#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dbk s GLU 2 N 0.00 3.00 0.30 0.00 2.02 -1.26 -1.26 118.70 121.50 3dbk s GLU 2 Ca 0.00 -0.47 0.03 0.00 0.02 0.00 0.00 54.97 54.55 3dbk s GLU 2 Cb 0.00 -2.74 -0.04 0.00 0.10 0.00 0.00 34.13 31.45 3dbk s GLU 2 CO 0.00 0.62 0.16 0.00 0.02 0.00 0.00 175.26 176.06 3dbk s ALA 3 N -0.68 1.91 0.32 5.21 0.00 0.30 -4.89 121.76 123.94 3dbk s ALA 3 Ca 0.11 -1.77 -0.02 0.00 0.00 0.00 0.00 51.96 50.28 3dbk s ALA 3 Cb -0.12 1.17 0.01 0.00 0.00 0.00 0.00 23.12 24.18 3dbk s ALA 3 CO 0.02 -0.51 0.45 0.41 0.00 0.00 0.00 175.76 176.13 3dbk n GLY 4 N -0.56 2.15 0.00 0.00 0.00 0.92 -0.66 105.19 107.04 3dbk n GLY 4 Ca 0.01 -1.57 0.00 0.00 0.00 0.00 0.00 46.02 44.46 3dbk n GLY 4 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dbk n GLY 5 N -0.52 1.91 3.78 -0.02 0.00 -0.95 -1.25 105.19 108.13 3dbk n GLY 5 Ca 0.00 -1.36 -0.31 0.00 0.00 0.00 0.00 46.02 44.36 3dbk n GLY 5 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3dbk s PRO 6 N -1.93 2.31 0.31 1.61 0.04 -1.26 0.16 135.00 136.25 3dbk s PRO 6 Ca 0.00 1.09 -0.14 0.00 0.04 0.00 0.00 61.00 61.99 3dbk s PRO 6 Cb 0.00 -1.91 0.02 0.00 0.04 0.00 0.00 34.50 32.65 3dbk s PRO 6 CO 0.00 -1.58 0.63 0.20 0.04 0.00 0.00 177.00 176.29 3dbk s GLY 7 N -3.49 0.47 0.00 0.56 0.00 -0.04 -4.31 107.32 100.51 3dbk s GLY 7 Ca 0.61 -0.79 0.00 0.00 0.00 0.00 0.00 44.72 44.54 3dbk s GLY 7 CO 0.56 -0.45 0.00 0.61 0.00 0.00 0.00 173.10 173.82 3dbk n GLY 8 N -0.47 -1.83 3.39 0.20 0.00 -1.26 -2.25 105.19 102.96 3dbk n GLY 8 Ca -0.04 -1.74 -0.12 0.00 0.00 0.00 0.00 46.02 44.12 3dbk n GLY 8 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 3dbk n ASN 9 N 0.34 -1.68 0.29 1.61 0.23 -1.14 -1.51 115.26 113.39 3dbk n ASN 9 Ca 0.00 -2.70 0.17 0.00 -0.53 0.00 0.00 54.58 51.53 3dbk n ASN 9 Cb 0.00 2.96 0.80 0.00 -2.08 0.00 0.00 39.78 41.45 3dbk n ASN 9 CO 0.00 0.00 0.00 0.06 -0.93 0.00 0.00 177.26 176.39 3dbk h GLN 10 N 0.00 0.00 0.04 -3.83 3.07 -1.34 0.26 115.11 113.31 3dbk h GLN 10 Ca -0.29 0.00 -0.00 0.00 0.09 0.00 0.00 58.65 58.45 3dbk h GLN 10 Cb 1.16 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.72 3dbk h GLN 10 CO 0.38 0.04 -0.02 -0.22 0.09 0.00 0.00 178.83 179.09 3dbk h LYS 11 N 0.00 -0.06 0.00 0.06 3.64 -1.88 -3.36 116.57 114.98 3dbk h LYS 11 Ca -0.00 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.38 3dbk h LYS 11 Cb 0.39 0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.23 3dbk h LYS 11 CO 0.00 0.56 -0.58 -0.84 -2.27 0.00 0.00 179.45 176.32 3dbk h ILE 12 N -0.92 0.00 0.00 2.00 3.07 -1.81 -3.50 117.51 116.35 3dbk h ILE 12 Ca -0.01 -0.55 0.00 0.00 1.55 0.00 0.00 64.86 65.85 3dbk h ILE 12 Cb 0.64 1.18 0.00 0.00 -0.27 0.00 0.00 36.82 38.37 3dbk h ILE 12 CO 0.01 0.00 0.00 0.61 -1.05 0.00 0.00 178.15 177.72 3dbk n GLY 13 N 1.31 2.29 3.85 0.16 0.00 0.92 -4.91 105.19 108.80 3dbk n GLY 13 Ca 0.03 -1.92 -0.36 0.00 0.00 0.00 0.00 46.02 43.77 3dbk n GLY 13 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3dbk s LYS 14 N -2.90 3.91 0.23 1.61 2.20 -1.25 -2.90 119.74 120.64 3dbk s LYS 14 Ca 0.00 0.39 -0.05 0.00 -0.36 0.00 0.00 55.97 55.96 3dbk s LYS 14 Cb 0.00 -3.05 -0.03 0.00 -1.51 0.00 0.00 37.83 33.24 3dbk s LYS 14 CO 0.00 0.57 0.27 1.52 -0.36 0.00 0.00 175.35 177.36 3dbk s TYR 15 N -1.31 0.92 -0.06 4.03 -0.85 -0.95 -5.01 117.35 114.12 3dbk s TYR 15 Ca 0.32 -1.18 0.02 0.00 -0.52 0.00 0.00 57.07 55.71 3dbk s TYR 15 Cb -0.15 -0.29 0.02 0.00 0.38 0.00 0.00 41.96 41.91 3dbk s TYR 15 CO 0.17 -0.80 -0.10 0.99 -1.52 0.00 0.00 175.55 174.29 3dbk s THR 16 N -4.01 0.97 0.07 -3.49 2.01 -1.26 -0.86 115.64 109.08 3dbk s THR 16 Ca 0.33 -0.38 -0.30 0.00 0.31 0.00 0.00 61.69 61.65 3dbk s THR 16 Cb 0.04 -0.91 -0.06 0.00 0.01 0.00 0.00 72.50 71.58 3dbk s THR 16 CO 0.12 0.32 1.17 -0.31 -0.69 0.00 0.00 174.62 175.23 3dbk s TYR 17 N 0.76 3.48 0.00 4.92 1.51 0.12 -1.14 117.35 127.00 3dbk s TYR 17 Ca -0.13 1.38 0.00 0.00 -1.01 0.00 0.00 57.07 57.31 3dbk s TYR 17 Cb -0.15 -3.38 0.00 0.00 -0.11 0.00 0.00 41.96 38.32 3dbk s TYR 17 CO 0.02 -1.08 0.00 0.41 -1.11 0.00 0.00 175.55 173.79 3dbk n GLY 18 N 3.01 0.47 0.70 0.71 0.00 0.10 -2.25 105.19 107.92 3dbk n GLY 18 Ca 0.08 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.10 3dbk n GLY 18 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 3dbk n SER 19 N 0.00 0.00 0.08 1.61 7.64 -0.96 -4.91 113.62 117.08 3dbk n SER 19 Ca 0.00 0.00 -0.05 0.00 1.01 0.00 0.00 58.87 59.83 3dbk n SER 19 Cb 0.00 0.00 0.14 0.00 -1.01 0.00 0.00 64.21 63.34 3dbk n SER 19 CO 0.00 0.00 0.00 0.44 -3.01 0.00 0.00 175.04 172.47 3dbk h ASP 20 N 0.00 0.31 -3.55 6.43 3.32 -1.47 -3.46 116.42 118.00 3dbk h ASP 20 Ca 0.00 -0.16 -0.48 0.00 0.02 0.00 0.00 57.03 56.41 3dbk h ASP 20 Cb 0.00 -0.09 -0.14 0.00 0.22 0.00 0.00 39.33 39.32 3dbk h ASP 20 CO 0.00 0.80 -0.57 -0.31 -1.72 0.00 0.00 179.24 177.44 3dbk s TYR 21 N -3.87 1.79 1.21 4.55 2.02 -1.14 -5.01 117.35 116.91 3dbk s TYR 21 Ca -0.04 -1.16 -0.14 0.00 -0.37 0.00 0.00 57.07 55.36 3dbk s TYR 21 Cb 0.12 -1.13 0.29 0.00 -0.40 0.00 0.00 41.96 40.84 3dbk s TYR 21 CO 0.80 -0.21 0.91 0.41 -1.57 0.00 0.00 175.55 175.88 3dbk n GLY 22 N -0.72 -2.27 3.85 0.71 0.00 -1.26 -0.73 105.19 104.77 3dbk n GLY 22 Ca -0.03 -1.20 -0.31 0.00 0.00 0.00 0.00 46.02 44.49 3dbk n GLY 22 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3dbk s PRO 23 N -4.30 3.02 0.13 1.61 0.04 -1.26 -2.48 135.00 131.75 3dbk s PRO 23 Ca 0.68 0.72 -0.26 0.00 0.04 0.00 0.00 61.00 62.18 3dbk s PRO 23 Cb -0.24 -2.02 -0.07 0.00 0.04 0.00 0.00 34.50 32.21 3dbk s PRO 23 CO 0.66 -0.98 0.80 -0.51 0.04 0.00 0.00 177.00 177.00 3dbk s LEU 24 N -5.41 4.55 -0.30 -3.56 1.43 0.17 -4.87 118.68 110.69 3dbk s LEU 24 Ca 0.57 1.62 -0.11 0.00 -1.03 0.00 0.00 54.13 55.18 3dbk s LEU 24 Cb -0.12 -3.32 -0.03 0.00 0.03 0.00 0.00 46.19 42.75 3dbk s LEU 24 CO 0.54 0.14 0.20 -0.63 0.23 0.00 0.00 176.35 176.83 3dbk s ILE 25 N -0.78 5.21 0.41 -0.59 -1.09 -1.26 -0.53 121.20 122.57 3dbk s ILE 25 Ca 0.38 -0.03 0.05 0.00 -2.23 0.00 0.00 60.65 58.81 3dbk s ILE 25 Cb -0.23 -3.57 -0.06 0.00 -1.58 0.00 0.00 42.46 37.03 3dbk s ILE 25 CO 0.26 0.14 0.03 0.68 -1.23 0.00 0.00 174.94 174.82 3dbk s VAL 26 N 1.73 1.55 0.30 2.92 -7.23 -0.39 -4.00 120.40 115.29 3dbk s VAL 26 Ca 0.06 -2.00 0.01 0.00 -1.81 0.00 0.00 61.98 58.25 3dbk s VAL 26 Cb -0.17 -2.74 0.06 0.00 0.56 0.00 0.00 36.38 34.09 3dbk s VAL 26 CO 0.10 0.00 0.41 -0.46 -0.31 0.00 0.00 175.10 174.85 3dbk n ASN 27 N -0.99 0.70 0.06 4.85 2.04 -0.94 -0.14 115.26 120.84 3dbk n ASN 27 Ca -0.07 -1.55 0.07 0.00 -0.44 0.00 0.00 54.58 52.58 3dbk n ASN 27 Cb 0.67 -0.25 0.33 0.00 -2.53 0.00 0.00 39.78 37.99 3dbk n ASN 27 CO 0.00 0.00 0.00 -0.90 -0.44 0.00 0.00 177.26 175.92 3dbk n ASP 28 N -2.88 0.26 -1.02 0.53 5.75 -1.26 -1.01 116.55 116.92 3dbk n ASP 28 Ca 0.07 0.59 0.12 0.00 -0.01 0.00 0.00 54.79 55.56 3dbk n ASP 28 Cb 0.26 -0.63 0.23 0.00 -1.03 0.00 0.00 41.12 39.95 3dbk n ASP 28 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 3dbk n ARG 29 N -1.81 2.34 -3.61 0.11 1.74 -1.26 -4.94 116.66 109.23 3dbk n ARG 29 Ca 0.01 -2.02 -0.22 0.00 -0.77 0.00 0.00 57.85 54.86 3dbk n ARG 29 Cb 0.12 -1.49 0.06 0.00 -1.02 0.00 0.00 32.46 30.13 3dbk n ARG 29 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 3dbk s GLU 31 N -5.93 2.57 -1.31 0.00 2.02 -1.26 -1.97 118.70 112.83 3dbk s GLU 31 Ca 0.24 -0.83 -0.18 0.00 0.02 0.00 0.00 54.97 54.23 3dbk s GLU 31 Cb -0.11 -2.55 0.05 0.00 0.10 0.00 0.00 34.13 31.61 3dbk s GLU 31 CO 0.76 0.54 1.86 -1.33 0.02 0.00 0.00 175.26 177.11 3dbk n MET 32 N 0.57 2.98 -3.46 1.61 2.81 0.26 -2.20 117.12 119.69 3dbk n MET 32 Ca -0.11 -3.06 -0.18 0.00 -1.81 0.00 0.00 57.70 52.55 3dbk n MET 32 Cb 0.52 -3.46 -0.12 0.00 -0.71 0.00 0.00 33.22 29.45 3dbk n MET 32 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 3dbk s ASP 33 N 4.19 1.54 -0.11 7.83 -1.08 -1.25 -1.62 116.67 126.17 3dbk s ASP 33 Ca 0.54 -0.43 0.19 0.00 -0.52 0.00 0.00 52.55 52.32 3dbk s ASP 33 Cb 0.06 0.42 0.74 0.00 -1.46 0.00 0.00 42.92 42.68 3dbk s ASP 33 CO 0.05 -0.35 1.65 -0.90 0.52 0.00 0.00 175.17 176.14 3dbk n ASP 34 N 5.31 4.85 0.00 -0.34 5.68 -0.79 -3.14 116.55 128.12 3dbk n ASP 34 Ca -0.04 -2.45 0.00 0.00 -0.50 0.00 0.00 54.79 51.80 3dbk n ASP 34 Cb 0.48 -0.59 0.00 0.00 -1.14 0.00 0.00 41.12 39.87 3dbk n ASP 34 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3dbk n GLY 35 N 1.19 3.21 0.00 6.12 0.00 -1.26 -4.71 105.19 109.73 3dbk n GLY 35 Ca 0.26 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.28 3dbk n GLY 35 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3dbk n ASN 36 N 0.00 2.52 -4.26 1.61 3.02 -1.26 -5.05 115.26 111.84 3dbk n ASN 36 Ca 0.00 0.00 -0.31 0.00 -0.03 0.00 0.00 54.58 54.24 3dbk n ASN 36 Cb 0.00 0.21 -0.16 0.00 -0.61 0.00 0.00 39.78 39.21 3dbk n ASN 36 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 3dbk s VAL 37 N -1.53 2.00 -0.12 2.41 1.01 -1.26 -1.72 120.40 121.19 3dbk s VAL 37 Ca 0.00 -1.04 0.01 0.00 0.00 0.00 0.00 61.98 60.96 3dbk s VAL 37 Cb 0.00 -1.69 0.02 0.00 0.00 0.00 0.00 36.38 34.71 3dbk s VAL 37 CO 0.00 0.56 -0.15 -0.63 0.00 0.00 0.00 175.10 174.88 3dbk s ILE 38 N -0.18 1.50 -0.17 2.22 1.01 0.42 -1.89 121.20 124.11 3dbk s ILE 38 Ca -0.03 -0.63 -0.04 0.00 0.00 0.00 0.00 60.65 59.95 3dbk s ILE 38 Cb -0.13 -1.38 -0.02 0.00 0.01 0.00 0.00 42.46 40.93 3dbk s ILE 38 CO 0.03 0.44 -0.04 -0.89 0.00 0.00 0.00 174.94 174.49 3dbk s THR 39 N 1.09 3.76 -0.09 2.92 2.01 -0.64 -0.24 115.64 124.47 3dbk s THR 39 Ca -0.04 -0.39 0.02 0.00 0.31 0.00 0.00 61.69 61.58 3dbk s THR 39 Cb -0.14 -2.66 -0.02 0.00 0.01 0.00 0.00 72.50 69.68 3dbk s THR 39 CO -0.03 0.47 -0.12 -0.69 -0.69 0.00 0.00 174.62 173.56 3dbk s VAL 40 N 0.63 3.19 -0.52 3.82 1.01 0.78 -0.62 120.40 128.69 3dbk s VAL 40 Ca -0.02 -0.65 -0.21 0.00 0.00 0.00 0.00 61.98 61.09 3dbk s VAL 40 Cb -0.14 -2.30 0.05 0.00 0.00 0.00 0.00 36.38 33.99 3dbk s VAL 40 CO 0.02 0.56 0.76 -0.62 0.00 0.00 0.00 175.10 