#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2o30 n LYS 6 N 0.00 0.13 -3.77 0.00 5.02 -1.26 -4.99 118.16 113.29 2o30 n LYS 6 Ca 0.00 -0.02 -0.08 0.00 -2.02 0.00 0.00 58.31 56.19 2o30 n LYS 6 Cb 0.00 -1.53 -0.02 0.00 -0.02 0.00 0.00 35.03 33.46 2o30 n LYS 6 CO 0.00 0.00 0.00 1.52 -0.52 0.00 0.00 177.40 178.40 2o30 s TYR 7 N -3.09 -0.26 0.26 2.13 1.13 -1.26 -4.61 117.35 111.64 2o30 s TYR 7 Ca 0.06 -0.15 0.04 0.00 -1.41 0.00 0.00 57.07 55.61 2o30 s TYR 7 Cb 0.16 0.68 -0.06 0.00 -1.10 0.00 0.00 41.96 41.64 2o30 s TYR 7 CO 0.82 -1.16 0.00 0.95 -2.51 0.00 0.00 175.55 173.66 2o30 s THR 8 N -3.89 1.16 0.12 -3.49 -4.23 -0.32 -4.98 115.64 100.00 2o30 s THR 8 Ca 0.09 -2.04 -0.11 0.00 -1.18 0.00 0.00 61.69 58.45 2o30 s THR 8 Cb -0.05 -2.46 0.01 0.00 1.34 0.00 0.00 72.50 71.34 2o30 s THR 8 CO 0.03 -0.25 0.28 -1.66 -0.54 0.00 0.00 174.62 172.49 2o30 s TRP 9 N -3.33 0.09 0.30 3.99 1.48 -1.26 -0.79 118.94 119.42 2o30 s TRP 9 Ca 0.31 -0.47 -0.08 0.00 -1.06 0.00 0.00 56.10 54.79 2o30 s TRP 9 Cb 0.06 0.05 0.00 0.00 -1.16 0.00 0.00 33.47 32.43 2o30 s TRP 9 CO 0.11 -0.64 0.50 0.16 -4.06 0.00 0.00 176.95 173.02 2o30 s ASP 10 N -2.87 0.35 0.02 -2.66 1.47 -0.23 -5.00 116.67 107.75 2o30 s ASP 10 Ca 0.07 -1.20 -0.09 0.00 1.18 0.00 0.00 52.55 52.51 2o30 s ASP 10 Cb 0.03 0.64 0.00 0.00 -0.34 0.00 0.00 42.92 43.26 2o30 s ASP 10 CO -0.09 -1.26 0.17 0.00 0.68 0.00 0.00 175.17 174.67 2o30 s GLN 11 N -3.42 0.58 0.49 2.11 -2.07 -1.26 -1.06 119.66 115.02 2o30 s GLN 11 Ca 0.26 -0.49 0.07 0.00 -1.82 0.00 0.00 55.36 53.38 2o30 s GLN 11 Cb -0.01 0.24 0.01 0.00 -1.09 0.00 0.00 33.01 32.17 2o30 s GLN 11 CO 0.14 -0.15 0.42 -1.21 -1.32 0.00 0.00 175.29 173.17 2o30 s GLU 12 N -1.86 2.37 0.41 9.60 2.02 -0.03 -4.98 118.70 126.22 2o30 s GLU 12 Ca -0.11 -1.77 0.10 0.00 0.02 0.00 0.00 54.97 53.22 2o30 s GLU 12 Cb -0.05 -2.26 0.91 0.00 0.10 0.00 0.00 34.13 32.83 2o30 s GLU 12 CO -0.00 -0.44 1.97 1.25 0.02 0.00 0.00 175.26 178.06 2o30 h LEU 13 N 0.84 0.48 -2.41 1.80 5.85 -1.99 -2.87 115.31 117.02 2o30 h LEU 13 Ca -0.38 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.34 2o30 h LEU 13 Cb 1.28 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 42.22 2o30 h LEU 13 CO 0.56 0.30 0.00 -0.46 -0.34 0.00 0.00 178.44 178.50 2o30 n ASN 14 N -4.48 2.48 -3.76 1.25 6.94 -1.26 -2.87 115.26 113.56 2o30 n ASN 14 Ca 0.10 -1.81 -0.13 0.00 -0.02 0.00 0.00 54.58 52.72 2o30 n ASN 14 Cb 0.30 -0.14 -0.08 0.00 -2.36 0.00 0.00 39.78 37.51 2o30 n ASN 14 CO 0.00 0.00 0.00 -1.83 -1.03 0.00 0.00 177.26 174.40 2o30 s GLU 15 N -0.94 0.73 -0.05 -3.83 -1.05 -1.09 -0.01 118.70 112.47 