 0.00 0.00 179.01 178.64 3ebk n ASP 170 N -3.26 0.54 -4.90 3.06 8.00 -0.46 -4.87 116.55 114.67 3ebk n ASP 170 Ca -0.01 -0.92 -0.30 0.00 0.71 0.00 0.00 54.79 54.27 3ebk n ASP 170 Cb 0.21 -0.04 -0.04 0.00 -0.02 0.00 0.00 41.12 41.23 3ebk n ASP 170 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 3ebk s LEU 171 N -2.21 4.11 0.11 0.64 1.43 -0.78 -4.94 118.68 117.04 3ebk s LEU 171 Ca 0.37 0.75 -0.30 0.00 -1.03 0.00 0.00 54.13 53.92 3ebk s LEU 171 Cb 0.21 -3.54 -0.06 0.00 0.03 0.00 0.00 46.19 42.83 3ebk s LEU 171 CO 0.41 -0.14 1.01 -1.00 0.23 0.00 0.00 176.35 176.86 3ebk s HIS 172 N -1.97 3.72 0.20 0.29 3.76 1.00 -4.80 115.29 117.49 3ebk s HIS 172 Ca 0.44 1.71 -0.30 0.00 -0.15 0.00 0.00 55.06 56.77 3ebk s HIS 172 Cb -0.11 -3.13 -0.08 0.00 1.11 0.00 0.00 32.58 30.36 3ebk s HIS 172 CO 0.27 -0.09 1.18 0.45 -0.85 0.00 0.00 174.74 175.70 3ebk s SER 173 N 0.19 7.12 -0.16 1.40 0.15 -1.26 -1.17 113.70 119.97 3ebk s SER 173 Ca 0.49 2.23 0.15 0.00 0.70 0.00 0.00 55.95 59.53 3ebk s SER 173 Cb -0.25 -2.61 0.34 0.00 -1.71 0.00 0.00 66.02 61.79 3ebk s SER 173 CO 0.31 -0.33 1.18 0.35 1.20 0.00 0.00 173.24 175.94 3ebk n THR 174 N 2.26 1.92 -3.20 6.45 -2.24 0.37 -4.86 114.28 114.99 3ebk n THR 174 Ca 0.03 -2.59 0.00 0.00 -2.27 0.00 0.00 64.05 59.23 3ebk n THR 174 Cb 0.45 -0.19 -0.02 0.00 -2.10 0.00 0.00 70.33 68.47 3ebk n THR 174 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50