175.83 3dbk s ASP 41 N -0.30 6.28 0.37 3.32 3.68 -1.26 -0.99 116.67 127.76 3dbk s ASP 41 Ca 0.03 -0.65 0.26 0.00 2.13 0.00 0.00 52.55 54.32 3dbk s ASP 41 Cb -0.13 -2.35 0.73 0.00 -1.45 0.00 0.00 42.92 39.72 3dbk s ASP 41 CO 0.03 -1.03 1.74 0.24 0.13 0.00 0.00 175.17 176.27 3dbk h MET 42 N 9.12 0.00 -6.42 4.34 2.86 -1.09 -3.48 114.93 120.26 3dbk h MET 42 Ca -0.27 0.00 -0.49 0.00 -2.06 0.00 0.00 59.70 56.88 3dbk h MET 42 Cb 1.09 0.00 -0.07 0.00 0.06 0.00 0.00 31.60 32.67 3dbk h MET 42 CO 1.01 0.00 -0.80 -1.71 1.06 0.00 0.00 176.91 176.47 3dbk n ASN 43 N -2.74 -3.39 0.00 1.22 4.05 -1.23 -0.64 115.26 112.53 3dbk n ASN 43 Ca 0.04 -0.87 0.00 0.00 0.45 0.00 0.00 54.58 54.19 3dbk n ASN 43 Cb 0.43 -3.51 0.00 0.00 1.23 0.00 0.00 39.78 37.93 3dbk n ASN 43 CO 0.00 0.00 0.00 -1.20 -3.05 0.00 0.00 177.26 173.01 3dbk n SER 44 N -2.84 -2.54 -4.89 1.20 7.64 0.87 -4.98 113.62 108.08 3dbk n SER 44 Ca -0.04 0.00 -0.29 0.00 1.01 0.00 0.00 58.87 59.55 3dbk n SER 44 Cb 0.56 -1.35 0.03 0.00 -1.01 0.00 0.00 64.21 62.44 3dbk n SER 44 CO 0.00 0.00 0.00 -0.55 -3.01 0.00 0.00 175.04 171.48 3dbk s SER 45 N -2.24 5.81 -0.04 6.43 0.15 0.18 -3.27 113.70 120.73 3dbk s SER 45 Ca 0.00 1.13 0.06 0.00 0.70 0.00 0.00 55.95 57.83 3dbk s SER 45 Cb 0.00 -2.10 0.08 0.00 -1.71 0.00 0.00 66.02 62.30 3dbk s SER 45 CO 0.00 -1.06 0.98 0.35 1.20 0.00 0.00 173.24 174.71 3dbk n THR 46 N -2.77 1.05 -2.12 6.45 -2.24 -1.26 -1.34 114.28 112.06 3dbk n THR 46 Ca 0.05 -1.16 -0.42 0.00 -2.27 0.00 0.00 64.05 60.26 3dbk n THR 46 Cb 0.56 0.35 -0.03 0.00 -2.10 0.00 0.00 70.33 69.11 3dbk n THR 46 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 3dbk s ASP 47 N -1.42 5.85 0.56 3.42 3.68 -1.26 -4.87 116.67 122.63 3dbk s ASP 47 Ca 0.09 0.87 0.38 0.00 2.13 0.00 0.00 52.55 56.02 3dbk s ASP 47 Cb 0.08 -2.53 2.00 0.00 -1.45 0.00 0.00 42.92 41.02 3dbk s ASP 47 CO 0.01 -1.82 2.15 -2.24 0.13 0.00 0.00 175.17 173.40 3dbk h ASP 48 N 12.79 0.00 0.97 -0.34 3.04 -2.04 -2.35 116.42 128.48 3dbk h ASP 48 Ca -0.30 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.49 3dbk h ASP 48 Cb 1.15 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.44 3dbk h ASP 48 CO 1.10 0.00 0.00 -1.54 -2.04 0.00 0.00 179.24 176.76 3dbk n SER 49 N -2.85 0.75 -4.64 4.15 3.41 -1.26 -4.72 113.62 108.47 3dbk n SER 49 Ca -0.02 0.65 -0.43 0.00 -0.26 0.00 0.00 58.87 58.81 3dbk n SER 49 Cb 0.08 -0.82 -0.02 0.00 -0.26 0.00 0.00 64.21 63.19 3dbk n SER 49 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 3dbk s LYS 50 N -3.27 3.93 -0.00 4.33 1.02 -0.89 -4.81 119.74 120.05 3dbk s LYS 50 Ca 0.06 1.64 0.00 0.00 0.02 0.00 0.00 55.97 57.69 3dbk s LYS 50 Cb 0.10 -3.96 0.01 0.00 -0.52 0.00 0.00 37.83 33.46 3dbk s LYS 50 CO 0.46 -1.11 0.72 0.25 -0.92 0.00 0.00 175.35 174.75 3dbk n THR 51 N 6.10 0.08 -2.58 2.17 -2.24 -1.26 -5.04 114.28 111.50 3dbk n THR 51 Ca 0.17 -0.08 -0.42 0.00 -2.27 0.00 0.00 64.05 61.44 3dbk n THR 51 Cb 0.45 0.76 -0.03 0.00 -2.10 0.00 0.00 70.33 69.42 3dbk n THR 51 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 3dbk s THR 52 N -0.10 4.50 0.31 4.28 2.01 -1.26 -4.98 115.64 120.40 3dbk s THR 52 Ca 0.01 1.79 -0.29 0.00 0.31 0.00 0.00 61.69 63.51 3dbk s THR 52 Cb 0.01 -4.15 -0.10 0.00 0.01 0.00 0.00 72.50 68.26 3dbk s THR 52 CO 0.00 0.11 1.38 -2.84 -0.69 0.00 0.00 174.62 172.58 3dbk s PRO 53 N 1.25 4.29 0.26 4.92 0.02 -1.26 -4.42 135.00 140.05 3dbk s PRO 53 Ca 0.54 2.30 -0.31 0.00 0.02 0.00 0.00 61.00 63.56 3dbk s PRO 53 Cb -0.24 -3.07 -0.11 0.00 0.02 0.00 0.00 34.50 31.10 3dbk s PRO 53 CO 0.27 -0.32 1.62 0.12 -0.33 0.00 0.00 177.00 178.36 3dbk s PHE 54 N -0.75 2.82 -0.02 6.54 5.36 0.21 -4.68 117.98 127.45 3dbk s PHE 54 Ca 0.53 0.67 0.07 0.00 -0.96 0.00 0.00 56.93 57.24 3dbk s PHE 54 Cb -0.41 -4.07 -0.02 0.00 -0.34 0.00 0.00 43.02 38.18 3dbk s PHE 54 CO 0.51 -3.73 -0.23 0.50 -1.46 0.00 0.00 175.22 170.82 3dbk s ARG 55 N 0.02 1.92 0.30 10.12 3.52 -1.26 -0.57 118.95 132.99 3dbk s ARG 55 Ca 0.66 -0.81 0.01 0.00 -0.13 0.00 0.00 55.73 55.47 3dbk s ARG 55 Cb -0.48 -1.81 -0.02 0.00 -1.56 0.00 0.00 34.95 31.08 3dbk s ARG 55 CO 0.43 0.46 0.32 -0.59 -0.81 0.00 0.00 175.30 175.10 3dbk s PHE 56 N -0.44 1.32 -0.43 5.12 -0.12 -0.83 -5.02 117.98 117.58 3dbk s PHE 56 Ca 0.06 -1.42 -0.24 0.00 -0.05 0.00 0.00 56.93 55.28 3dbk s PHE 56 Cb -0.10 -0.43 0.02 0.00 -0.63 0.00 0.00 43.02 41.89 3dbk s PHE 56 CO -0.00 -0.91 0.81 0.00 -0.05 0.00 0.00 175.22 175.07 3dbk s ALA 57 N -3.54 3.32 0.89 1.99 0.00 -1.26 -4.74 121.76 118.43 3dbk s ALA 57 Ca 0.36 -0.87 -0.11 0.00 0.00 0.00 0.00 51.96 51.34 3dbk s ALA 57 Cb 0.02 -3.47 0.13 0.00 0.00 0.00 0.00 23.12 19.80 3dbk s ALA 57 CO 0.21 -1.83 1.11 0.00 0.00 0.00 0.00 175.76 175.25 3dbk n PRO 59 N -4.05 2.14 -5.23 0.00 -0.04 -1.26 -5.08 135.00 121.48 3dbk n PRO 59 Ca 0.10 -1.69 -0.32 0.00 -0.04 0.00 0.00 63.50 61.55 3dbk n PRO 59 Cb 0.53 -1.46 -0.16 0.00 -0.04 0.00 0.00 33.50 32.36 3dbk n PRO 59 CO 0.00 0.00 0.00 0.99 -0.04 0.00 0.00 175.50 176.45 3dbk s THR 60 N -1.74 2.12 -0.15 0.52 2.01 -1.25 -0.06 115.64 117.10 3dbk s THR 60 Ca 0.35 -1.04 0.01 0.00 0.31 0.00 0.00 61.69 61.32 3dbk s THR 60 Cb 0.20 -1.78 0.00 0.00 0.01 0.00 0.00 72.50 70.94 3dbk s THR 60 CO 0.30 0.57 -0.18 0.21 -0.69 0.00 0.00 174.62 174.83 3dbk s ASN 61 N -0.08 3.46 0.00 3.53 3.04 -0.38 -4.71 114.94 119.79 3dbk s ASN 61 Ca -0.06 -0.51 0.02 0.00 0.04 0.00 0.00 52.86 52.35 3dbk s ASN 61 Cb -0.14 -1.52 0.05 0.00 -1.54 0.00 0.00 41.25 38.10 3dbk s ASN 61 CO 0.05 0.09 0.88 0.35 -3.04 0.00 0.00 177.10 175.43 3dbk n THR 62 N 4.01 0.63 -2.79 -5.21 -2.24 -1.26 -4.01 114.28 103.41 3dbk n THR 62 Ca -0.19 -0.82 -0.42 0.00 -2.27 0.00 0.00 64.05 60.35 3dbk n THR 62 Cb 0.52 0.70 -0.03 0.00 -2.10 0.00 0.00 70.33 69.42 3dbk n THR 62 CO 0.00 0.00 0.00 -0.47 -0.57 0.00 0.00 175.07 174.03 3dbk s TYR 63 N -0.71 3.31 0.09 4.78 5.04 -1.26 -4.23 117.35 124.38 3dbk s TYR 63 Ca 0.04 1.26 -0.12 0.00 -2.44 0.00 0.00 57.07 55.81 3dbk s TYR 63 Cb 0.02 -3.16 0.02 0.00 0.35 0.00 0.00 41.96 39.19 3dbk s TYR 63 CO 0.03 -0.45 0.29 -1.59 -1.34 0.00 0.00 175.55 172.49 3dbk s LYS 64 N 3.01 0.91 -0.03 4.97 -2.85 -1.26 -4.53 119.74 119.97 3dbk s LYS 64 Ca 0.39 -0.77 -0.24 0.00 -1.00 0.00 0.00 55.97 54.34 3dbk s LYS 64 Cb -0.15 0.39 -0.04 0.00 -2.06 0.00 0.00 37.83 35.97 3dbk s LYS 64 CO 0.07 -0.32 0.75 -1.14 0.10 0.00 0.00 175.35 174.81 3dbk s GLN 65 N -3.56 4.46 -0.25 1.78 0.74 -1.22 -3.55 119.66 118.06 3dbk s GLN 65 Ca 0.02 0.99 -0.20 0.00 0.05 0.00 0.00 55.36 56.22 3dbk s GLN 65 Cb 0.03 -3.42 0.07 0.00 1.10 0.00 0.00 33.01 30.78 3dbk s GLN 65 CO -0.10 0.12 0.64 0.54 -0.55 0.00 0.00 175.29 175.95 3dbk s VAL 66 N 0.56 -0.00 -1.57 1.34 0.11 -0.58 -4.97 120.40 115.29 3dbk s VAL 66 Ca 0.39 0.01 -0.05 0.00 -2.93 0.00 0.00 61.98 59.40 3dbk s VAL 66 Cb -0.19 -0.91 0.05 0.00 -1.53 0.00 0.00 36.38 33.80 3dbk s VAL 66 CO 0.21 0.00 0.26 -3.20 -3.33 0.00 0.00 175.10 169.04 3dbk n ASN 67 N 3.25 -0.15 0.00 3.54 5.15 -1.26 -0.88 115.26 124.91 3dbk n ASN 67 Ca -0.16 -1.18 0.00 0.00 -0.60 0.00 0.00 54.58 52.64 3dbk n ASN 67 Cb 0.56 -2.08 0.00 0.00 -0.53 0.00 0.00 39.78 37.73 3dbk n ASN 67 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 3dbk n GLY 68 N -2.11 1.24 3.81 8.20 0.00 -1.26 -4.31 105.19 110.76 3dbk n GLY 68 Ca -0.23 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.50 3dbk n GLY 68 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dbk s ALA 69 N -3.45 3.65 -0.03 4.61 0.00 -0.06 -0.96 121.76 125.53 3dbk s ALA 69 Ca 0.00 -1.05 0.09 0.00 0.00 0.00 0.00 51.96 51.01 3dbk s ALA 69 Cb 0.00 -1.49 -0.23 0.00 0.00 0.00 0.00 23.12 21.39 3dbk s ALA 69 CO 0.00 0.68 0.70 1.88 0.00 0.00 0.00 175.76 179.02 3dbk h TYR 70 N 2.94 0.07 -0.37 0.00 0.05 -1.53 -1.53 116.97 116.60 3dbk h TYR 70 Ca -0.47 -0.05 0.07 0.00 0.05 0.00 0.00 58.73 58.33 3dbk h TYR 70 Cb 1.17 -0.00 -0.17 0.00 1.01 0.00 0.00 36.73 38.74 3dbk h TYR 70 CO 0.59 1.10 -0.18 0.45 -1.05 0.00 0.00 178.16 179.07 3dbk s SER 71 N -6.29 -0.57 0.44 3.88 0.15 -1.23 -3.45 113.70 106.64 3dbk s SER 71 Ca -0.06 -0.34 0.12 0.00 0.70 0.00 0.00 55.95 56.37 3dbk s SER 71 Cb 0.08 0.73 1.02 0.00 -1.71 0.00 0.00 66.02 66.14 3dbk s SER 71 CO 0.82 -0.06 2.04 -0.65 1.20 0.00 0.00 173.24 176.59 3dbk h PRO 72 N 5.54 0.37 -0.29 5.44 0.11 -1.85 -2.10 132.00 139.22 3dbk h PRO 72 Ca -0.01 -0.02 -0.01 0.00 0.11 0.00 0.00 66.00 66.07 3dbk h PRO 72 Cb 1.21 -0.08 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 3dbk h PRO 72 CO -0.05 0.24 0.16 -0.07 -0.21 0.00 0.00 178.00 178.08 3dbk h LEU 73 N 0.38 0.36 -0.20 2.35 3.38 -1.90 0.65 115.31 120.32 3dbk h LEU 73 Ca 0.18 -0.08 -0.00 0.00 0.09 0.00 0.00 57.88 58.07 3dbk h LEU 73 Cb 0.25 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 3dbk h LEU 73 CO -0.04 0.34 0.12 0.78 0.09 0.00 0.00 178.44 179.72 3dbk h ASN 74 N 0.35 0.25 -0.34 -0.43 -0.26 -1.67 -1.60 115.58 111.88 3dbk h ASN 74 Ca 0.10 -0.06 -0.01 0.00 -0.56 0.00 0.00 56.30 55.77 3dbk h ASN 74 Cb 0.06 -0.06 -0.02 0.00 -1.06 0.00 0.00 38.32 37.24 3dbk h ASN 74 CO -0.02 0.24 0.18 0.44 -1.06 0.00 0.00 177.43 177.21 3dbk h ASP 75 N 0.24 0.43 -0.64 5.81 3.45 -1.29 -1.55 116.42 122.86 3dbk h ASP 75 Ca 0.07 -0.10 -0.01 0.00 0.43 0.00 0.00 57.03 57.43 3dbk h ASP 75 Cb 0.04 -0.11 -0.03 0.00 -0.56 0.00 0.00 39.33 38.67 3dbk h ASP 75 CO -0.01 0.41 0.37 0.00 -1.57 0.00 0.00 179.24 178.44 3dbk h ALA 76 N 1.04 0.82 -0.12 3.45 0.00 -0.75 0.12 119.26 123.81 3dbk h ALA 76 Ca 0.12 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 3dbk h ALA 76 Cb 0.08 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 3dbk h ALA 76 CO -0.02 0.32 0.03 1.25 0.00 0.00 0.00 179.25 180.83 3dbk h HIS 77 N 0.87 0.21 -0.17 0.00 -0.00 -1.16 -0.21 115.15 114.69 3dbk h HIS 77 Ca 0.23 -0.02 -0.00 0.00 -0.00 0.00 0.00 60.37 60.57 3dbk h HIS 77 Cb 0.01 -0.06 -0.01 0.00 -0.00 0.00 0.00 27.41 27.35 3dbk h HIS 77 CO -0.01 0.35 0.09 0.35 -0.00 0.00 0.00 177.93 178.70 3dbk h PHE 78 N 0.00 0.23 -0.10 