2o30 s GLU 15 Ca 0.17 -0.33 0.04 0.00 -0.15 0.00 0.00 54.97 54.70 2o30 s GLU 15 Cb 0.10 0.32 -0.02 0.00 -0.44 0.00 0.00 34.13 34.08 2o30 s GLU 15 CO 0.13 -0.22 -0.16 0.42 0.95 0.00 0.00 175.26 176.38 2o30 s ILE 16 N -1.88 2.92 -0.05 1.83 -1.09 -0.09 -0.85 121.20 122.00 2o30 s ILE 16 Ca -0.10 -0.77 0.05 0.00 -2.23 0.00 0.00 60.65 57.60 2o30 s ILE 16 Cb -0.03 -2.14 -0.00 0.00 -1.58 0.00 0.00 42.46 38.71 2o30 s ILE 16 CO 0.01 0.58 -0.19 0.20 -1.23 0.00 0.00 174.94 174.31 2o30 s ASN 17 N -0.61 2.39 0.00 3.58 0.01 -0.22 -1.50 114.94 118.59 2o30 s ASN 17 Ca 0.09 -0.40 0.06 0.00 -0.71 0.00 0.00 52.86 51.90 2o30 s ASN 17 Cb -0.11 -0.68 -0.02 0.00 0.41 0.00 0.00 41.25 40.85 2o30 s ASN 17 CO 0.01 0.17 -0.18 -0.63 -1.51 0.00 0.00 177.10 174.97 2o30 s ILE 18 N 0.01 1.40 -0.00 0.60 1.01 0.14 -1.07 121.20 123.28 2o30 s ILE 18 Ca -0.04 -0.85 0.04 0.00 0.00 0.00 0.00 60.65 59.80 2o30 s ILE 18 Cb -0.12 -1.18 -0.01 0.00 0.01 0.00 0.00 42.46 41.16 2o30 s ILE 18 CO 0.03 0.32 -0.12 -1.10 0.00 0.00 0.00 174.94 174.06 2o30 s GLN 19 N -0.61 0.97 0.10 2.79 1.11 0.03 -0.43 119.66 123.62 2o30 s GLN 19 Ca 0.06 -0.50 -0.16 0.00 0.01 0.00 0.00 55.36 54.78 2o30 s GLN 19 Cb -0.07 -0.94 0.03 0.00 -1.01 0.00 0.00 33.01 31.02 2o30 s GLN 19 CO -0.00 0.25 0.38 -0.59 0.01 0.00 0.00 175.29 175.35 2o30 s PHE 20 N -0.40 -0.18 0.26 0.91 -0.71 -0.88 -1.18 117.98 115.80 2o30 s PHE 20 Ca 0.04 -0.08 -0.26 0.00 -1.04 0.00 0.00 56.93 55.59 2o30 s PHE 20 Cb -0.05 0.22 -0.09 0.00 -1.21 0.00 0.00 43.02 41.88 2o30 s PHE 20 CO -0.00 -0.66 0.89 -1.25 -1.34 0.00 0.00 175.22 172.86 2o30 s PRO 21 N -3.50 4.62 -0.02 1.99 0.04 -1.26 -0.47 135.00 136.41 2o30 s PRO 21 Ca 0.01 1.29 -0.30 0.00 0.04 0.00 0.00 61.00 62.04 2o30 s PRO 21 Cb 0.01 -3.03 -0.04 0.00 0.04 0.00 0.00 34.50 31.49 2o30 s PRO 21 CO -0.10 0.41 1.19 0.08 0.04 0.00 0.00 177.00 178.63 2o30 s VAL 22 N -1.40 4.21 -0.37 -0.36 1.01 0.54 -4.86 120.40 119.18 2o30 s VAL 22 Ca 0.44 1.56 -0.10 0.00 0.00 0.00 0.00 61.98 63.89 2o30 s VAL 22 Cb -0.21 -4.00 0.03 0.00 0.00 0.00 0.00 36.38 32.20 2o30 s VAL 22 CO 0.26 0.04 0.18 0.28 0.00 0.00 0.00 175.10 175.86 2o30 s THR 23 N 1.82 4.32 0.00 3.92 -1.32 -1.26 -4.96 115.64 118.15 2o30 s THR 23 Ca 0.57 -0.97 0.00 0.00 -1.21 0.00 0.00 61.69 60.08 2o30 s THR 23 Cb -0.26 -3.43 0.00 0.00 -1.51 0.00 0.00 72.50 67.30 2o30 s THR 23 CO 0.24 -0.23 0.99 0.61 -2.21 0.00 0.00 174.62 174.02 2o30 n GLY 24 N 4.94 0.51 5.67 6.08 0.00 -1.26 -4.76 105.19 116.37 2o30 n GLY 24 Ca -0.12 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.90 2o30 n GLY 24 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2o30 