5.26 3.57 -1.07 -2.36 116.94 122.48 3dbk h PHE 78 Ca 0.04 -0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.45 3dbk h PHE 78 Cb 0.25 -0.07 -0.01 0.00 2.79 0.00 0.00 35.95 38.90 3dbk h PHE 78 CO 0.00 0.24 -0.31 0.74 -2.23 0.00 0.00 178.31 176.76 3dbk h PHE 79 N 0.16 0.20 -0.86 0.41 0.05 -0.74 -0.98 116.94 115.18 3dbk h PHE 79 Ca 0.06 -0.04 -0.03 0.00 3.82 0.00 0.00 57.97 61.78 3dbk h PHE 79 Cb 0.09 -0.05 -0.04 0.00 2.00 0.00 0.00 35.95 37.95 3dbk h PHE 79 CO -0.03 0.48 0.44 0.78 -0.18 0.00 0.00 178.31 179.79 3dbk h GLY 80 N 1.04 1.32 1.06 -1.45 0.00 -0.85 -0.71 103.07 103.47 3dbk h GLY 80 Ca 0.02 -0.63 -0.07 0.00 0.00 0.00 0.00 47.33 46.66 3dbk h GLY 80 CO 0.05 0.60 0.16 -1.33 0.00 0.00 0.00 176.54 176.02 3dbk h GLY 81 N 1.23 1.19 0.95 4.60 0.00 -0.76 -1.43 103.07 108.86 3dbk h GLY 81 Ca 0.30 -0.75 -0.01 0.00 0.00 0.00 0.00 47.33 46.87 3dbk h GLY 81 CO -0.04 0.70 0.19 -2.08 0.00 0.00 0.00 176.54 175.31 3dbk h VAL 82 N 1.03 1.17 -0.80 4.60 2.07 -0.59 -0.58 116.25 123.15 3dbk h VAL 82 Ca 0.21 -0.48 -0.04 0.00 0.82 0.00 0.00 66.70 67.22 3dbk h VAL 82 Cb 0.38 0.77 -0.04 0.00 -1.52 0.00 0.00 31.29 30.88 3dbk h VAL 82 CO 0.00 0.18 0.35 0.58 0.02 0.00 0.00 177.57 178.71 3dbk h VAL 83 N 0.49 1.26 -0.39 2.57 2.07 -0.97 0.06 116.25 121.34 3dbk h VAL 83 Ca 0.13 -0.77 -0.02 0.00 0.82 0.00 0.00 66.70 66.86 3dbk h VAL 83 Cb 0.11 0.27 -0.02 0.00 -1.52 0.00 0.00 31.29 30.13 3dbk h VAL 83 CO -0.02 0.32 0.16 0.15 0.02 0.00 0.00 177.57 178.20 3dbk h PHE 84 N 1.15 0.59 -0.16 1.57 3.04 -0.97 -2.57 116.94 119.60 3dbk h PHE 84 Ca 0.27 -0.04 -0.07 0.00 3.98 0.00 0.00 57.97 62.11 3dbk h PHE 84 Cb 0.17 -0.18 -0.01 0.00 2.56 0.00 0.00 35.95 38.49 3dbk h PHE 84 CO 0.02 0.53 -0.21 0.87 -2.02 0.00 0.00 178.31 177.50 3dbk h LYS 85 N 0.48 0.27 0.02 1.11 1.57 -0.67 -1.67 116.57 117.68 3dbk h LYS 85 Ca 0.13 -0.08 -0.00 0.00 -1.87 0.00 0.00 60.65 58.83 3dbk h LYS 85 Cb 0.19 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.47 3dbk h LYS 85 CO -0.01 0.48 -0.01 1.25 -0.57 0.00 0.00 179.45 180.58 3dbk h LEU 86 N 0.25 -0.03 -1.16 2.94 6.46 -0.73 0.16 115.31 123.21 3dbk h LEU 86 Ca 0.04 -0.20 -0.06 0.00 -0.12 0.00 0.00 57.88 57.54 3dbk h LEU 86 Cb 0.52 0.01 -0.02 0.00 -0.73 0.00 0.00 40.66 40.44 3dbk h LEU 86 CO 0.03 0.18 -0.05 1.88 -0.62 0.00 0.00 178.44 179.87 3dbk h TYR 87 N -0.24 0.56 0.25 1.25 -1.99 -1.34 -0.63 116.97 114.83 3dbk h TYR 87 Ca -0.00 -0.07 -0.01 0.00 2.00 0.00 0.00 58.73 60.65 3dbk h TYR 87 Cb 0.22 -0.16 0.00 0.00 2.00 0.00 0.00 36.73 38.80 3dbk h TYR 87 CO -0.01 0.58 -0.12 -0.09 -0.00 0.00 0.00 178.16 178.52 3dbk h ARG 88 N 0.50 -0.32 -0.46 4.88 2.43 -1.07 -0.90 114.38 119.44 3dbk h ARG 88 Ca 0.10 0.02 -0.05 0.00 -0.81 0.00 0.00 59.98 59.24 3dbk h ARG 88 Cb 0.40 0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 30.00 3dbk h ARG 88 CO 0.02 0.00 0.08 -0.44 -1.51 0.00 0.00 179.97 178.12 3dbk h ASP 89 N -0.67 0.73 0.79 -3.80 3.45 -0.58 -0.15 116.42 116.19 3dbk h ASP 89 Ca -0.03 -0.26 -0.21 0.00 0.43 0.00 0.00 57.03 56.96 3dbk h ASP 89 Cb 0.47 -0.19 -0.03 0.00 -0.56 0.00 0.00 39.33 39.01 3dbk h ASP 89 CO 0.06 0.81 -1.32 -0.50 -1.57 0.00 0.00 179.24 176.71 3dbk h TRP 90 N 0.63 0.00 0.00 4.55 4.06 -1.22 -3.41 115.95 120.56 3dbk h TRP 90 Ca 0.14 0.00 0.00 0.00 2.06 0.00 0.00 58.89 61.09 3dbk h TRP 90 Cb 0.38 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.54 3dbk h TRP 90 CO 0.03 0.78 0.00 1.19 -3.56 0.00 0.00 178.44 176.88 3dbk n PHE 91 N -3.07 0.00 -3.17 0.49 3.72 -0.40 -5.03 117.46 110.00 3dbk n PHE 91 Ca -0.09 0.00 -0.23 0.00 -0.05 0.00 0.00 57.45 57.08 3dbk n PHE 91 Cb 0.91 0.00 0.05 0.00 -0.94 0.00 0.00 39.48 39.50 3dbk n PHE 91 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3dbk n GLY 92 N 0.03 -0.53 3.34 1.37 0.00 -0.07 -4.96 105.19 104.38 3dbk n GLY 92 Ca 0.00 0.17 -0.11 0.00 0.00 0.00 0.00 46.02 46.08 3dbk n GLY 92 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 3dbk s THR 93 N -3.22 0.05 0.46 2.61 -1.32 -1.16 -4.98 115.64 108.08 3dbk s THR 93 Ca 0.38 -0.43 -0.18 0.00 -1.21 0.00 0.00 61.69 60.26 3dbk s THR 93 Cb -0.17 -1.12 -0.09 0.00 -1.51 0.00 0.00 72.50 69.62 3dbk s THR 93 CO 0.47 -0.24 0.93 -0.55 -2.21 0.00 0.00 174.62 173.02 3dbk s SER 94 N -2.74 6.75 0.45 8.08 0.15 -1.26 -2.86 113.70 122.26 3dbk s SER 94 Ca 0.02 1.55 0.23 0.00 0.70 0.00 0.00 55.95 58.45 3dbk s SER 94 Cb 0.01 -2.49 1.04 0.00 -1.71 0.00 0.00 66.02 62.87 3dbk s SER 94 CO -0.12 -0.45 1.89 1.55 1.20 0.00 0.00 173.24 177.31 3dbk h PRO 95 N 1.43 0.00 -5.28 5.44 0.13 -1.89 -3.45 132.00 128.38 3dbk h PRO 95 Ca -0.48 0.00 -0.39 0.00 -0.87 0.00 0.00 66.00 64.27 3dbk h PRO 95 Cb 1.18 0.00 -0.14 0.00 0.13 0.00 0.00 31.00 32.17 3dbk h PRO 95 CO 0.62 0.23 -0.71 -0.51 -0.23 0.00 0.00 178.00 177.40 3dbk s LEU 96 N -7.13 2.51 0.00 1.56 1.43 -1.26 -3.79 118.68 111.99 3dbk s LEU 96 Ca -0.01 -1.05 0.31 0.00 -1.03 0.00 0.00 54.13 52.36 3dbk s LEU 96 Cb 0.12 -0.48 1.76 0.00 0.03 0.00 0.00 46.19 47.62 3dbk s LEU 96 CO 0.64 -0.29 2.16 0.35 0.23 0.00 0.00 176.35 179.44 3dbk n THR 97 N -0.31 0.00 -4.13 5.49 -2.24 -1.26 -4.84 114.28 106.99 3dbk n THR 97 Ca -0.09 -0.00 -0.14 0.00 -2.27 0.00 0.00 64.05 61.55 3dbk n THR 97 Cb 0.61 -0.50 -0.05 0.00 -2.10 0.00 0.00 70.33 68.29 3dbk n THR 97 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3dbk n HIS 98 N -1.10 -0.89 -1.79 4.78 -0.00 -1.26 -5.15 115.22 109.81 3dbk n HIS 98 Ca 0.20 -2.15 -0.35 0.00 -0.00 0.00 0.00 57.72 55.43 3dbk n HIS 98 Cb 0.16 0.32 0.05 0.00 -0.00 0.00 0.00 29.99 30.53 3dbk n HIS 98 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 176.34 176.49 3dbk s LYS 99 N -2.93 2.69 -0.31 -1.40 1.02 -1.26 -4.97 119.74 112.57 3dbk s LYS 99 Ca 0.29 1.72 -0.22 0.00 0.02 0.00 0.00 55.97 57.78 3dbk s LYS 99 Cb 0.01 -1.90 -0.00 0.00 -0.52 0.00 0.00 37.83 35.41 3dbk s LYS 99 CO 0.21 -1.40 0.73 -0.51 -0.92 0.00 0.00 175.35 173.46 3dbk s LEU 100 N -4.55 4.11 -0.32 3.17 1.02 -0.70 -4.99 118.68 116.42 3dbk s LEU 100 Ca 0.74 0.55 -0.09 0.00 0.02 0.00 0.00 54.13 55.36 3dbk s LEU 100 Cb -0.28 -2.98 0.01 0.00 0.02 0.00 0.00 46.19 42.96 3dbk s LEU 100 CO 0.38 -0.58 0.14 -0.31 0.02 0.00 0.00 176.35 176.01 3dbk s TYR 101 N 2.85 3.19 -0.45 0.29 2.02 -1.26 -0.43 117.35 123.56 3dbk s TYR 101 Ca 0.30 -0.82 -0.15 0.00 -0.37 0.00 0.00 57.07 56.03 3dbk s TYR 101 Cb -0.14 -2.34 0.06 0.00 -0.40 0.00 0.00 41.96 39.13 3dbk s TYR 101 CO 0.13 -0.55 0.35 -1.64 -1.57 0.00 0.00 175.55 172.27 3dbk s MET 102 N 1.56 2.95 -0.47 -0.62 -1.94 0.67 -1.27 119.30 120.17 3dbk s MET 102 Ca 0.03 -1.25 -0.16 0.00 -1.71 0.00 0.00 55.69 52.60 3dbk s MET 102 Cb -0.18 -4.05 0.07 0.00 2.01 0.00 0.00 34.83 32.68 3dbk s MET 102 CO 0.05 -0.93 0.41 0.15 -0.01 0.00 0.00 175.02 174.70 3dbk s LYS 103 N 1.63 2.99 0.23 2.03 1.02 0.35 -0.16 119.74 127.84 3dbk s LYS 103 Ca 0.04 -1.30 0.01 0.00 0.02 0.00 0.00 55.97 54.74 3dbk s LYS 103 Cb -0.22 -4.13 -0.04 0.00 -0.52 0.00 0.00 37.83 32.92 3dbk s LYS 103 CO 0.07 -1.04 0.40 0.08 -0.92 0.00 0.00 175.35 173.95 3dbk s VAL 104 N 1.73 5.21 -1.33 3.17 1.01 -0.17 -0.64 120.40 129.39 3dbk s VAL 104 Ca 0.05 -0.54 -0.07 0.00 0.00 0.00 0.00 61.98 61.42 3dbk s VAL 104 Cb -0.24 -3.78 0.01 0.00 0.00 0.00 0.00 36.38 32.37 3dbk s VAL 104 CO 0.07 -0.27 0.98 1.41 0.00 0.00 0.00 175.10 177.30 3dbk n HIS 105 N -1.00 -2.51 -2.48 5.22 8.25 -1.05 -0.66 115.22 120.99 3dbk n HIS 105 Ca -0.06 0.84 -0.42 0.00 -0.26 0.00 0.00 57.72 57.82 3dbk n HIS 105 Cb 0.55 -4.69 -0.03 0.00 1.12 0.00 0.00 29.99 26.95 3dbk n HIS 105 CO 0.00 0.00 0.00 -0.47 0.64 0.00 0.00 176.34 176.51 3dbk s TYR 106 N -3.26 3.18 0.06 4.41 5.04 -0.78 -0.09 117.35 125.91 3dbk s TYR 106 Ca 0.49 1.23 0.00 0.00 -2.44 0.00 0.00 57.07 56.35 3dbk s TYR 106 Cb -0.21 -3.41 0.00 0.00 0.35 0.00 0.00 41.96 38.69 3dbk s TYR 106 CO 0.60 -1.25 0.00 0.41 -1.34 0.00 0.00 175.55 173.97 3dbk n GLY 107 N 3.37 -1.61 3.41 8.97 0.00 -0.45 -4.36 105.19 114.52 3dbk n GLY 107 Ca 0.11 -1.21 -0.42 0.00 0.00 0.00 0.00 46.02 44.49 3dbk n GLY 107 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3dbk s ARG 108 N -0.54 2.90 -1.54 1.61 0.52 -1.25 -4.20 118.95 116.45 3dbk s ARG 108 Ca 0.00 -1.10 -0.09 0.00 -0.52 0.00 0.00 55.73 54.02 3dbk s ARG 108 Cb 0.00 -3.91 0.07 0.00 0.52 0.00 0.00 34.95 31.63 3dbk s ARG 108 CO 0.00 -0.78 0.62 0.43 0.02 0.00 0.00 175.30 175.60 3dbk n SER 109 N 5.10 -1.96 -4.66 0.23 7.64 -1.26 -4.88 113.62 113.82 3dbk n SER 109 Ca -0.11 -0.98 -0.43 0.00 1.01 0.00 0.00 58.87 58.36 3dbk n SER 109 Cb 0.46 -3.04 -0.02 0.00 -1.01 0.00 0.00 64.21 60.60 3dbk n SER 109 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 3dbk s VAL 110 N -3.63 4.23 -1.24 0.44 1.01 -1.26 -4.47 120.40 115.48 3dbk s VAL 110 Ca 0.36 1.50 -0.05 0.00 0.00 0.00 0.00 61.98 63.79 3dbk s VAL 110 Cb -0.19 -3.97 0.11 0.00 0.00 0.00 0.00 36.38 32.32 3dbk s VAL 110 CO 0.90 -0.11 2.45 -0.62 0.00 0.00 0.00 175.10 177.71 3dbk n GLU 111 N 6.43 4.37 -3.82 2.72 -0.58 -1.26 -1.13 120.64 127.37 3dbk n GLU 111 Ca 0.14 -3.31 0.01 0.00 -0.42 0.00 0.00 57.16 53.57 3dbk n GLU 111 Cb 0.45 -2.59 0.01 0.00 -0.57 0.00 0.00 31.44 28.74 3dbk n GLU 111 CO 0.00 0.00 0.00 1.21 -0.48 0.00 0.00 177.13 177.86 3dbk s ASN 112 N 0.43 -0.03 0.02 1.62 3.84 -1.26 -5.01 114.94 114.55 3dbk s ASN 112 Ca 0.55 -0.30 -0.05 0.00 0.21 0.00 0.00 52.86 53.27 3dbk s ASN 112 Cb 0.20 0.26 -0.01 0.00 -0.55 0.00 0.00 41.25 41.15 3dbk s ASN 112 CO -0.11 -0.50 0.08 0.00 -2.79 0.00 0.00 177.10 173.79 3dbk s ALA 113 N -2.30 -0.09 0.18 1.71 0.00 -1.26 -1.63 121.76 118.37 3dbk s ALA 113 Ca 0.21 -0.46 -0.09 0.00 0.00 0.00 0.00 51.96 51.62 3dbk s ALA 113 Cb 0.01 0.19 -0.01 0.00 0.00 0.00 0.00 23.12 23.31 3dbk s ALA 113 CO -0.00 -0.26 0.31 0.71 0.00 0.00 0.00 175.76 176.52 3dbk s TYR 114 N -2.08 0.42 -0.21 0.00 1.51 0.28 -4.97 117.35 112.30 3dbk s TYR 114 Ca -0.10 -0.77 0.01 0.00 -1.01 0.00 0.00 57.07 55.21 3dbk s TYR 114 Cb -0.04 -0.03 0.03 0.00 -0.11 0.00 0.00 41.96 41.80 3dbk s TYR 114 CO -0.02 -0.76 -0.15 -0.46 -1.11 0.00 0.00 175.55 173.04 3dbk s TRP 115 N -3.98 2.97 -1.36 2.71 -0.11 -1.26 -0.39 118.94 117.52 3dbk s TRP 115 Ca 0.19 -1.83 0.19 0.00 1.22 0.00 0.00 56.10 55.87 3dbk s TRP 115 Cb 0.03 -1.94 0.65 0.00 -1.50 0.00 0.00 33.47 30.71 3dbk s TRP 115 CO 0.02 -0.82 1.56 -0.40 -4.62 0.00 0.00 176.95 172.69 3dbk n ASP 116 N 4.57 4.29 0.00 5.86 5.68 -0.65 -4.92 116.55 131.38 3dbk n ASP 116 Ca -0.18 -2.28 0.00 0.00 -0.50 0.00 0.00 54.79 51.83 3dbk n ASP 116 Cb 0.47 -0.51 0.00 0.00 -1.14 0.00 0.00 41.12 39.94 3dbk n ASP 116 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 3dbk n GLY 117 N 1.18 1.51 0.00 6.12 0.00 -1.26 -4.77 105.19 107.98 3dbk n GLY 117 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.26 3dbk n GLY 117 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3dbk n THR 118 N -1.92 0.00 -4.11 2.61 -2.24 -1.26 -5.13 114.28 102.23 3dbk n THR 118 Ca 0.00 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.65 3dbk n THR 118 Cb 0.00 -0.13 -0.06 0.00 -2.10 0.00 0.00 70.33 68.03 3dbk n THR 118 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3dbk s ALA 119 N -1.14 0.67 -0.19 6.98 0.00 -1.26 -4.68 121.76 122.13 3dbk s ALA 119 Ca 0.00 -1.42 -0.06 0.00 0.00 0.00 0.00 51.96 50.47 3dbk s ALA 119 Cb 0.00 1.22 -0.03 0.00 0.00 0.00 0.00 23.12 24.31 3dbk s ALA 119 CO 0.00 -0.74 0.04 -1.64 0.00 0.00 0.00 175.76 173.42 3dbk s MET 120 N -3.69 3.83 -0.10 0.00 -1.94 -0.40 -1.64 119.30 115.35 3dbk s MET 120 Ca 0.31 -0.42 -0.00 0.00 -1.71 0.00 0.00 55.69 53.87 3dbk s MET 120 Cb 0.02 -3.16 -0.03 0.00 2.01 0.00 0.00 34.83 33.67 3dbk s MET 120 CO 0.15 0.16 -0.09 -0.51 -0.01 0.00 0.00 175.02 174.73 3dbk s LEU 121 N 0.64 3.03 -0.12 -0.03 1.43 0.48 -0.49 118.68 123.61 3dbk s LEU 121 Ca 0.02 -0.14 -0.00 0.00 -1.03 0.00 0.00 54.13 52.97 3dbk s LEU 121 Cb -0.13 -1.68 0.03 0.00 0.03 0.00 0.00 46.19 44.43 3dbk s LEU 121 CO 0.02 0.27 -0.09 -0.36 0.23 0.00 0.00 176.35 176.42 3dbk s PHE 122 N -0.24 1.61 0.75 0.29 0.40 0.19 -0.56 117.98 120.43 3dbk s PHE 122 Ca 0.03 -0.84 -0.12 0.00 -0.60 0.00 0.00 56.93 55.40 3dbk s PHE 122 Cb -0.13 -1.30 0.04 0.00 0.51 0.00 0.00 43.02 42.14 3dbk s PHE 122 CO 0.03 -0.55 1.13 0.20 0.70 0.00 0.00 175.22 176.73 3dbk s GLY 123 N 1.67 1.61 0.00 4.36 0.00 -0.64 -1.87 107.32 112.45 3dbk s GLY 123 Ca 0.05 -0.45 0.27 0.00 0.00 0.00 0.00 44.72 44.59 3dbk s GLY 123 CO -0.09 -0.03 1.61 1.22 0.00 0.00 0.00 173.10 175.82 3dbk n ASP 124 N -3.17 0.76 -0.46 1.64 8.00 -1.20 -1.56 116.55 120.56 3dbk n ASP 124 Ca 0.07 -0.64 0.00 0.00 0.71 0.00 0.00 54.79 54.93 3dbk n ASP 124 Cb 0.59 0.09 0.00 0.00 -0.02 0.00 0.00 41.12 41.77 3dbk n ASP 124 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 3dbk n GLY 125 N 1.36 -1.51 0.00 0.44 0.00 -0.28 -2.58 105.19 102.63 3dbk n GLY 125 Ca 0.11 -1.22 0.00 0.00 0.00 0.00 0.00 46.02 44.91 3dbk n GLY 125 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dbk n ALA 126 N 0.07 0.05 -0.05 4.61 0.00 -0.83 -4.19 120.51 120.17 3dbk n ALA 126 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.43 3dbk n ALA 126 Cb 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 19.32 3dbk n ALA 126 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3dbk n THR 127 N 0.00 0.63 0.09 0.00 -2.24 -1.26 -4.58 114.28 106.92 3dbk n THR 127 Ca 0.00 -0.55 -0.22 0.00 -2.27 0.00 0.00 64.05 61.01 3dbk n THR 127 Cb 0.00 -0.29 -0.15 0.00 -2.10 0.00 0.00 70.33 67.79 3dbk n THR 127 CO 0.00 0.00 0.00 -0.03 -0.57 0.00 0.00 175.07 174.47 3dbk h MET 128 N 0.00 0.40 -5.08 -0.78 1.85 -1.95 -3.43 114.93 105.94 3dbk h MET 128 Ca -0.25 -0.68 -0.34 0.00 -0.61 0.00 0.00 59.70 57.82 3dbk h MET 128 Cb 1.48 0.25 -0.16 0.00 0.43 0.00 0.00 31.60 33.60 3dbk h MET 128 CO 0.01 1.31 -0.73 -0.06 -0.40 0.00 0.00 176.91 177.05 3dbk s PHE 129 N -2.59 1.22 0.75 1.39 0.08 -1.26 -1.34 117.98 116.22 3dbk s PHE 129 Ca -0.13 -0.69 -0.06 0.00 0.12 0.00 0.00 56.93 56.16 3dbk s PHE 129 Cb 0.05 -0.63 0.10 0.00 -0.57 0.00 0.00 43.02 41.97 3dbk s PHE 129 CO 0.88 0.06 1.05 0.71 -0.10 0.00 0.00 175.22 177.82 3dbk s TYR 130 N -2.85 2.31 0.12 0.36 1.51 0.35 -1.97 117.35 117.18 3dbk s TYR 130 Ca 0.12 0.20 -0.35 0.00 -1.01 0.00 0.00 57.07 56.02 3dbk s TYR 130 Cb -0.00 -3.29 -0.16 0.00 -0.11 0.00 0.00 41.96 38.39 3dbk s TYR 130 CO 0.01 -1.69 1.33 -2.30 -1.11 0.00 0.00 175.55 171.78 3dbk n PRO 131 N -3.02 1.30 -1.58 -1.71 -0.02 -1.06 -4.32 135.00 124.58 3dbk n PRO 131 Ca 0.11 0.47 -0.41 0.00 -2.02 0.00 0.00 63.50 61.65 3dbk n PRO 131 Cb 0.60 -2.09 -0.01 0.00 -0.02 0.00 0.00 33.50 31.98 3dbk n PRO 131 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 3dbk n LEU 132 N 2.49 7.70 -2.28 2.45 4.32 -0.60 -4.55 117.00 126.52 3dbk n LEU 132 Ca 0.17 -4.27 -0.17 0.00 -0.02 0.00 0.00 56.01 51.72 3dbk n LEU 132 Cb 0.22 -1.60 0.03 0.00 -1.62 0.00 0.00 43.42 40.44 3dbk n LEU 132 CO 0.62 1.55 0.12 0.52 -1.22 0.00 0.00 177.39 178.98 3dbk n VAL 133 N 4.32 2.13 -1.96 4.08 0.31 -1.26 -4.70 118.33 121.25 3dbk n VAL 133 Ca 0.63 -3.82 -0.30 0.00 -0.01 0.00 0.00 64.34 60.85 3dbk n VAL 133 Cb 0.32 -0.38 0.05 0.00 -0.91 0.00 0.00 33.84 32.92 3dbk n VAL 133 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 3dbk s SER 134 N -3.66 5.40 0.19 4.52 1.04 -1.26 -4.50 113.70 115.41 3dbk s SER 134 Ca 0.43 1.04 -0.12 0.00 0.48 0.00 0.00 55.95 57.79 3dbk s SER 134 Cb 0.38 -1.84 0.11 0.00 0.10 0.00 0.00 66.02 64.76 3dbk s SER 134 CO 0.01 -1.35 1.81 0.25 0.98 0.00 0.00 173.24 174.95 3dbk h LEU 135 N -0.62 0.80 -1.22 2.42 5.85 -1.96 -1.37 115.31 119.21 3dbk h LEU 135 Ca -0.45 -0.08 -0.07 0.00 0.84 0.00 0.00 57.88 58.12 3dbk h LEU 135 Cb 1.26 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 42.08 3dbk h LEU 135 CO 0.64 0.65 -0.35 -2.24 -0.34 0.00 0.00 178.44 176.80 3dbk h ASP 136 N 0.88 0.00 -0.12 1.25 -0.00 -1.94 -1.57 116.42 114.93 3dbk h ASP 136 Ca 0.23 0.00 -0.22 0.00 -0.00 0.00 0.00 57.03 57.04 3dbk h ASP 136 Cb 0.01 0.00 0.01 0.00 -0.00 0.00 0.00 39.33 39.36 3dbk h ASP 136 CO -0.04 0.35 -0.79 0.58 -0.00 0.00 0.00 179.24 179.34 3dbk h VAL 137 N 0.00 1.29 -0.49 4.15 2.07 -1.82 -0.51 116.25 120.93 3dbk h VAL 137 Ca -0.00 -2.00 0.02 0.00 0.82 0.00 0.00 66.70 65.54 3dbk h VAL 137 Cb 0.72 2.08 -0.03 0.00 -1.52 0.00 0.00 31.29 32.54 3dbk h VAL 137 CO 0.05 0.63 0.30 0.00 0.02 0.00 0.00 177.57 178.56 3dbk h ALA 138 N 0.51 0.63 -0.54 1.67 0.00 -0.99 -1.35 119.26 119.19 3dbk h ALA 138 Ca -0.06 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.75 3dbk h ALA 138 Cb 1.43 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 19.04 3dbk h ALA 138 CO 0.16 0.00 0.01 0.00 0.00 0.00 0.00 179.25 179.43 3dbk h ALA 139 N 1.21 1.01 -0.03 0.00 0.00 -1.26 -1.80 119.26 118.40 3dbk h ALA 139 Ca 0.20 -0.28 0.01 0.00 0.00 0.00 0.00 54.91 54.83 3dbk h ALA 139 Cb 0.00 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 3dbk h ALA 139 CO -0.08 0.61 -0.02 1.25 0.00 0.00 0.00 179.25 181.01 3dbk h HIS 140 N 0.85 -0.04 -0.23 0.00 6.17 -0.41 -0.47 115.15 121.02 3dbk h HIS 140 Ca 0.16 0.00 -0.06 0.00 0.71 0.00 0.00 60.37 61.19 3dbk h HIS 140 Cb 0.48 0.02 -0.01 0.00 2.52 0.00 0.00 27.41 30.43 3dbk h HIS 140 CO 0.03 -0.03 -0.08 0.93 0.71 0.00 0.00 177.93 179.49 3dbk h GLU 141 N -0.02 0.46 -0.90 5.26 4.39 -1.16 -2.80 114.58 119.80 3dbk h GLU 141 Ca 0.02 -0.19 0.00 0.00 0.34 0.00 0.00 59.36 59.53 3dbk h GLU 141 Cb 0.04 -0.02 -0.04 0.00 -0.10 0.00 0.00 28.75 28.63 3dbk h GLU 141 CO -0.04 0.72 0.57 0.28 -1.16 0.00 0.00 179.01 179.37 3dbk h VAL 142 N 0.18 1.24 0.00 3.13 2.07 -1.30 -2.25 116.25 119.33 3dbk h VAL 142 Ca 0.05 -0.49 -0.01 0.00 0.82 0.00 0.00 66.70 67.07 3dbk h VAL 142 Cb 0.56 -0.05 -0.00 0.00 -1.52 0.00 0.00 31.29 30.28 3dbk h VAL 142 CO 0.03 0.25 -0.04 0.28 0.02 0.00 0.00 177.57 178.10 3dbk h SER 143 N 1.24 0.00 -0.10 0.57 0.02 -0.98 -0.21 113.55 114.09 3dbk h SER 143 Ca 0.33 0.00 -0.10 0.00 -0.84 0.00 0.00 61.79 61.17 3dbk h SER 143 Cb -0.09 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.44 3dbk h SER 143 CO -0.07 0.04 -0.27 0.45 -1.14 0.00 0.00 176.83 175.85 3dbk h HIS 144 N 0.00 0.62 -0.40 3.45 -0.00 -1.14 -0.53 115.15 117.16 3dbk h HIS 144 Ca -0.00 -0.14 -0.09 0.00 -0.00 0.00 0.00 60.37 60.14 3dbk h HIS 144 Cb 0.35 -0.15 -0.01 0.00 -0.00 0.00 0.00 27.41 27.60 3dbk h HIS 144 CO 0.00 0.76 -0.12 0.78 -0.00 0.00 0.00 177.93 179.35 3dbk h GLY 145 N 1.02 0.85 0.75 2.45 0.00 -1.06 -1.22 103.07 105.86 3dbk h GLY 145 Ca 0.07 -0.72 0.03 0.00 0.00 0.00 0.00 47.33 46.71 3dbk h GLY 145 CO 0.05 0.65 0.01 -2.75 0.00 0.00 0.00 176.54 174.51 3dbk h PHE 146 N 0.60 0.01 -0.41 5.60 3.57 -0.99 -1.18 116.94 124.13 3dbk h PHE 146 Ca 0.10 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.61 3dbk h PHE 146 Cb 0.65 0.02 -0.02 0.00 2.79 0.00 0.00 35.95 39.39 3dbk h PHE 146 CO 0.05 -0.01 0.25 1.15 -2.23 0.00 0.00 178.31 177.52 3dbk h THR 147 N 0.08 1.13 -0.73 4.41 2.02 -1.00 -1.56 112.91 117.26 3dbk h THR 147 Ca 0.08 -0.31 0.05 0.00 0.77 0.00 0.00 66.41 67.01 3dbk h THR 147 Cb 0.10 0.59 -0.04 0.00 -1.74 0.00 0.00 68.15 67.06 3dbk h THR 147 CO -0.13 0.13 0.48 -0.08 0.37 0.00 0.00 175.52 176.29 3dbk h GLU 148 N 0.54 0.78 -0.01 6.66 4.81 -0.91 0.18 114.58 126.63 3dbk h GLU 148 Ca 0.15 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.33 3dbk h GLU 148 Cb 0.00 -0.18 0.00 0.00 0.63 0.00 0.00 28.75 29.21 3dbk h GLU 148 CO -0.03 0.52 -0.03 1.04 -0.73 0.00 0.00 179.01 179.78 3dbk n GLN 149 N -4.47 1.50 0.00 1.92 6.02 -0.47 -4.14 117.38 117.73 3dbk n GLN 149 Ca 0.10 -0.81 0.00 0.00 -0.01 0.00 0.00 57.00 56.28 3dbk n GLN 149 Cb 0.19 -1.48 0.00 0.00 1.02 0.00 0.00 30.24 29.97 3dbk n GLN 149 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 3dbk n ASN 150 N -0.04 0.00 -0.27 1.08 3.02 -0.63 -4.91 115.26 113.50 3dbk n ASN 150 Ca 0.19 0.00 0.03 0.00 -0.03 0.00 0.00 54.58 54.77 3dbk n ASN 150 Cb 0.33 0.00 0.24 0.00 -0.61 0.00 0.00 39.78 39.74 3dbk n ASN 150 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 3dbk h SER 151 N 0.00 