n SER 29 N 0.00 0.00 0.07 1.61 7.64 -1.26 -5.15 113.62 116.54 2o30 n SER 29 Ca 0.00 0.00 -0.06 0.00 1.01 0.00 0.00 58.87 59.82 2o30 n SER 29 Cb 0.70 0.00 -0.10 0.00 -1.01 0.00 0.00 64.21 63.80 2o30 n SER 29 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2o30 h ALA 30 N -0.33 0.40 -2.80 -0.43 0.00 -1.96 -3.44 119.26 110.70 2o30 h ALA 30 Ca 0.00 -0.86 -0.66 0.00 0.00 0.00 0.00 54.91 53.39 2o30 h ALA 30 Cb 0.00 -0.15 -0.18 0.00 0.00 0.00 0.00 17.79 17.45 2o30 h ALA 30 CO 0.00 1.18 -0.50 0.42 0.00 0.00 0.00 179.25 180.35 2o30 s ILE 31 N -2.76 5.23 -0.18 0.00 1.01 -1.26 -0.92 121.20 122.32 2o30 s ILE 31 Ca 0.01 -0.09 0.01 0.00 0.00 0.00 0.00 60.65 60.58 2o30 s ILE 31 Cb 0.10 -3.61 0.02 0.00 0.01 0.00 0.00 42.46 38.98 2o30 s ILE 31 CO 0.81 0.10 -0.19 -0.54 0.00 0.00 0.00 174.94 175.12 2o30 s LYS 32 N 1.73 2.84 -0.06 2.79 1.02 -0.56 -5.00 119.74 122.50 2o30 s LYS 32 Ca 0.06 -0.84 0.01 0.00 0.02 0.00 0.00 55.97 55.23 2o30 s LYS 32 Cb -0.17 -2.54 0.02 0.00 -0.52 0.00 0.00 37.83 34.62 2o30 s LYS 32 CO 0.10 -0.24 -0.06 0.42 -0.92 0.00 0.00 175.35 174.65 2o30 s ILE 33 N 1.30 0.70 0.20 2.17 1.01 -1.26 -0.51 121.20 124.81 2o30 s ILE 33 Ca 0.04 -0.20 0.04 0.00 0.00 0.00 0.00 60.65 60.53 2o30 s ILE 33 Cb -0.14 -0.70 -0.01 0.00 0.01 0.00 0.00 42.46 41.62 2o30 s ILE 33 CO -0.12 0.27 0.14 -1.14 0.00 0.00 0.00 174.94 174.09 2o30 n ARG 34 N 4.15 0.34 0.00 2.79 0.63 -0.23 -5.02 116.66 119.31 2o30 n ARG 34 Ca -0.22 -1.91 0.00 0.00 -0.92 0.00 0.00 57.85 54.80 2o30 n ARG 34 Cb 0.51 1.45 0.00 0.00 0.45 0.00 0.00 32.46 34.87 2o30 n ARG 34 CO 0.00 0.00 0.00 0.28 -2.51 0.00 0.00 177.63 175.40 2o30 n VAL 36 N -0.40 0.00 0.00 5.15 0.31 -0.67 -1.05 118.33 121.67 2o30 n VAL 36 Ca 0.03 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.36 2o30 n VAL 36 Cb 0.35 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.28 2o30 n VAL 36 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 2o30 n GLY 37 N 0.00 4.02 0.15 2.92 0.00 -1.26 -1.13 105.19 109.88 2o30 n GLY 37 Ca 0.00 0.10 0.11 0.00 0.00 0.00 0.00 46.02 46.24 2o30 n GLY 37 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2o30 n LYS 38 N 14.00 0.40 -2.37 1.61 5.02 -1.26 -4.71 118.16 130.85 2o30 n LYS 38 Ca 0.00 -0.30 -0.41 0.00 -2.02 0.00 0.00 58.31 55.58 2o30 n LYS 38 Cb 0.00 -1.49 -0.03 0.00 -0.02 0.00 0.00 35.03 33.48 2o30 n LYS 38 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2o30 s LYS 39 N -2.80 4.47 -0.04 1.97 -0.14 -0.29 -0.21 119.74 122.70 2o30 s LYS 39 Ca 0.14 1.87 0.02 0.00 -1.36 0.00 0.00 55.97 56.63 2o30 s LYS 39 Cb 0.17 -3.26 0.02 0.00 -1.68 0.00 0.00 