0.89 -0.01 6.41 4.64 -1.31 -3.46 113.55 120.70 3dbk h SER 151 Ca 0.00 -0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 3dbk h SER 151 Cb 0.00 -0.20 -0.00 0.00 -0.31 0.00 0.00 62.40 61.89 3dbk h SER 151 CO 0.00 0.60 -0.01 0.61 -0.87 0.00 0.00 176.83 177.16 3dbk n GLY 152 N -1.41 0.41 3.71 -0.77 0.00 0.54 -2.41 105.19 105.26 3dbk n GLY 152 Ca 0.12 -1.05 -0.65 0.00 0.00 0.00 0.00 46.02 44.44 3dbk n GLY 152 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3dbk n LEU 153 N -0.03 1.23 -4.89 0.99 4.77 -1.26 -4.51 117.00 113.30 3dbk n LEU 153 Ca -0.00 1.17 -0.29 0.00 -0.03 0.00 0.00 56.01 56.85 3dbk n LEU 153 Cb 0.01 -0.93 0.05 0.00 -2.33 0.00 0.00 43.42 40.22 3dbk n LEU 153 CO 0.00 -0.93 0.71 0.27 -1.33 0.00 0.00 177.39 176.12 3dbk s ILE 154 N 2.63 3.21 0.19 -0.08 -4.36 -0.22 -4.89 121.20 117.67 3dbk s ILE 154 Ca 1.02 0.28 0.15 0.00 -0.26 0.00 0.00 60.65 61.84 3dbk s ILE 154 Cb -1.40 -3.37 0.05 0.00 1.25 0.00 0.00 42.46 39.00 3dbk s ILE 154 CO 0.76 -0.47 1.65 0.22 0.24 0.00 0.00 174.94 177.34 3dbk h TYR 155 N -0.63 0.00 -3.91 1.37 5.03 -1.90 -2.19 116.97 114.73 3dbk h TYR 155 Ca -0.45 0.00 -0.49 0.00 2.58 0.00 0.00 58.73 60.37 3dbk h TYR 155 Cb 1.27 0.00 0.01 0.00 1.55 0.00 0.00 36.73 39.56 3dbk h TYR 155 CO 0.46 0.50 0.42 1.03 -1.32 0.00 0.00 178.16 179.25 3dbk s ARG 156 N -3.53 4.35 2.30 1.82 0.52 -1.26 -3.61 118.95 119.54 3dbk s ARG 156 Ca -0.00 1.57 0.00 0.00 -0.52 0.00 0.00 55.73 56.78 3dbk s ARG 156 Cb 0.11 -2.75 0.00 0.00 0.52 0.00 0.00 34.95 32.83 3dbk s ARG 156 CO 0.72 0.01 0.00 0.41 0.02 0.00 0.00 175.30 176.47 3dbk n GLY 157 N 0.62 -0.67 0.28 -3.53 0.00 -1.26 -3.69 105.19 96.93 3dbk n GLY 157 Ca 0.03 -1.14 0.16 0.00 0.00 0.00 0.00 46.02 45.06 3dbk n GLY 157 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 3dbk h GLN 158 N 0.00 0.00 -0.85 1.61 4.20 -1.90 -2.66 115.11 115.52 3dbk h GLN 158 Ca 0.00 0.00 0.07 0.00 0.06 0.00 0.00 58.65 58.78 3dbk h GLN 158 Cb 0.00 0.00 -0.06 0.00 0.30 0.00 0.00 27.48 27.72 3dbk h GLN 158 CO 0.00 0.07 0.55 0.77 -0.67 0.00 0.00 178.83 179.55 3dbk h SER 159 N 0.00 0.81 -0.64 1.46 0.02 -1.64 -1.70 113.55 111.87 3dbk h SER 159 Ca -0.00 0.01 -0.03 0.00 -0.84 0.00 0.00 61.79 60.93 3dbk h SER 159 Cb 0.39 -0.17 -0.03 0.00 0.14 0.00 0.00 62.40 62.73 3dbk h SER 159 CO 0.01 0.52 0.29 1.23 -1.14 0.00 0.00 176.83 177.74 3dbk h GLY 160 N 0.92 1.01 1.45 -3.77 0.00 -1.01 -0.34 103.07 101.33 3dbk h GLY 160 Ca 0.37 -0.52 -0.10 0.00 0.00 0.00 0.00 47.33 47.08 3dbk h GLY 160 CO -0.14 0.49 -0.19 -1.33 0.00 0.00 0.00 176.54 175.37 3dbk h GLY 161 N 0.89 0.70 1.61 4.60 0.00 -1.51 -1.89 103.07 107.48 3dbk h GLY 161 Ca 0.22 -0.55 -0.11 0.00 0.00 0.00 0.00 47.33 46.88 3dbk h GLY 161 CO -0.02 0.51 -0.36 -0.33 0.00 0.00 0.00 176.54 176.33 3dbk h MET 162 N 0.57 0.43 -0.03 4.80 2.86 -0.94 0.11 114.93 122.73 3dbk h MET 162 Ca 0.09 -0.20 -0.00 0.00 -2.06 0.00 0.00 59.70 57.53 3dbk h MET 162 Cb 0.65 -0.01 -0.00 0.00 0.06 0.00 0.00 31.60 32.30 3dbk h MET 162 CO 0.05 0.74 0.01 -0.97 1.06 0.00 0.00 176.91 177.79 3dbk h ASN 163 N 0.37 0.04 -0.75 1.22 -0.73 -0.74 -0.87 115.58 114.12 3dbk h ASN 163 Ca 0.04 -0.20 -0.02 0.00 1.87 0.00 0.00 56.30 57.99 3dbk h ASN 163 Cb 0.81 -0.01 -0.03 0.00 0.27 0.00 0.00 38.32 39.35 3dbk h ASN 163 CO 0.07 0.23 0.38 -0.33 -0.37 0.00 0.00 177.43 177.40 3dbk h GLU 164 N -0.15 1.07 -0.70 6.67 4.39 -1.18 -2.72 114.58 121.96 3dbk h GLU 164 Ca 0.01 -0.15 -0.02 0.00 0.34 0.00 0.00 59.36 59.54 3dbk h GLU 164 Cb 0.20 -0.20 -0.03 0.00 -0.10 0.00 0.00 28.75 28.62 3dbk h GLU 164 CO -0.00 0.83 0.38 0.00 -1.16 0.00 0.00 179.01 179.06 3dbk h ALA 165 N 1.19 0.90 -0.71 3.43 0.00 -0.79 -1.94 119.26 121.35 3dbk h ALA 165 Ca 0.26 -0.12 0.03 0.00 0.00 0.00 0.00 54.91 55.09 3dbk h ALA 165 Cb 0.09 -0.28 -0.05 0.00 0.00 0.00 0.00 17.79 17.56 3dbk h ALA 165 CO -0.04 0.43 0.44 0.35 0.00 0.00 0.00 179.25 180.43 3dbk h PHE 166 N 0.97 0.83 -0.44 0.00 3.57 -0.92 0.66 116.94 121.62 3dbk h PHE 166 Ca 0.25 0.02 -0.05 0.00 3.53 0.00 0.00 57.97 61.72 3dbk h PHE 166 Cb 0.05 -0.27 -0.02 0.00 2.79 0.00 0.00 35.95 38.50 3dbk h PHE 166 CO -0.00 0.47 0.06 0.77 -2.23 0.00 0.00 178.31 177.37 3dbk h SER 167 N 0.86 0.63 -0.43 0.41 0.02 -1.15 -0.49 113.55 113.40 3dbk h SER 167 Ca 0.29 -0.12 -0.13 0.00 -0.84 0.00 0.00 61.79 60.99 3dbk h SER 167 Cb 0.03 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.39 3dbk h SER 167 CO -0.11 0.67 -0.24 0.44 -1.14 0.00 0.00 176.83 176.45 3dbk h ASP 168 N 0.65 0.96 -0.92 3.07 3.45 -0.56 -2.54 116.42 120.54 3dbk h ASP 168 Ca 0.14 -0.41 -0.01 0.00 0.43 0.00 0.00 57.03 57.17 3dbk h ASP 168 Cb 0.32 -0.27 -0.04 0.00 -0.56 0.00 0.00 39.33 38.78 3dbk h ASP 168 CO 0.01 1.16 0.51 0.24 -1.57 0.00 0.00 179.24 179.59 3dbk h MET 169 N 0.76 1.27 -0.62 3.56 2.86 -0.46 -2.12 114.93 120.18 3dbk h MET 169 Ca 0.09 -0.14 -0.01 0.00 -2.06 0.00 0.00 59.70 57.58 3dbk h MET 169 Cb 0.81 -0.25 -0.03 0.00 0.06 0.00 0.00 31.60 32.19 3dbk h MET 169 CO 0.07 0.92 0.33 0.00 1.06 0.00 0.00 176.91 179.29 3dbk h ALA 170 N 1.28 1.42 -0.69 6.32 0.00 -0.90 -0.22 119.26 126.47 3dbk h ALA 170 Ca 0.32 -0.10 -0.06 0.00 0.00 0.00 0.00 54.91 55.08 3dbk h ALA 170 Cb 0.01 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.52 3dbk h ALA 170 CO -0.05 0.48 0.22 0.78 0.00 0.00 0.00 179.25 180.67 3dbk h GLY 171 N 0.93 1.16 1.31 0.00 0.00 -0.97 -0.39 103.07 105.11 3dbk h GLY 171 Ca 0.22 -0.69 -0.15 0.00 0.00 0.00 0.00 47.33 46.72 3dbk h GLY 171 CO -0.03 0.64 -0.39 0.83 0.00 0.00 0.00 176.54 177.59 3dbk h GLU 172 N 1.02 0.76 -0.72 4.80 4.39 -1.04 -2.35 114.58 121.44 3dbk h GLU 172 Ca 0.22 -0.39 -0.05 0.00 0.34 0.00 0.00 59.36 59.48 3dbk h GLU 172 Cb 0.30 0.01 -0.03 0.00 -0.10 0.00 0.00 28.75 28.93 3dbk h GLU 172 CO -0.01 1.01 0.24 0.00 -1.16 0.00 0.00 179.01 179.10 3dbk h ALA 173 N 0.94 0.95 -0.63 3.43 0.00 -0.77 -1.03 119.26 122.14 3dbk h ALA 173 Ca 0.05 -0.21 -0.03 0.00 0.00 0.00 0.00 54.91 54.72 3dbk h ALA 173 Cb 0.94 -0.28 -0.03 0.00 0.00 0.00 0.00 17.79 18.42 3dbk h ALA 173 CO 0.09 0.61 0.27 0.00 0.00 0.00 0.00 179.25 180.21 3dbk h ALA 174 N 1.12 0.81 -0.44 0.00 0.00 -0.92 0.17 119.26 120.00 3dbk h ALA 174 Ca 0.24 -0.16 -0.02 0.00 0.00 0.00 0.00 54.91 54.96 3dbk h ALA 174 Cb 0.28 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.80 3dbk h ALA 174 CO -0.01 0.41 0.19 0.93 0.00 0.00 0.00 179.25 180.77 3dbk h GLU 175 N 0.87 0.64 -0.63 0.00 5.08 -1.14 -1.08 114.58 118.33 3dbk h GLU 175 Ca 0.21 -0.11 -0.02 0.00 -1.00 0.00 0.00 59.36 58.45 3dbk h GLU 175 Cb 0.18 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.29 3dbk h GLU 175 CO -0.02 0.58 0.33 0.35 -1.00 0.00 0.00 179.01 179.25 3dbk h PHE 176 N 0.56 0.87 -0.66 4.33 3.57 -0.83 0.31 116.94 125.09 3dbk h PHE 176 Ca 0.15 -0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.62 3dbk h PHE 176 Cb 0.16 -0.28 -0.03 0.00 2.79 0.00 0.00 35.95 38.59 3dbk h PHE 176 CO -0.00 0.64 0.41 -0.92 -2.23 0.00 0.00 178.31 176.20 3dbk h TYR 177 N 0.86 0.86 0.15 0.41 5.03 -0.39 0.20 116.97 124.07 3dbk h TYR 177 Ca 0.22 0.00 -0.26 0.00 2.58 0.00 0.00 58.73 61.27 3dbk h TYR 177 Cb 0.06 -0.28 0.01 0.00 1.55 0.00 0.00 36.73 38.07 3dbk h TYR 177 CO -0.01 0.57 -1.28 1.98 -1.32 0.00 0.00 178.16 178.10 3dbk h MET 178 N 0.90 0.31 0.00 1.82 4.05 -0.91 -3.40 114.93 117.69 3dbk h MET 178 Ca 0.24 -0.53 0.00 0.00 -0.28 0.00 0.00 59.70 59.13 3dbk h MET 178 Cb -0.05 0.20 0.00 0.00 -0.80 0.00 0.00 31.60 30.95 3dbk h MET 178 CO -0.05 1.25 -1.29 0.54 0.23 0.00 0.00 176.91 177.60 3dbk n ARG 179 N -3.93 0.44 -0.81 0.39 1.74 0.11 -4.97 116.66 109.64 3dbk n ARG 179 Ca -0.21 -0.06 0.00 0.00 -0.77 0.00 0.00 57.85 56.81 3dbk n ARG 179 Cb 0.92 -1.46 0.00 0.00 -1.02 0.00 0.00 32.46 30.89 3dbk n ARG 179 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3dbk n GLY 180 N 1.42 0.74 3.48 -0.13 0.00 0.69 -4.99 105.19 106.41 3dbk n GLY 180 Ca 0.01 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.93 3dbk n GLY 180 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3dbk s LYS 181 N -0.19 0.98 0.04 1.61 -2.85 -1.25 -4.96 119.74 113.12 3dbk s LYS 181 Ca 0.00 -0.29 -0.08 0.00 -1.00 0.00 0.00 55.97 54.60 3dbk s LYS 181 Cb 0.00 0.45 -0.00 0.00 -2.06 0.00 0.00 37.83 36.22 3dbk s LYS 181 CO 0.00 -0.41 0.16 0.54 0.10 0.00 0.00 175.35 175.73 3dbk s ASN 182 N -2.39 0.10 0.00 0.03 2.20 -1.26 -3.53 114.94 110.09 3dbk s ASN 182 Ca 0.02 -0.46 0.24 0.00 -0.94 0.00 0.00 52.86 51.72 3dbk s ASN 182 Cb -0.01 0.27 0.34 0.00 -2.00 0.00 0.00 41.25 39.85 3dbk s ASN 182 CO -0.08 -0.56 1.30 -0.90 -2.94 0.00 0.00 177.10 173.92 3dbk n ASP 183 N 0.64 0.61 -1.56 3.54 3.85 -1.26 -4.95 116.55 117.41 3dbk n ASP 183 Ca -0.18 -0.40 -0.17 0.00 -0.71 0.00 0.00 54.79 53.32 3dbk n ASP 183 Cb 0.59 0.42 -0.05 0.00 -1.35 0.00 0.00 41.12 40.73 3dbk n ASP 183 CO 0.00 0.00 0.00 0.49 -1.01 0.00 0.00 177.20 176.68 3dbk n PHE 184 N -1.51 -0.32 -4.74 2.11 3.01 -1.26 -4.98 117.46 109.76 3dbk n PHE 184 Ca 0.05 0.00 -0.33 0.00 1.01 0.00 0.00 57.45 58.18 3dbk n PHE 184 Cb 0.34 -3.14 -0.15 0.00 -0.01 0.00 0.00 39.48 36.52 3dbk n PHE 184 CO 0.00 0.00 0.00 -0.51 1.01 0.00 0.00 176.76 177.26 3dbk s LEU 185 N -4.30 2.59 -0.28 4.37 1.43 -1.26 -2.64 118.68 118.59 3dbk s LEU 185 Ca 0.00 -0.39 -0.23 0.00 -1.03 0.00 0.00 54.13 52.48 3dbk s LEU 185 Cb 0.00 -1.58 -0.00 0.00 0.03 0.00 0.00 46.19 44.63 3dbk s LEU 185 CO 0.00 0.14 0.77 -0.63 0.23 0.00 0.00 176.35 176.85 3dbk s ILE 186 N 0.50 4.84 -0.97 -0.59 1.09 -0.21 -4.10 121.20 121.75 3dbk s ILE 186 Ca -0.10 1.26 0.00 0.00 -1.10 0.00 0.00 60.65 60.71 3dbk s ILE 186 Cb -0.16 -4.10 0.00 0.00 -1.06 0.00 0.00 42.46 37.14 3dbk s ILE 186 CO 0.04 -0.15 0.00 0.61 -0.10 0.00 0.00 174.94 175.34 3dbk n GLY 187 N 4.08 0.86 0.29 6.18 0.00 -1.26 -0.99 105.19 114.36 3dbk n GLY 187 Ca 0.03 -0.57 0.03 0.00 0.00 0.00 0.00 46.02 45.51 3dbk n GLY 187 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 3dbk h TYR 188 N 0.00 0.73 0.00 1.61 5.03 -1.84 -1.92 116.97 120.59 3dbk h TYR 188 Ca -0.20 0.03 -0.01 0.00 2.58 0.00 0.00 58.73 61.13 3dbk h TYR 188 Cb 0.75 -0.21 -0.00 0.00 1.55 0.00 0.00 36.73 38.81 3dbk h TYR 188 CO 0.27 0.26 -0.04 -0.44 -1.32 0.00 0.00 178.16 176.88 3dbk h ASP 189 N 0.67 0.00 -0.11 -2.11 3.32 -1.91 -3.10 116.42 113.18 3dbk h ASP 189 Ca 0.39 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.44 3dbk h ASP 189 Cb 0.43 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.98 3dbk h ASP 189 CO -0.28 0.04 0.00 2.30 -1.72 0.00 0.00 179.24 179.58 3dbk n ILE 190 N -3.99 0.48 -3.21 0.35 -6.64 -0.79 -4.61 119.36 100.95 3dbk n ILE 190 Ca -0.03 -0.74 -0.39 0.00 -1.77 0.00 0.00 62.75 59.82 3dbk n ILE 190 Cb 0.13 0.83 -0.06 0.00 -1.44 0.00 0.00 39.64 39.10 3dbk n ILE 190 CO 0.00 0.00 0.00 -0.75 -1.77 0.00 0.00 176.55 174.03 3dbk s LYS 191 N -0.77 4.24 0.40 6.28 2.20 -0.81 -0.50 119.74 130.78 3dbk s LYS 191 Ca 0.11 0.51 -0.25 0.00 -0.36 0.00 0.00 55.97 55.98 3dbk s LYS 191 Cb 0.06 -3.53 -0.09 0.00 -1.51 0.00 0.00 37.83 32.76 3dbk s LYS 191 CO 0.09 -0.10 1.14 0.15 -0.36 0.00 0.00 175.35 176.27 3dbk s LYS 192 N 1.46 4.10 1.64 4.03 1.02 -0.45 -4.78 119.74 126.75 3dbk s LYS 192 Ca 0.27 1.76 0.00 0.00 0.02 0.00 0.00 55.97 58.02 3dbk s LYS 192 Cb -0.16 -2.67 0.00 0.00 -0.52 0.00 0.00 37.83 34.49 3dbk s LYS 192 CO 0.11 -0.26 0.00 0.41 -0.92 0.00 0.00 175.35 174.68 3dbk n GLY 193 N 0.60 -1.52 3.90 -3.33 0.00 -1.26 -4.92 105.19 98.66 3dbk n GLY 193 Ca 0.04 -1.44 -0.28 0.00 0.00 0.00 0.00 46.02 44.34 3dbk n GLY 193 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3dbk s SER 194 N -4.00 6.18 0.05 1.61 1.04 -1.26 -4.96 113.70 112.36 3dbk s SER 194 Ca 0.00 1.02 0.00 0.00 0.48 0.00 0.00 55.95 57.45 3dbk s SER 194 Cb 0.00 -2.24 0.00 0.00 0.10 0.00 0.00 66.02 63.88 3dbk s SER 194 CO 0.00 -0.70 0.00 0.61 0.98 0.00 0.00 173.24 174.13 3dbk n GLY 195 N -2.41 -1.61 3.17 7.32 0.00 -1.26 -5.01 105.19 105.38 3dbk n GLY 195 Ca 0.02 -1.33 -0.21 0.00 0.00 0.00 0.00 46.02 44.51 3dbk n GLY 195 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dbk n ALA 196 N 1.27 0.65 -0.03 4.61 0.00 -1.26 -4.69 120.51 121.06 3dbk n ALA 196 Ca 0.00 -1.94 -0.15 0.00 0.00 0.00 0.00 53.44 51.36 3dbk n ALA 196 Cb 0.00 1.48 -0.10 0.00 0.00 0.00 0.00 19.45 20.82 3dbk n ALA 196 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 3dbk h LEU 197 N 0.00 0.26 -8.28 0.00 5.85 -1.29 -3.47 115.31 108.38 3dbk h LEU 197 Ca -0.26 -0.68 -0.16 0.00 0.84 0.00 0.00 57.88 57.63 3dbk h LEU 197 Cb 1.17 -0.08 -0.16 0.00 0.37 0.00 0.00 40.66 41.97 3dbk h LEU 197 CO 0.39 0.90 -0.69 -0.13 -0.34 0.00 0.00 178.44 178.57 3dbk s ARG 198 N -3.51 0.65 -0.02 1.25 0.52 -1.17 -4.91 118.95 111.76 3dbk s ARG 198 Ca -0.15 -1.20 0.05 0.00 -0.52 0.00 0.00 55.73 53.92 3dbk s ARG 198 Cb 0.02 0.06 -0.01 0.00 0.52 0.00 0.00 34.95 35.54 3dbk s ARG 198 CO 0.74 -0.07 -0.18 0.71 0.02 0.00 0.00 175.30 176.52 3dbk s TYR 199 N -3.57 1.64 -0.12 -0.53 2.02 -1.26 -1.05 117.35 114.48 3dbk s TYR 199 Ca 0.06 -0.34 0.13 0.00 -0.37 0.00 0.00 57.07 56.56 3dbk s TYR 199 Cb 0.05 -1.06 -0.24 0.00 -0.40 0.00 0.00 41.96 40.31 3dbk s TYR 199 CO -0.07 -0.05 0.37 -1.33 -1.57 0.00 0.00 175.55 172.89 3dbk n MET 200 N 2.72 0.66 -0.18 -0.62 2.81 -1.08 -2.99 117.12 118.44 3dbk n MET 200 Ca -0.15 0.16 -0.10 0.00 -1.81 0.00 0.00 57.70 55.81 3dbk n MET 200 Cb 0.54 -1.67 0.01 0.00 -0.71 0.00 0.00 33.22 31.39 3dbk n MET 200 CO 0.00 0.00 0.00 0.38 1.51 0.00 0.00 175.97 177.86 3dbk h ASP 201 N 0.00 0.91 -2.17 7.83 -0.00 -1.89 -3.31 116.42 117.78 3dbk h ASP 201 Ca -0.41 -0.31 -0.49 0.00 -0.00 0.00 0.00 57.03 55.82 3dbk h ASP 201 Cb 2.11 -0.24 -0.34 0.00 -0.00 0.00 0.00 39.33 40.85 3dbk h ASP 201 CO 0.05 0.99 -0.82 -1.58 -0.00 0.00 0.00 179.24 177.88 3dbk s GLN 202 N -5.02 0.77 0.32 4.15 0.74 -1.26 -4.97 119.66 114.39 3dbk s GLN 202 Ca -0.12 -1.50 0.10 0.00 0.05 0.00 0.00 55.36 53.89 3dbk s GLN 202 Cb 0.12 -1.07 0.92 0.00 1.10 0.00 0.00 33.01 34.08 3dbk s GLN 202 CO 0.83 -1.29 1.71 -1.35 -0.55 0.00 0.00 175.29 174.64 3dbk h PRO 203 N 6.26 0.48 0.00 1.67 0.11 -1.72 -0.73 132.00 138.07 3dbk h PRO 203 Ca 0.14 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 66.22 3dbk h PRO 203 Cb 0.98 -0.11 0.00 0.00 0.11 0.00 0.00 31.00 31.98 3dbk h PRO 203 CO 0.26 0.32 0.00 -1.13 -0.21 0.00 0.00 178.00 177.24 3dbk n SER 204 N -4.94 0.00 0.31 -2.05 3.41 -1.21 -2.31 113.62 106.83 3dbk n SER 204 Ca 0.28 0.36 0.17 0.00 -0.26 0.00 0.00 58.87 59.42 3dbk n SER 204 Cb 0.80 -0.36 0.99 0.00 -0.26 0.00 0.00 64.21 65.38 3dbk n SER 204 CO 0.00 0.00 0.00 0.03 -0.16 0.00 0.00 175.04 174.91 3dbk h ARG 205 N 0.00 0.00 -0.02 4.33 3.08 -1.44 0.01 114.38 120.34 3dbk h ARG 205 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 3dbk h ARG 205 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 3dbk h ARG 205 CO 0.00 0.01 0.00 -0.40 -1.07 0.00 0.00 179.97 178.51 3dbk n ASP 206 N -3.59 0.76 -0.18 7.04 3.85 -0.98 -4.92 116.55 118.55 3dbk n ASP 206 Ca -0.03 -1.32 -0.02 0.00 -0.71 0.00 0.00 54.79 52.71 3dbk n ASP 206 Cb 0.10 -0.01 -0.01 0.00 -1.35 0.00 0.00 41.12 39.84 3dbk n ASP 206 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3dbk n GLY 207 N 1.06 0.55 0.10 6.12 0.00 -0.01 -4.77 105.19 108.23 3dbk n GLY 207 Ca 0.20 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.90 3dbk n GLY 207 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dbk n ARG 208 N -2.27 0.00 -1.83 1.61 5.12 -1.26 -5.12 116.66 112.92 3dbk n ARG 208 Ca -0.02 0.00 -0.33 0.00 -1.93 0.00 0.00 57.85 55.57 3dbk n ARG 208 Cb 0.16 -0.37 0.04 0.00 -1.16 0.00 0.00 32.46 31.13 3dbk n ARG 208 CO 0.00 0.00 0.00 -1.12 -1.93 0.00 0.00 177.63 174.58 3dbk s SER 209 N -2.63 5.23 0.11 0.55 0.01 -1.26 -4.88 113.70 110.83 3dbk s SER 209 Ca 0.00 1.99 0.03 0.00 1.31 0.00 0.00 55.95 59.28 3dbk s SER 209 Cb 0.00 -2.55 -0.04 0.00 0.21 0.00 0.00 66.02 63.64 3dbk s SER 209 CO 0.00 -1.55 0.16 0.27 0.41 0.00 0.00 173.24 172.54 3dbk s ILE 210 N -2.31 4.86 -0.78 1.44 -4.36 -0.82 -3.28 121.20 115.95 3dbk s ILE 210 Ca 0.67 -0.76 0.19 0.00 -0.26 0.00 0.00 60.65 60.50 3dbk s ILE 210 Cb -0.20 -3.42 -0.22 0.00 1.25 0.00 0.00 42.46 39.86 3dbk s ILE 210 CO 0.40 0.02 0.76 0.47 0.24 0.00 0.00 174.94 176.83 3dbk n ASP 211 N -0.01 0.84 -3.72 4.36 8.00 -1.26 -3.40 116.55 121.37 3dbk n ASP 211 Ca -0.07 -0.82 -0.10 0.00 0.71 0.00 0.00 54.79 54.51 3dbk n ASP 211 Cb 0.53 1.13 -0.06 0.00 -0.02 0.00 0.00 41.12 42.70 3dbk n ASP 211 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3dbk s ASN 212 N -3.03 -0.11 0.42 -2.24 4.22 -1.26 -4.72 114.94 108.22 3dbk s ASN 212 Ca 0.05 -0.39 0.12 0.00 -2.14 0.00 0.00 52.86 50.50 3dbk s ASN 212 Cb 0.14 0.41 0.97 0.00 1.28 0.00 0.00 41.25 44.06 3dbk s ASN 212 CO 0.80 -0.77 2.00 0.00 -2.04 0.00 0.00 177.10 177.08 3dbk h ALA 213 N 2.63 1.92 0.00 3.54 0.00 -1.29 -1.88 119.26 124.18 3dbk h ALA 213 Ca -0.34 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.56 3dbk h ALA 213 Cb 1.23 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.91 3dbk h ALA 213 CO 0.49 -0.03 0.00 0.66 0.00 0.00 0.00 179.25 180.37 3dbk h SER 214 N 0.47 0.00 0.29 0.00 4.64 -1.87 -2.03 113.55 115.04 3dbk h SER 214 Ca 0.25 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.57 3dbk h SER 214 Cb 0.39 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.48 3dbk h SER 214 CO -0.07 0.00 -0.16 0.00 -0.87 0.00 0.00 176.83 175.73 3dbk n GLN 215 N -2.58 0.79 -1.95 4.77 6.02 -0.71 -4.89 117.38 118.85 3dbk n GLN 215 Ca 0.00 -0.37 -0.39 0.00 -0.01 0.00 0.00 57.00 56.24 3dbk n GLN 215 Cb 0.18 -1.49 0.01 0.00 1.02 0.00 0.00 30.24 29.96 3dbk n GLN 215 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 177.06 175.58 3dbk s TYR 216 N -2.46 2.59 -0.09 1.08 6.14 -0.77 -5.00 117.35 118.84 3dbk s TYR 216 Ca 0.28 1.38 -0.20 0.00 0.64 0.00 0.00 57.07 59.17 3dbk s TYR 216 Cb 0.20 -3.73 0.04 0.00 0.42 0.00 0.00 41.96 38.90 3dbk s TYR 216 CO 0.48 -2.44 0.48 1.52 0.64 0.00 0.00 175.55 176.23 3dbk s TYR 217 N -1.30 -0.45 0.15 4.97 -0.85 -1.26 -5.10 117.35 113.51 3dbk s TYR 217 Ca 0.63 0.92 -0.31 0.00 -0.52 0.00 0.00 57.07 57.78 3dbk s TYR 217 Cb -0.39 0.21 -0.11 0.00 0.38 0.00 0.00 41.96 42.06 3dbk s TYR 217 CO 0.48 -0.39 1.76 0.54 -1.52 0.00 0.00 175.55 176.42 3dbk s ASN 218 N -0.64 6.44 0.00 -0.18 2.20 -1.26 -1.60 114.94 119.90 3dbk s ASN 218 Ca -0.07 2.75 0.00 0.00 -0.94 0.00 0.00 52.86 54.60 3dbk s ASN 218 Cb -0.03 -2.58 0.00 0.00 -2.00 0.00 0.00 41.25 36.64 3dbk s ASN 218 CO 0.04 -0.97 0.00 0.61 -2.94 0.00 0.00 177.10 173.84 3dbk n GLY 219 N 4.09 0.72 3.74 0.45 0.00 -1.26 -5.08 105.19 107.86 3dbk n GLY 219 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 3dbk n GLY 219 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 3dbk s ILE 220 N -2.00 3.48 0.39 -0.61 2.07 -0.63 -5.00 121.20 118.90 3dbk s ILE 220 Ca 0.00 1.31 -0.26 0.00 -1.41 0.00 0.00 60.65 60.29 3dbk s ILE 220 Cb 0.00 -3.83 -0.09 0.00 0.13 0.00 0.00 42.46 38.67 3dbk s ILE 220 CO 0.00 0.24 1.19 -0.62 -1.91 0.00 0.00 174.94 173.84 3dbk s ASP 221 N -0.12 6.56 0.60 4.50 -1.08 -1.26 -4.86 116.67 121.01 3dbk s ASP 221 Ca 0.51 2.40 0.31 0.00 -0.52 0.00 0.00 52.55 55.25 3dbk s ASP 221 Cb -0.33 -2.62 1.87 0.00 -1.46 0.00 0.00 42.92 40.38 3dbk s ASP 221 CO 0.39 -0.65 2.27 -0.37 0.52 0.00 0.00 175.17 177.32 3dbk h VAL 222 N 2.43 0.48 -0.00 1.11 -1.51 -1.93 0.99 116.25 117.82 3dbk h VAL 222 Ca -0.49 -0.01 0.00 0.00 -1.23 0.00 0.00 66.70 64.97 3dbk h VAL 222 Cb 1.23 1.01 0.00 0.00 -2.13 0.00 0.00 31.29 31.40 3dbk h VAL 222 CO 0.63 0.00 -0.08 1.41 -1.23 0.00 0.00 177.57 178.30 3dbk n HIS 223 N -3.78 0.00 -0.12 5.19 8.25 -1.26 -2.51 115.22 120.99 3dbk n HIS 223 Ca -0.03 0.00 -0.17 0.00 -0.26 0.00 0.00 57.72 57.26 3dbk n HIS 223 Cb 0.08 -0.30 -0.12 0.00 1.12 0.00 0.00 29.99 30.78 3dbk n HIS 223 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 3dbk n HIS 224 N -1.25 0.00 0.40 4.41 8.25 0.24 -4.31 115.22 122.96 3dbk n HIS 224 Ca 0.12 0.00 0.13 0.00 -0.26 0.00 0.00 57.72 57.71 3dbk