37.83 33.07 2o30 s LYS 39 CO 0.70 -0.15 -0.07 -1.50 -0.76 0.00 0.00 175.35 173.57 2o30 s ILE 40 N 0.28 0.72 -0.09 2.17 2.07 0.51 -1.67 121.20 125.19 2o30 s ILE 40 Ca 0.55 -0.25 0.01 0.00 -1.41 0.00 0.00 60.65 59.54 2o30 s ILE 40 Cb -0.32 -0.69 0.02 0.00 0.13 0.00 0.00 42.46 41.60 2o30 s ILE 40 CO 0.34 0.25 -0.09 0.00 -1.91 0.00 0.00 174.94 173.54 2o30 s VAL 42 N 1.26 0.98 0.11 0.00 1.01 0.14 -1.07 120.40 122.83 2o30 s VAL 42 Ca -0.04 -0.30 0.08 0.00 0.00 0.00 0.00 61.98 61.73 2o30 s VAL 42 Cb -0.14 -0.98 -0.04 0.00 0.00 0.00 0.00 36.38 35.23 2o30 s VAL 42 CO -0.03 0.35 -0.21 -0.54 0.00 0.00 0.00 175.10 174.67 2o30 s LYS 43 N 1.41 1.13 -0.16 2.72 1.02 0.34 -0.17 119.74 126.03 2o30 s LYS 43 Ca -0.01 -1.18 -0.02 0.00 0.02 0.00 0.00 55.97 54.78 2o30 s LYS 43 Cb -0.13 -1.37 0.05 0.00 -0.52 0.00 0.00 37.83 35.85 2o30 s LYS 43 CO -0.05 0.32 0.02 1.21 -0.92 0.00 0.00 175.35 175.93 2o30 s ASN 44 N -1.98 2.56 -1.53 2.83 2.47 0.56 -1.49 114.94 118.35 2o30 s ASN 44 Ca 0.07 -0.62 -0.12 0.00 0.42 0.00 0.00 52.86 52.62 2o30 s ASN 44 Cb -0.10 -0.58 0.08 0.00 -1.45 0.00 0.00 41.25 39.20 2o30 s ASN 44 CO 0.04 -0.27 0.87 0.00 -3.72 0.00 0.00 177.10 174.03 2o30 n GLN 45 N 5.06 -4.83 0.00 0.43 6.02 -0.10 -1.28 117.38 122.68 2o30 n GLN 45 Ca -0.09 0.54 0.00 0.00 -0.01 0.00 0.00 57.00 57.44 2o30 n GLN 45 Cb 0.48 -5.30 0.00 0.00 1.02 0.00 0.00 30.24 26.44 2o30 n GLN 45 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2o30 n GLY 46 N -1.64 3.01 3.72 1.08 0.00 -1.26 -5.02 105.19 105.08 2o30 n GLY 46 Ca -0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 2o30 n GLY 46 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2o30 s GLU 47 N -0.21 4.67 0.02 1.61 8.01 -0.40 -5.02 118.70 127.37 2o30 s GLU 47 Ca 0.00 1.45 -0.30 0.00 0.01 0.00 0.00 54.97 56.13 2o30 s GLU 47 Cb 0.00 -3.39 -0.05 0.00 -4.31 0.00 0.00 34.13 26.38 2o30 s GLU 47 CO 0.00 0.15 1.20 0.42 0.01 0.00 0.00 175.26 177.04 2o30 s ILE 48 N 0.22 4.12 -0.23 -1.63 1.01 -1.26 -0.33 121.20 123.11 2o30 s ILE 48 Ca 0.48 1.50 -0.19 0.00 0.00 0.00 0.00 60.65 62.45 2o30 s ILE 48 Cb -0.23 -3.96 -0.17 0.00 0.01 0.00 0.00 42.46 38.11 2o30 s ILE 48 CO 0.30 0.07 0.04 0.52 0.00 0.00 0.00 174.94 175.86 2o30 n VAL 49 N 4.20 1.54 -3.86 2.92 0.31 0.76 -4.92 118.33 119.30 2o30 n VAL 49 Ca 0.10 -0.16 -0.12 0.00 -0.01 0.00 0.00 64.34 64.14 2o30 n VAL 49 Cb 0.46 -1.98 -0.14 0.00 -0.91 0.00 0.00 33.84 31.28 2o30 n VAL 49 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 2o30 s ILE 50 N -2.42 -0.01 -0.33 2.52 1.01 -1.03 -4.74 121.20 116.21 2o30 s ILE 50 Ca -0.32 0.03 0.00 0.00 0.00 0.00 0.00 60.65 