n HIS 224 Cb 0.28 -0.96 0.51 0.00 1.12 0.00 0.00 29.99 30.94 3dbk n HIS 224 CO 0.00 0.00 0.00 0.66 0.64 0.00 0.00 176.34 177.64 3dbk h SER 225 N 0.00 0.00 0.56 0.41 4.64 -1.32 -2.09 113.55 115.75 3dbk h SER 225 Ca -0.55 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.77 3dbk h SER 225 Cb 1.87 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.96 3dbk h SER 225 CO -0.08 0.00 0.00 0.77 -0.87 0.00 0.00 176.83 176.65 3dbk h SER 226 N 0.00 0.00 -0.73 4.97 4.64 -1.62 -3.03 113.55 117.78 3dbk h SER 226 Ca 0.00 0.00 0.13 0.00 -0.47 0.00 0.00 61.79 61.45 3dbk h SER 226 Cb 0.46 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.50 3dbk h SER 226 CO 0.00 0.00 0.48 1.23 -0.87 0.00 0.00 176.83 177.67 3dbk h GLY 227 N 1.31 0.75 0.96 -0.77 0.00 -1.60 -0.31 103.07 103.41 3dbk h GLY 227 Ca 0.00 -0.20 -0.01 0.00 0.00 0.00 0.00 47.33 47.12 3dbk h GLY 227 CO 0.00 0.09 -0.09 -2.08 0.00 0.00 0.00 176.54 174.46 3dbk h VAL 228 N 0.48 0.84 -0.05 4.60 2.07 -1.54 -0.10 116.25 122.55 3dbk h VAL 228 Ca 0.35 -0.09 -0.17 0.00 0.82 0.00 0.00 66.70 67.61 3dbk h VAL 228 Cb 0.70 0.90 -0.01 0.00 -1.52 0.00 0.00 31.29 31.35 3dbk h VAL 228 CO -0.12 0.02 -0.71 1.88 0.02 0.00 0.00 177.57 178.66 3dbk h TYR 229 N -0.28 0.37 -0.72 1.57 -1.99 -1.68 -2.16 116.97 112.08 3dbk h TYR 229 Ca -0.02 -0.17 -0.03 0.00 2.00 0.00 0.00 58.73 60.51 3dbk h TYR 229 Cb 0.22 -0.06 -0.03 0.00 2.00 0.00 0.00 36.73 38.86 3dbk h TYR 229 CO -0.05 0.89 0.32 -0.91 -0.00 0.00 0.00 178.16 178.41 3dbk h ASN 230 N 0.19 0.97 -0.32 3.88 2.35 -0.94 -0.54 115.58 121.17 3dbk h ASN 230 Ca -0.02 -0.15 -0.14 0.00 -0.55 0.00 0.00 56.30 55.44 3dbk h ASN 230 Cb 1.27 -0.25 -0.01 0.00 0.05 0.00 0.00 38.32 39.38 3dbk h ASN 230 CO 0.11 0.85 -0.32 -0.09 -1.65 0.00 0.00 177.43 176.33 3dbk h ARG 231 N 1.02 0.85 -0.74 0.81 2.43 -0.95 -0.96 114.38 116.84 3dbk h ARG 231 Ca 0.24 -0.40 -0.01 0.00 -0.81 0.00 0.00 59.98 59.00 3dbk h ARG 231 Cb 0.16 -0.01 -0.04 0.00 -0.42 0.00 0.00 29.97 29.67 3dbk h ARG 231 CO -0.03 1.04 0.43 0.00 -1.51 0.00 0.00 179.97 179.91 3dbk h ALA 232 N 0.92 0.95 -0.56 2.80 0.00 -1.05 -0.16 119.26 122.16 3dbk h ALA 232 Ca 0.08 -0.10 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 3dbk h ALA 232 Cb 0.88 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 18.34 3dbk h ALA 232 CO 0.08 0.43 0.29 0.35 0.00 0.00 0.00 179.25 180.40 3dbk h PHE 233 N 1.01 0.78 -0.31 0.00 3.57 -0.83 -0.62 116.94 120.55 3dbk h PHE 233 Ca 0.26 -0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.73 3dbk h PHE 233 Cb -0.01 -0.25 -0.01 0.00 2.79 0.00 0.00 35.95 38.47 3dbk h PHE 233 CO -0.01 0.59 0.18 -0.92 -2.23 0.00 0.00 178.31 175.92 3dbk h TYR 234 N 0.75 0.42 -0.68 0.41 5.03 -0.64 0.74 116.97 123.00 3dbk h TYR 234 Ca 0.19 -0.01 -0.02 0.00 2.58 0.00 0.00 58.73 61.48 3dbk h TYR 234 Cb 0.08 -0.14 -0.03 0.00 1.55 0.00 0.00 36.73 38.19 3dbk h TYR 234 CO -0.01 0.33 0.36 -0.07 -1.32 0.00 0.00 178.16 177.45 3dbk h LEU 235 N 0.39 0.86 -0.01 2.82 3.38 -0.80 -1.99 115.31 119.96 3dbk h LEU 235 Ca 0.11 -0.11 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 3dbk h LEU 235 Cb 0.04 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.57 3dbk h LEU 235 CO -0.02 0.72 -0.00 0.25 0.09 0.00 0.00 178.44 179.48 3dbk h LEU 236 N 0.93 0.01 -1.80 1.67 5.85 -0.81 -2.57 115.31 118.60 3dbk h LEU 236 Ca 0.24 -0.32 0.04 0.00 0.84 0.00 0.00 57.88 58.67 3dbk h LEU 236 Cb 0.06 -0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.07 3dbk h LEU 236 CO -0.04 0.34 0.22 0.00 -0.34 0.00 0.00 178.44 178.62 3dbk h ALA 237 N 0.68 1.98 -0.52 1.25 0.00 -0.78 -1.37 119.26 120.48 3dbk h ALA 237 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 3dbk h ALA 237 Cb 0.33 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.05 3dbk h ALA 237 CO 0.00 -0.03 0.00 0.09 0.00 0.00 0.00 179.25 179.31 3dbk n ASN 238 N -4.49 3.50 -4.82 0.00 3.02 -0.75 -3.16 115.26 108.55 3dbk n ASN 238 Ca 0.03 -2.22 -0.34 0.00 -0.03 0.00 0.00 54.58 52.03 3dbk n ASN 238 Cb 0.20 -0.46 -0.07 0.00 -0.61 0.00 0.00 39.78 38.85 3dbk n ASN 238 CO 0.00 0.00 0.00 -0.44 -2.62 0.00 0.00 177.26 174.20 3dbk s SER 239 N -0.87 6.96 0.06 6.41 0.01 -0.52 -4.97 113.70 120.77 3dbk s SER 239 Ca 0.39 1.54 -0.35 0.00 1.31 0.00 0.00 55.95 58.84 3dbk s SER 239 Cb 0.23 -2.48 -0.15 0.00 0.21 0.00 0.00 66.02 63.84 3dbk s SER 239 CO 0.21 -0.22 1.56 -2.65 0.41 0.00 0.00 173.24 172.56 3dbk n PRO 240 N -0.22 1.74 -0.09 12.44 -0.02 -1.26 -1.02 135.00 146.57 3dbk n PRO 240 Ca 0.04 0.63 0.00 0.00 -2.02 0.00 0.00 63.50 62.15 3dbk n PRO 240 Cb 0.53 -2.36 0.00 0.00 -0.02 0.00 0.00 33.50 31.65 3dbk n PRO 240 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3dbk n GLY 241 N 3.35 1.66 3.93 -1.23 0.00 -1.26 -5.03 105.19 106.61 3dbk n GLY 241 Ca 0.19 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 46.01 3dbk n GLY 241 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3dbk s TRP 242 N -2.69 2.44 0.33 1.61 0.52 -0.19 -5.09 118.94 115.86 3dbk s TRP 242 Ca 0.00 -0.54 -0.18 0.00 0.02 0.00 0.00 56.10 55.40 3dbk s TRP 242 Cb 0.00 -2.20 0.03 0.00 -1.15 0.00 0.00 33.47 30.16 3dbk s TRP 242 CO 0.00 -0.37 0.73 0.16 0.02 0.00 0.00 176.95 177.49 3dbk s ASP 243 N -4.27 -0.10 0.29 2.95 3.84 -1.19 -4.74 116.67 113.46 3dbk s ASP 243 Ca 0.50 -0.89 0.01 0.00 -0.00 0.00 0.00 52.55 52.17 3dbk s ASP 243 Cb -0.05 0.77 0.53 0.00 -1.38 0.00 0.00 42.92 42.79 3dbk s ASP 243 CO 0.30 -1.49 1.89 0.74 -0.00 0.00 0.00 175.17 176.61 3dbk h THR 244 N 2.02 1.03 0.10 2.11 2.02 -1.95 -1.92 112.91 116.32 3dbk h THR 244 Ca -0.25 -0.36 -0.01 0.00 0.77 0.00 0.00 66.41 66.57 3dbk h THR 244 Cb 1.25 -0.10 0.00 0.00 -1.74 0.00 0.00 68.15 67.56 3dbk h THR 244 CO 0.32 0.19 -0.05 -0.09 0.37 0.00 0.00 175.52 176.26 3dbk h ARG 245 N 1.03 -0.14 -0.96 6.66 2.43 -1.95 -0.95 114.38 120.51 3dbk h ARG 245 Ca 0.42 0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.60 3dbk h ARG 245 Cb 0.28 0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 29.82 3dbk h ARG 245 CO -0.18 0.03 0.60 0.87 -1.51 0.00 0.00 179.97 179.78 3dbk h LYS 246 N -0.27 1.29 -0.46 0.20 1.57 -1.90 0.01 116.57 117.01 3dbk h LYS 246 Ca -0.01 -0.10 -0.04 0.00 -1.87 0.00 0.00 60.65 58.63 3dbk h LYS 246 Cb 0.22 -0.28 -0.02 0.00 0.08 0.00 0.00 32.23 32.23 3dbk h LYS 246 CO 0.02 0.88 0.14 0.00 -0.57 0.00 0.00 179.45 179.92 3dbk h ALA 247 N 1.33 0.61 -0.52 3.86 0.00 -1.25 -2.92 119.26 120.37 3dbk h ALA 247 Ca 0.35 -0.18 -0.10 0.00 0.00 0.00 0.00 54.91 54.98 3dbk h ALA 247 Cb -0.10 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 3dbk h ALA 247 CO -0.07 0.26 -0.07 0.35 0.00 0.00 0.00 179.25 179.73 3dbk h PHE 248 N 0.61 1.03 -0.67 0.00 3.57 -0.68 -3.05 116.94 117.75 3dbk h PHE 248 Ca 0.15 -0.19 0.09 0.00 3.53 0.00 0.00 57.97 61.55 3dbk h PHE 248 Cb 0.28 -0.26 -0.07 0.00 2.79 0.00 0.00 35.95 38.69 3dbk h PHE 248 CO 0.01 0.96 0.31 0.93 -2.23 0.00 0.00 178.31 178.29 3dbk h GLU 249 N 0.85 0.53 0.00 1.11 5.08 -0.83 0.89 114.58 122.20 3dbk h GLU 249 Ca 0.14 -0.03 -0.10 0.00 -1.00 0.00 0.00 59.36 58.37 3dbk h GLU 249 Cb 0.60 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.71 3dbk h GLU 249 CO 0.04 0.35 -0.50 -0.39 -1.00 0.00 0.00 179.01 177.51 3dbk h VAL 250 N 0.54 1.26 0.02 3.13 -1.51 -1.43 -1.05 116.25 117.20 3dbk h VAL 250 Ca 0.33 -1.75 -0.24 0.00 -1.23 0.00 0.00 66.70 63.80 3dbk h VAL 250 Cb 0.35 1.97 0.01 0.00 -2.13 0.00 0.00 31.29 31.49 3dbk h VAL 250 CO -0.27 0.49 -1.00 -0.26 -1.23 0.00 0.00 177.57 175.30 3dbk h PHE 251 N 0.00 0.69 -0.34 5.19 0.04 -1.24 -2.35 116.94 118.92 3dbk h PHE 251 Ca -0.00 -0.39 -0.05 0.00 2.80 0.00 0.00 57.97 60.33 3dbk h PHE 251 Cb 0.93 -0.07 -0.01 0.00 2.20 0.00 0.00 35.95 38.99 3dbk h PHE 251 CO 0.00 1.22 0.02 0.28 -0.60 0.00 0.00 178.31 179.23 3dbk h VAL 252 N 0.25 1.25 -0.76 -0.55 2.07 -0.68 -1.00 116.25 116.83 3dbk h VAL 252 Ca -0.10 -0.92 0.04 0.00 0.82 0.00 0.00 66.70 66.54 3dbk h VAL 252 Cb 1.65 1.18 -0.05 0.00 -1.52 0.00 0.00 31.29 32.55 3dbk h VAL 252 CO 0.18 0.31 0.47 0.44 0.02 0.00 0.00 177.57 178.99 3dbk h ASP 253 N 0.41 0.77 -0.39 0.57 3.45 -1.22 0.95 116.42 120.95 3dbk h ASP 253 Ca 0.10 0.00 -0.00 0.00 0.43 0.00 0.00 57.03 57.56 3dbk h ASP 253 Cb 0.42 -0.16 -0.02 0.00 -0.56 0.00 0.00 39.33 39.01 3dbk h ASP 253 CO 0.01 0.52 0.23 0.00 -1.57 0.00 0.00 179.24 178.43 3dbk h ALA 254 N 1.33 0.50 -0.70 3.45 0.00 -1.17 0.24 119.26 122.91 3dbk h ALA 254 Ca 0.31 -0.06 0.01 0.00 0.00 0.00 0.00 54.91 55.16 3dbk h ALA 254 Cb 0.06 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 3dbk h ALA 254 CO -0.13 0.00 0.46 -0.97 0.00 0.00 0.00 179.25 178.61 3dbk h ASN 255 N 0.51 0.80 0.08 0.00 -0.00 -0.46 0.26 115.58 116.77 3dbk h ASN 255 Ca 0.14 -0.03 -0.29 0.00 -0.00 0.00 0.00 56.30 56.13 3dbk h ASN 255 Cb 0.02 -0.20 0.03 0.00 -0.00 0.00 0.00 38.32 38.17 3dbk h ASN 255 CO -0.02 0.59 -1.16 0.03 -0.00 0.00 0.00 177.43 176.86 3dbk h ARG 256 N 0.95 0.66 0.00 6.67 3.08 -0.52 -2.59 114.38 122.63 3dbk h ARG 256 Ca 0.25 -0.80 0.00 0.00 0.07 0.00 0.00 59.98 59.50 3dbk h ARG 256 Cb -0.10 0.25 0.00 0.00 0.08 0.00 0.00 29.97 30.20 3dbk h ARG 256 CO -0.05 1.36 -1.27 0.66 -1.07 0.00 0.00 179.97 179.59 3dbk n TYR 257 N -3.82 0.00 -0.00 3.04 4.01 0.83 -4.82 117.16 116.40 3dbk n TYR 257 Ca -0.12 0.00 -0.01 0.00 -0.16 0.00 0.00 57.90 57.61 3dbk n TYR 257 Cb 0.94 -0.16 -0.00 0.00 -0.31 0.00 0.00 39.34 39.81 3dbk n TYR 257 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 3dbk n TYR 258 N -1.72 0.00 -1.74 -0.72 4.01 -0.09 -5.04 117.16 111.86 3dbk n TYR 258 Ca -0.01 0.00 -0.36 0.00 -0.16 0.00 0.00 57.90 57.37 3dbk n TYR 258 Cb 0.18 -0.03 0.06 0.00 -0.31 0.00 0.00 39.34 39.25 3dbk n TYR 258 CO 0.00 0.00 0.00 -1.58 -0.46 0.00 0.00 176.86 174.82 3dbk s TRP 259 N -2.01 2.18 0.43 -0.72 0.51 0.74 -4.97 118.94 115.09 3dbk s TRP 259 Ca -0.01 1.53 0.06 0.00 -2.12 0.00 0.00 56.10 55.56 3dbk s TRP 259 Cb 0.00 -3.55 -0.06 0.00 -0.81 0.00 0.00 33.47 29.05 3dbk s TRP 259 CO 0.01 -2.58 0.07 0.95 -0.51 0.00 