60.36 2o30 s ILE 50 Cb 0.09 -0.03 0.14 0.00 0.01 0.00 0.00 42.46 42.67 2o30 s ILE 50 CO 0.57 0.01 0.28 -0.62 0.00 0.00 0.00 174.94 175.18 2o30 s ASP 51 N 0.13 2.03 0.00 3.58 2.15 -1.25 -0.68 116.67 122.63 2o30 s ASP 51 Ca -0.01 -1.38 0.00 0.00 0.43 0.00 0.00 52.55 51.59 2o30 s ASP 51 Cb -0.02 0.22 0.00 0.00 -0.30 0.00 0.00 42.92 42.83 2o30 s ASP 51 CO -0.00 -0.34 0.00 0.61 -0.17 0.00 0.00 175.17 175.27 2o30 n GLY 52 N 4.70 2.48 2.90 2.66 0.00 -0.56 -5.01 105.19 112.36 2o30 n GLY 52 Ca 0.04 -0.57 -0.23 0.00 0.00 0.00 0.00 46.02 45.27 2o30 n GLY 52 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2o30 s GLU 53 N 1.46 1.11 0.68 1.61 2.12 -1.26 -0.36 118.70 124.07 2o30 s GLU 53 Ca 0.00 -0.16 -0.16 0.00 0.36 0.00 0.00 54.97 55.01 2o30 s GLU 53 Cb 0.00 -1.13 0.01 0.00 0.26 0.00 0.00 34.13 33.27 2o30 s GLU 53 CO 0.00 -0.13 1.18 -0.51 -0.54 0.00 0.00 175.26 175.26 2o30 s LEU 54 N 1.20 3.41 0.20 2.70 1.43 0.71 -0.94 118.68 127.38 2o30 s LEU 54 Ca -0.06 2.27 -0.09 0.00 -1.03 0.00 0.00 54.13 55.22 2o30 s LEU 54 Cb -0.14 -4.58 0.13 0.00 0.03 0.00 0.00 46.19 41.62 2o30 s LEU 54 CO -0.02 -1.96 1.76 0.25 0.23 0.00 0.00 176.35 176.61 2o30 h LEU 55 N 0.05 1.00 -9.01 1.79 5.85 -1.38 -3.39 115.31 110.21 2o30 h LEU 55 Ca -0.48 -0.18 -0.42 0.00 0.84 0.00 0.00 57.88 57.65 2o30 h LEU 55 Cb 1.28 -0.26 -0.14 0.00 0.37 0.00 0.00 40.66 41.91 2o30 h LEU 55 CO 0.52 0.91 -0.57 -1.00 -0.34 0.00 0.00 178.44 177.96 2o30 s HIS 56 N -5.53 1.62 0.37 1.25 3.76 -1.26 -4.89 115.29 110.61 2o30 s HIS 56 Ca -0.12 -1.29 -0.26 0.00 -0.15 0.00 0.00 55.06 53.24 2o30 s HIS 56 Cb 0.15 -0.92 -0.09 0.00 1.11 0.00 0.00 32.58 32.82 2o30 s HIS 56 CO 0.82 -0.42 1.12 -1.21 -0.85 0.00 0.00 174.74 174.21 2o30 s GLU 57 N -3.87 4.25 0.26 1.40 2.02 -1.26 -4.94 118.70 116.56 2o30 s GLU 57 Ca 0.35 1.75 0.08 0.00 0.02 0.00 0.00 54.97 57.17 2o30 s GLU 57 Cb 0.06 -2.79 -0.05 0.00 0.10 0.00 0.00 34.13 31.45 2o30 s GLU 57 CO 0.16 -0.13 -0.11 0.14 0.02 0.00 0.00 175.26 175.35 2o30 s VAL 58 N -1.41 1.81 -0.85 2.63 -7.23 -1.26 -1.37 120.40 112.72 2o30 s VAL 58 Ca 0.54 -2.20 -0.24 0.00 -1.81 0.00 0.00 61.98 58.27 2o30 s VAL 58 Cb -0.29 -2.29 0.05 0.00 0.56 0.00 0.00 36.38 34.41 2o30 s VAL 58 CO 0.37 -0.42 1.30 -0.62 -0.31 0.00 0.00 175.10 175.42 2o30 s ASP 59 N -3.41 6.32 0.49 4.85 2.15 0.10 -4.73 116.67 122.44 2o30 s ASP 59 Ca 0.27 -1.00 0.16 0.00 0.43 0.00 0.00 52.55 52.41 2o30 s ASP 59 Cb 0.01 -2.54 1.18 0.00 -0.30 0.00 0.00 42.92 41.27 2o30 s ASP 59 CO 0.11 -1.62 2.08 0.58 -0.17 0.00 0.00 175.17 176.15 2o30 h VAL 60 N 6.30 0.96 0.00 1.11 2.07 -1.89 0.16 116.25 124.95 2o30 h VAL 60 Ca -0.07 -0.06 0.00 0.00 0.82 0.00 0.00 66.70 67.40 2o30 h VAL 60 Cb 1.04 0.78 0.00 0.00 -1.52 0.00 0.00 31.29 31.59 2o30 h VAL 60 CO 1.31 0.03 0.00 0.77 0.02 0.00 0.00 177.57 179.70 2o30 h SER 61 N 0.16 0.00 0.37 0.57 4.64 -1.98 -2.66 113.55 114.65 2o30 h SER 61 Ca 0.11 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.43 2o30 h SER 61 Cb 0.24 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.33 2o30 h SER 61 CO -0.02 0.00 -0.22 -1.54 -0.87 0.00 0.00 176.83 174.18 2o30 n SER 62 N -3.08 0.66 -4.67 4.97 3.41 0.04 -4.92 113.62 110.04 2o30 n SER 62 Ca -0.01 -0.58 -0.46 0.00 -0.26 0.00 0.00 58.87 57.56 2o30 n SER 62 Cb 0.19 0.03 -0.04 0.00 -0.26 0.00 0.00 64.21 64.13 2o30 n SER 62 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 2o30 n LEU 63 N -0.95 3.07 -3.80 1.04 7.94 -1.01 -4.62 117.00 118.68 2o30 n LEU 63 Ca 0.12 1.09 -0.12 0.00 -1.11 0.00 0.00 56.01 55.98 2o30 n LEU 63 Cb 0.32 -1.42 -0.09 0.00 0.53 0.00 0.00 43.42 42.75 2o30 n LEU 63 CO 0.26 -0.31 -0.05 0.86 -1.11 0.00 0.00 177.39 177.05 2o30 s TRP 64 N 0.87 -0.08 0.05 1.96 -0.11 -0.31 -5.01 118.94 116.31 2o30 s TRP 64 Ca 0.78 0.07 -0.12 0.00 1.22 0.00 0.00 56.10 58.05 2o30 s TRP 64 Cb -0.68 0.04 0.02 0.00 -1.50 0.00 0.00 33.47 31.34 2o30 s TRP 64 CO 0.38 -0.37 0.27 1.67 -4.62 0.00 0.00 176.95 174.29 2o30 s TRP 65 N -1.52 -0.05 0.17 5.86 1.48 -1.26 -0.62 118.94 122.99 2o30 s TRP 65 Ca -0.13 -0.13 -0.10 0.00 -1.06 0.00 0.00 56.10 54.68 2o30 s TRP 65 Cb -0.05 0.06 -0.00 0.00 -1.16 0.00 0.00 33.47 32.31 2o30 s TRP 65 CO 0.02 -0.50 0.31 0.14 -4.06 0.00 0.00 176.95 172.87 2o30 s VAL 66 N -2.70 0.06 -0.23 -0.66 -7.23 -0.72 -5.00 120.40 103.92 2o30 s VAL 66 Ca -0.04 -1.33 -0.07 0.00 -1.81 0.00 0.00 61.98 58.73 2o30 s VAL 66 Cb -0.00 -1.83 -0.03 0.00 0.56 0.00 0.00 36.38 35.08 2o30 s VAL 66 CO -0.04 -0.27 0.06 -0.63 -0.31 0.00 0.00 175.10 173.91 2o30 s ILE 67 N -3.96 4.35 -0.38 -0.62 1.01 -1.26 -0.75 121.20 119.59 2o30 s ILE 67 Ca 0.17 -0.16 -0.04 0.00 0.00 0.00 0.00 60.65 60.61 2o30 s ILE 67 Cb 0.03 -3.02 0.08 0.00 0.01 0.00 0.00 42.46 39.57 2o30 s ILE 67 CO 0.00 0.37 0.16 0.20 0.00 0.00 0.00 174.94 175.67 2o30 s ASN 68 N 1.34 5.27 1.60 3.58 -0.87 0.68 -4.98 114.94 121.57 2o30 s ASN 68 Ca 0.05 -1.66 0.00 0.00 -1.57 0.00 0.00 52.86 49.68 2o30 s ASN 68 Cb -0.15 -1.85 0.00 0.00 -0.02 0.00 0.00 41.25 39.24 2o30 s ASN 68 CO 0.03 -0.46 0.00 0.61 -2.57 0.00 0.00 177.10 174.71 2o30 n GLY 69 N 4.70 3.75 1.04 0.66 0.00 -1.26 -1.52 105.19 112.55 2o30 n GLY 69 Ca -0.07 0.21 0.09 0.00 0.00 0.00 0.00 46.02 46.25 2o30 n GLY 69 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2o30 