0.00 176.95 174.89 3dbk s THR 260 N -1.65 1.93 0.55 2.01 -4.23 -1.26 -4.64 115.64 108.36 3dbk s THR 260 Ca 0.78 -1.91 0.25 0.00 -1.18 0.00 0.00 61.69 59.63 3dbk s THR 260 Cb -0.32 -2.83 0.35 0.00 1.34 0.00 0.00 72.50 71.03 3dbk s THR 260 CO 0.39 0.00 2.08 0.00 -0.54 0.00 0.00 174.62 176.55 3dbk h ALA 261 N 1.58 2.07 -0.12 3.99 0.00 -1.70 -2.76 119.26 122.31 3dbk h ALA 261 Ca -0.43 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.44 3dbk h ALA 261 Cb 1.26 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.05 3dbk h ALA 261 CO 0.76 -0.34 -0.07 0.25 0.00 0.00 0.00 179.25 179.85 3dbk n THR 262 N -4.15 2.13 -1.76 0.00 -2.24 -1.26 -1.05 114.28 105.95 3dbk n THR 262 Ca 0.03 -2.33 -0.41 0.00 -2.27 0.00 0.00 64.05 59.07 3dbk n THR 262 Cb 0.36 -0.26 0.00 0.00 -2.10 0.00 0.00 70.33 68.34 3dbk n THR 262 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 3dbk n SER 263 N -1.08 3.47 -4.28 3.42 7.64 -1.04 -4.86 113.62 116.89 3dbk n SER 263 Ca 0.20 1.19 -0.20 0.00 1.01 0.00 0.00 58.87 61.08 3dbk n SER 263 Cb 0.77 -1.59 0.01 0.00 -1.01 0.00 0.00 64.21 62.39 3dbk n SER 263 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 3dbk n ASN 264 N 0.34 2.29 -0.11 6.43 2.04 -1.26 -3.69 115.26 121.29 3dbk n ASN 264 Ca 0.03 -2.47 -0.10 0.00 -0.44 0.00 0.00 54.58 51.60 3dbk n ASN 264 Cb 0.39 -0.08 -0.05 0.00 -2.53 0.00 0.00 39.78 37.51 3dbk n ASN 264 CO 0.00 0.00 0.00 1.88 -0.44 0.00 0.00 177.26 178.70 3dbk h TYR 265 N 0.54 -1.24 0.16 -2.53 0.99 -1.95 0.88 116.97 113.82 3dbk h TYR 265 Ca -0.27 0.07 -0.01 0.00 2.00 0.00 0.00 58.73 60.52 3dbk h TYR 265 Cb 1.02 0.60 0.00 0.00 1.00 0.00 0.00 36.73 39.34 3dbk h TYR 265 CO 0.00 -0.44 -0.08 -0.91 -0.00 0.00 0.00 178.16 176.73 3dbk h ASN 266 N -0.34 -0.18 0.34 3.88 -0.26 -1.95 -2.47 115.58 114.60 3dbk h ASN 266 Ca 0.13 -0.09 -0.06 0.00 -0.56 0.00 0.00 56.30 55.72 3dbk h ASN 266 Cb 0.59 0.05 -0.01 0.00 -1.06 0.00 0.00 38.32 37.88 3dbk h ASN 266 CO -0.55 -0.02 -0.29 0.77 -1.06 0.00 0.00 177.43 176.28 3dbk h SER 267 N -0.32 0.00 0.67 5.81 4.64 -1.79 -2.54 113.55 120.02 3dbk h SER 267 Ca -0.02 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.17 3dbk h SER 267 Cb 0.26 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.33 3dbk h SER 267 CO 0.04 0.29 -0.60 1.23 -0.87 0.00 0.00 176.83 176.92 3dbk h GLY 268 N 0.97 0.00 1.56 -0.77 0.00 -0.72 -3.12 103.07 100.99 3dbk h GLY 268 Ca -0.00 0.00 -0.04 0.00 0.00 0.00 0.00 47.33 47.29 3dbk h GLY 268 CO 0.04 0.00 0.07 0.00 0.00 0.00 0.00 176.54 176.64 3dbk h ALA 269 N 1.40 1.42 -0.70 3.60 0.00 -0.99 -2.86 119.26 121.14 3dbk h ALA 269 Ca -0.01 -0.17 0.08 0.00 0.00 0.00 0.00 54.91 54.82 3dbk h ALA 269 Cb 1.09 -0.16 -0.07 0.00 0.00 0.00 0.00 17.79 18.66 3dbk h ALA 269 CO 0.08 0.42 0.36 0.00 0.00 0.00 0.00 179.25 180.11 3dbk h GLY 271 N 0.64 0.53 0.93 0.00 0.00 -1.65 -0.81 103.07 102.70 3dbk h GLY 271 Ca 0.33 -0.41 -0.13 0.00 0.00 0.00 0.00 47.33 47.13 3dbk h GLY 271 CO -0.24 0.37 -0.39 -2.08 0.00 0.00 0.00 176.54 174.21 3dbk h VAL 272 N 0.44 1.33 -0.40 4.60 2.07 -1.38 -0.89 116.25 122.02 3dbk h VAL 272 Ca 0.07 -1.62 -0.02 0.00 0.82 0.00 0.00 66.70 65.95 3dbk h VAL 272 Cb 0.60 1.87 -0.02 0.00 -1.52 0.00 0.00 31.29 32.23 3dbk h VAL 272 CO 0.04 0.50 0.17 0.40 0.02 0.00 0.00 177.57 178.70 3dbk h ILE 273 N 0.28 1.19 -0.60 4.57 2.04 -1.09 -1.64 117.51 122.26 3dbk h ILE 273 Ca 0.01 -0.58 -0.05 0.00 1.00 0.00 0.00 64.86 65.23 3dbk h ILE 273 Cb 0.99 0.83 -0.03 0.00 -0.74 0.00 0.00 36.82 37.87 3dbk h ILE 273 CO 0.09 0.21 0.16 -0.09 0.00 0.00 0.00 178.15 178.52 3dbk h ARG 274 N 0.51 0.93 -0.40 2.37 9.65 -1.13 -2.11 114.38 124.20 3dbk h ARG 274 Ca 0.13 -0.19 -0.04 0.00 -1.10 0.00 0.00 59.98 58.78 3dbk h ARG 274 Cb 0.17 -0.14 -0.02 0.00 -1.39 0.00 0.00 29.97 28.60 3dbk h ARG 274 CO -0.01 0.82 0.06 0.77 2.80 0.00 0.00 179.97 184.41 3dbk h SER 275 N 0.90 0.56 -0.38 -3.80 0.02 -0.78 -0.80 113.55 109.26 3dbk h SER 275 Ca 0.20 -0.09 -0.02 0.00 -0.84 0.00 0.00 61.79 61.03 3dbk h SER 275 Cb 0.30 -0.14 -0.02 0.00 0.14 0.00 0.00 62.40 62.68 3dbk h SER 275 CO -0.00 0.59 0.16 0.00 -1.14 0.00 0.00 176.83 176.43 3dbk h ALA 276 N 1.49 0.49 -0.89 3.77 0.00 -0.66 -2.17 119.26 121.29 3dbk h ALA 276 Ca 0.13 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 3dbk h ALA 276 Cb 0.28 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.87 3dbk h ALA 276 CO 0.00 0.08 0.54 1.96 0.00 0.00 0.00 179.25 181.83 3dbk h GLN 277 N 0.47 1.21 -0.47 0.00 4.20 -0.89 0.17 115.11 119.79 3dbk h GLN 277 Ca 0.13 -0.11 0.00 0.00 0.06 0.00 0.00 58.65 58.73 3dbk h GLN 277 Cb 0.16 -0.25 -0.02 0.00 0.30 0.00 0.00 27.48 27.66 3dbk h GLN 277 CO -0.01 0.84 0.30 -0.91 -0.67 0.00 0.00 178.83 178.37 3dbk h ASN 278 N 1.22 0.55 -0.48 1.46 -0.26 -0.79 -1.61 115.58 115.67 3dbk h ASN 278 Ca 0.32 -0.02 0.00 0.00 -0.56 0.00 0.00 56.30 56.04 3dbk h ASN 278 Cb -0.06 -0.14 0.00 0.00 -1.06 0.00 0.00 38.32 37.06 3dbk h ASN 278 CO -0.06 0.41 0.00 0.54 -1.06 0.00 0.00 177.43 177.26 3dbk n ARG 279 N -4.45 2.21 -2.73 0.81 1.74 -0.85 -4.92 116.66 108.47 3dbk n ARG 279 Ca 0.04 -1.86 -0.18 0.00 -0.77 0.00 0.00 57.85 55.07 3dbk n ARG 279 Cb 0.07 -1.42 0.02 0.00 -1.02 0.00 0.00 32.46 30.10 3dbk n ARG 279 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 3dbk n ASN 280 N 1.02 -5.34 -4.97 0.55 3.02 -0.61 -5.01 115.26 103.92 3dbk n ASN 280 Ca 0.18 -0.17 -0.19 0.00 -0.03 0.00 0.00 54.58 54.37 3dbk n ASN 280 Cb 0.45 -4.25 -0.01 0.00 -0.61 0.00 0.00 39.78 35.36 3dbk n ASN 280 CO 0.00 0.00 0.00 -0.31 -2.62 0.00 0.00 177.26 174.33 3dbk s TYR 281 N -3.02 2.94 -0.36 3.10 2.02 0.53 -5.01 117.35 117.56 3dbk s TYR 281 Ca 0.18 -0.32 -0.29 0.00 -0.37 0.00 0.00 57.07 56.28 3dbk s TYR 281 Cb -0.08 -2.12 -0.01 0.00 -0.40 0.00 0.00 41.96 39.36 3dbk s TYR 281 CO 0.22 -0.14 1.64 0.45 -1.57 0.00 0.00 175.55 176.16 3dbk s SER 282 N -4.21 6.08 0.29 2.29 0.15 -1.26 -4.10 113.70 112.94 3dbk s SER 282 Ca 0.48 1.14 0.03 0.00 0.70 0.00 0.00 55.95 58.30 3dbk s SER 282 Cb -0.09 -2.53 0.45 0.00 -1.71 0.00 0.00 66.02 62.15 3dbk s SER 282 CO 0.31 -1.58 1.75 0.00 1.20 0.00 0.00 173.24 174.91 3dbk h ALA 283 N 11.95 1.15 -0.97 5.45 0.00 -1.87 -2.70 119.26 132.28 3dbk h ALA 283 Ca -0.31 -0.32 0.01 0.00 0.00 0.00 0.00 54.91 54.28 3dbk h ALA 283 Cb 1.14 -0.12 -0.05 0.00 0.00 0.00 0.00 17.79 18.76 3dbk h ALA 283 CO 1.05 0.54 0.63 0.00 0.00 0.00 0.00 179.25 181.46 3dbk h ALA 284 N 1.35 1.28 -0.66 0.00 0.00 -1.95 -0.10 119.26 119.18 3dbk h ALA 284 Ca 0.07 -0.08 -0.07 0.00 0.00 0.00 0.00 54.91 54.83 3dbk h ALA 284 Cb 0.62 -0.39 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 3dbk h ALA 284 CO 0.04 0.65 0.14 -0.44 0.00 0.00 0.00 179.25 179.65 3dbk h ASP 285 N 1.32 1.01 -0.28 0.00 3.32 -1.89 -0.13 116.42 119.77 3dbk h ASP 285 Ca 0.35 -0.22 -0.08 0.00 0.02 0.00 0.00 57.03 57.10 3dbk h ASP 285 Cb -0.13 -0.27 -0.01 0.00 0.22 0.00 0.00 39.33 39.15 3dbk h ASP 285 CO -0.07 0.98 -0.15 0.58 -1.72 0.00 0.00 179.24 178.85 3dbk h VAL 286 N 1.01 1.30 -0.75 -1.35 2.07 -1.31 -2.16 116.25 115.06 3dbk h VAL 286 Ca 0.21 -1.26 0.03 0.00 0.82 0.00 0.00 66.70 66.50 3dbk h VAL 286 Cb 0.38 1.52 -0.05 0.00 -1.52 0.00 0.00 31.29 31.63 3dbk h VAL 286 CO 0.01 0.40 0.47 0.74 0.02 0.00 0.00 177.57 179.21 3dbk h THR 287 N 0.33 1.10 -0.49 2.57 2.02 -0.79 -2.11 112.91 115.55 3dbk h THR 287 Ca 0.06 -0.32 -0.03 0.00 0.77 0.00 0.00 66.41 66.89 3dbk h THR 287 Cb 0.68 0.10 -0.02 0.00 -1.74 0.00 0.00 68.15 67.17 3dbk h THR 287 CO 0.04 0.17 0.17 -0.09 0.37 0.00 0.00 175.52 176.19 3dbk h ARG 288 N 0.92 0.74 -0.38 6.66 2.43 -0.91 -0.09 114.38 123.75 3dbk h ARG 288 Ca 0.30 -0.15 0.02 0.00 -0.81 0.00 0.00 59.98 59.35 3dbk h ARG 288 Cb 0.02 -0.11 -0.03 0.00 -0.42 0.00 0.00 29.97 29.43 3dbk h ARG 288 CO -0.11 0.68 0.20 0.00 -1.51 0.00 0.00 179.97 179.23 3dbk h ALA 289 N 1.02 0.47 -0.40 2.80 0.00 -1.00 -1.10 119.26 121.05 3dbk h ALA 289 Ca 0.16 0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.99 3dbk h ALA 289 Cb 0.23 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 3dbk h ALA 289 CO -0.01 -0.15 -0.07 0.74 0.00 0.00 0.00 179.25 179.76 3dbk h PHE 290 N 0.41 0.84 -0.86 0.00 0.04 -1.21 -3.02 116.94 113.14 3dbk h PHE 290 Ca 0.16 -0.17 0.05 0.00 2.80 0.00 0.00 57.97 60.80 3dbk h PHE 290 Cb 0.04 -0.21 -0.05 0.00 2.20 0.00 0.00 35.95 37.93 3dbk h PHE 290 CO -0.09 0.87 0.56 1.03 -0.60 0.00 0.00 178.31 180.08 3dbk h SER 291 N 0.57 0.89 -0.89 2.17 0.87 -0.72 0.09 113.55 116.52 3dbk h SER 291 Ca 0.10 -0.00 0.06 0.00 -1.23 0.00 0.00 61.79 60.72 3dbk h SER 291 Cb 0.58 -0.20 -0.06 0.00 -0.44 0.00 0.00 62.40 62.28 3dbk h SER 291 CO 0.03 0.60 0.58 0.74 -0.53 0.00 0.00 176.83 178.25 3dbk h THR 292 N 1.03 1.07 -0.54 2.23 2.02 -1.07 -1.78 112.91 115.87 3dbk h THR 292 Ca 0.35 -0.35 0.00 0.00 0.77 0.00 0.00 66.41 67.18 3dbk h THR 292 Cb 0.09 -0.04 0.00 0.00 -1.74 0.00 0.00 68.15 66.46 3dbk h THR 292 CO -0.11 0.19 0.00 1.33 0.37 0.00 0.00 175.52 177.29 3dbk n VAL 293 N -4.48 1.19 -0.81 3.16 0.24 -0.70 -4.93 118.33 112.00 3dbk n VAL 293 Ca 0.13 -0.87 0.00 0.00 -2.04 0.00 0.00 64.34 61.57 3dbk n VAL 293 Cb 0.19 0.16 0.00 0.00 -1.47 0.00 0.00 33.84 32.72 3dbk n VAL 293 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3dbk n GLY 294 N 1.13 0.54 3.46 7.63 0.00 -0.67 -0.92 105.19 116.35 3dbk n GLY 294 Ca 0.20 -0.84 -0.33 0.00 0.00 0.00 0.00 46.02 45.05 3dbk n GLY 294 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3dbk s VAL 295 N -2.00 3.41 -0.03 1.61 1.01 -0.07 -4.63 120.40 119.71 3dbk s VAL 295 Ca 0.00 -0.55 0.00 0.00 0.00 0.00 0.00 61.98 61.43 3dbk s VAL 295 Cb 0.00 -2.44 0.03 0.00 0.00 0.00 0.00 36.38 33.97 3dbk s VAL 295 CO 0.00 0.54 0.01 -0.89 0.00 0.00 0.00 175.10 174.76 3dbk s THR 296 N 0.03 0.08 -0.07 3.92 2.01 -1.26 -2.71 115.64 117.64 3dbk s THR 296 Ca -0.03 0.14 -0.30 0.00 0.31 0.00 0.00 61.69 61.82 3dbk s THR 296 Cb -0.14 -0.19 -0.04 0.00 0.01 0.00 0.00 72.50 72.13 3dbk s THR 296 CO 0.04 0.12 1.49 0.00 -0.69 0.00 0.00 174.62 175.58