n ASP 70 N 7.84 3.02 -4.18 1.61 2.03 -1.26 -4.92 116.55 120.71 2o30 n ASP 70 Ca 0.00 -1.98 -0.28 0.00 0.52 0.00 0.00 54.79 53.04 2o30 n ASP 70 Cb 0.00 -0.36 -0.16 0.00 -0.72 0.00 0.00 41.12 39.88 2o30 n ASP 70 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 2o30 s VAL 71 N -1.28 1.68 -0.12 5.18 1.01 -0.58 -0.34 120.40 125.95 2o30 s VAL 71 Ca 0.38 -0.84 -0.18 0.00 0.00 0.00 0.00 61.98 61.34 2o30 s VAL 71 Cb 0.20 -1.44 -0.04 0.00 0.00 0.00 0.00 36.38 35.10 2o30 s VAL 71 CO 0.26 0.48 0.46 -0.69 0.00 0.00 0.00 175.10 175.61 2o30 s VAL 72 N 0.09 5.20 -0.22 2.92 1.01 0.39 -0.23 120.40 129.56 2o30 s VAL 72 Ca -0.07 0.91 -0.04 0.00 0.00 0.00 0.00 61.98 62.78 2o30 s VAL 72 Cb -0.14 -3.80 -0.01 0.00 0.00 0.00 0.00 36.38 32.44 2o30 s VAL 72 CO 0.04 0.33 -0.05 -1.81 0.00 0.00 0.00 175.10 173.62 2o30 s ASP 73 N 0.59 4.27 -0.07 3.32 1.01 0.07 -2.06 116.67 123.80 2o30 s ASP 73 Ca 0.25 -0.39 0.02 0.00 0.71 0.00 0.00 52.55 53.13 2o30 s ASP 73 Cb -0.15 -1.73 -0.03 0.00 1.01 0.00 0.00 42.92 42.02 2o30 s ASP 73 CO 0.10 -0.01 -0.11 -0.69 0.21 0.00 0.00 175.17 174.66 2o30 s VAL 74 N 1.44 3.31 -0.01 -1.27 1.01 0.42 -1.76 120.40 123.56 2o30 s VAL 74 Ca 0.05 -0.62 0.02 0.00 0.00 0.00 0.00 61.98 61.44 2o30 s VAL 74 Cb -0.14 -2.34 -0.00 0.00 0.00 0.00 0.00 36.38 33.90 2o30 s VAL 74 CO -0.03 0.58 -0.06 0.21 0.00 0.00 0.00 175.10 175.80 2o30 s ASN 75 N -0.54 0.71 -0.02 3.32 3.84 0.21 -0.69 114.94 121.76 2o30 s ASN 75 Ca 0.08 -0.11 -0.08 0.00 0.21 0.00 0.00 52.86 52.95 2o30 s ASN 75 Cb -0.12 -0.09 0.01 0.00 -0.55 0.00 0.00 41.25 40.51 2o30 s ASN 75 CO 0.02 0.07 0.18 0.54 -2.79 0.00 0.00 177.10 175.12 2o30 s VAL 76 N -0.11 0.06 0.06 -5.21 0.11 -0.56 -1.16 120.40 113.59 2o30 s VAL 76 Ca 0.02 -0.48 -0.20 0.00 -2.93 0.00 0.00 61.98 58.38 2o30 s VAL 76 Cb -0.03 -0.42 -0.06 0.00 -1.53 0.00 0.00 36.38 34.34 2o30 s VAL 76 CO -0.00 -0.27 0.61 -0.89 -3.33 0.00 0.00 175.10 171.22 2o30 s THR 77 N -1.00 4.75 0.43 5.04 2.01 -1.26 -0.91 115.64 124.69 2o30 s THR 77 Ca -0.11 1.29 -0.23 0.00 0.31 0.00 0.00 61.69 62.96 2o30 s THR 77 Cb -0.06 -3.94 -0.09 0.00 0.01 0.00 0.00 72.50 68.42 2o30 s THR 77 CO 0.02 0.51 1.04 -0.54 -0.69 0.00 0.00 174.62 174.96 2o30 s LYS 78 N -0.82 4.06 0.14 4.92 1.02 0.98 -0.72 119.74 129.32 2o30 s LYS 78 Ca 0.31 1.45 -0.12 0.00 0.02 0.00 0.00 55.97 57.63 2o30 s LYS 78 Cb -0.20 -2.40 -0.00 0.00 -0.52 0.00 0.00 37.83 34.72 2o30 s LYS 78 CO 0.19 -0.22 1.56 0.87 -0.92 0.00 0.00 175.35 176.83 2o30 h LYS 79 N 2.20 0.87 -5.86 1.68 1.57 -1.51 -3.43 116.57 112.09 2o30 h LYS 79 Ca -0.49 -0.32 -0.68 0.00 -1.87 0.00 0.00 60.65 57.29 2o30 h LYS 79 Cb 1.22 -0.06 -0.28 0.00 0.08 0.00 0.00 32.23 33.19 2o30 h LYS 79 CO 0.61 0.96 -0.82 1.03 -0.57 0.00 0.00 179.45 180.66 2o30 s ARG 80 N -4.85 2.80 -0.91 3.15 0.52 -1.26 -5.05 118.95 113.35 2o30 s ARG 80 Ca -0.12 -0.79 -0.24 0.00 -0.52 0.00 0.00 55.73 54.05 2o30 s ARG 80 Cb 0.11 -2.36 0.03 0.00 0.52 0.00 0.00 34.95 33.26 2o30 s ARG 80 CO 0.83 0.39 1.48 -0.80 0.02 0.00 0.00 175.30 177.22 2o30 s ASN 81 N -0.14 6.19 -0.01 0.23 0.01 -1.26 -4.87 114.94 115.09 2o30 s ASN 81 Ca -0.03 -0.99 -0.22 0.00 -0.71 0.00 0.00 52.86 50.92 2o30 s ASN 81 Cb -0.14 -2.56 0.04 0.00 0.41 0.00 0.00 41.25 39.00 2o30 s ASN 81 CO 0.04 -1.78 0.48 -1.83 -1.51 0.00 0.00 177.10 172.49 2o30 s GLU 82 N 5.52 0.88 0.35 -0.60 -1.05 -1.14 -4.99 118.70 117.68 2o30 s GLU 82 Ca 0.47 -0.07 -0.27 0.00 -0.15 0.00 0.00 54.97 54.95 2o30 s GLU 82 Cb -0.04 0.40 -0.09 0.00 -0.44 0.00 0.00 34.13 33.97 2o30 s GLU 82 CO -0.00 -0.27 1.17 -1.58 0.95 0.00 0.00 175.26 175.53 2o30 s TRP 83 N -1.58 3.20 -0.17 4.83 0.52 -1.26 -4.84 118.94 119.65 2o30 s TRP 83 Ca -0.11 1.57 -0.07 0.00 0.02 0.00 0.00 56.10 57.51 2o30 s TRP 83 Cb -0.02 -3.41 -0.04 0.00 -1.15 0.00 0.00 33.47 28.84 2o30 s TRP 83 CO 0.05 -1.20 0.07 -1.58 0.02 0.00 0.00 176.95 174.30 2o30 s TRP 84 N -1.30 3.29 0.30 -1.98 0.52 -1.26 -5.00 118.94 113.52 2o30 s TRP 84 Ca 0.52 0.15 0.04 0.00 0.02 0.00 0.00 56.10 56.84 2o30 s TRP 84 Cb -0.32 -2.04 0.49 0.00 -1.15 0.00 0.00 33.47 30.45 2o30 s TRP 84 CO 0.42 0.27 1.77 -0.44 0.02 0.00 0.00 176.95 178.98 2o30 h ASP 85 N 6.32 0.44 -5.28 2.95 3.32 -1.99 -3.46 116.42 118.72 2o30 h ASP 85 Ca -0.41 -0.13 -0.11 0.00 0.02 0.00 0.00 57.03 56.40 2o30 h ASP 85 Cb 1.18 -0.12 -0.13 0.00 0.22 0.00 0.00 39.33 40.48 2o30 h ASP 85 CO 0.68 0.65 -0.34 -0.94 -1.72 0.00 0.00 179.24 177.57 2o30 s SER 86 N -6.81 0.05 0.02 6.45 1.04 -1.26 -5.07 113.70 108.13 2o30 s SER 86 Ca -0.07 -0.90 -0.19 0.00 0.48 0.00 0.00 55.95 55.28 2o30 s SER 86 Cb 0.14 0.43 -0.24 0.00 0.10 0.00 0.00 66.02 66.45 2o30 s SER 86 CO 0.78 -0.89 1.10 0.25 0.98 0.00 0.00 173.24 175.46 2o30 h LEU 87 N 2.56 0.62 -9.60 2.42 5.85 -1.97 -3.42 115.31 111.77 2o30 h LEU 87 Ca -0.32 -0.78 -0.57 0.00 0.84 0.00 0.00 57.88 57.05 2o30 h LEU 87 Cb 1.23 -0.19 -0.10 0.00 0.37 0.00 0.00 40.66 41.96 2o30 h LEU 87 CO 0.49 1.32 -0.62 -0.76 -0.34 0.00 0.00 178.44 178.52 2o30 s LEU 88 N -8.23 3.05 0.00 2.25 1.43 -1.26 -1.18 118.68 114.73 2o30 s LEU 88 Ca -0.12 -0.87 0.00 0.00 -1.03 0.00 0.00 54.13 52.10 2o30 s LEU 88 Cb 0.04 -1.49 0.00 0.00 0.03 0.00 0.00 46.19 44.77 2o30 s LEU 88 CO 0.85 -0.17 0.42 1.33 0.23 0.00 0.00 176.35 179.01